*HEADER    HYDROLASE                               27-SEP-00   1E8L
*TITLE     NMR SOLUTION STRUCTURE OF HEN LYSOZYME
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: LYSOZYME;
*COMPND   3 CHAIN: A;
*COMPND   4 EC: 3.2.1.17;
*COMPND   5 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;
*SOURCE   3 ORGANISM_COMMON: CHICKEN;
*SOURCE   4 CELLULAR_LOCATION: EGG WHITE;
*SOURCE   5 EXPRESSION_SYSTEM: ASPERGILLUS NIGER;
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: TRANSFORMANT B1
*KEYWDS    HYDROLASE
*EXPDTA    NMR, 50 STRUCTURES
*AUTHOR    H.SCHWALBE,S.B.GRIMSHAW,A.SPENCER,M.BUCK,J.BOYD,
*AUTHOR   2 C.M.DOBSON,C.REDFIELD,L.J.SMITH
*REVDAT   1   09-OCT-00 1E8L    0




! NOE restraints
ASSIGN (RESID   1    AND NAME HA   ) (RESID   2    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID   2    AND NAME HN   ) (RESID   2    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   2    AND NAME HA   ) (RESID   2    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID   2    AND NAME HA   ) (RESID   2    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID   2    AND NAME HA   ) (RESID   2    AND NAME HG1# )   2.2  0.4  1.8
ASSIGN (RESID   2    AND NAME HA   ) (RESID   3    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID   2    AND NAME HA   ) (RESID  40    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   2    AND NAME HA   ) (RESID  39    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID   2    AND NAME HG2# ) (RESID  39    AND NAME HA   )   2.7  0.9  1.8
ASSIGN (RESID   2    AND NAME HG1# ) (RESID  39    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HN   ) (RESID   2    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID   2    AND NAME HN   ) (RESID   2    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID   2    AND NAME HN   ) (RESID   2    AND NAME HG1# )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HG2# ) (RESID   3    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HG1# ) (RESID   3    AND NAME HN   )   2.7  0.9  1.8
ASSIGN (RESID   2    AND NAME HG2# ) (RESID  38    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HG1# ) (RESID  38    AND NAME HN   )   2.7  0.9  1.8
ASSIGN (RESID   2    AND NAME HG2# ) (RESID  40    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HB   ) (RESID   2    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID   2    AND NAME HB   ) (RESID   2    AND NAME HG1# )   2.7  0.9  1.8
ASSIGN (RESID   2    AND NAME HN   ) (RESID  40    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID   2    AND NAME HG1# ) (RESID  40    AND NAME HN   )   5.2  3.4  1.8
ASSIGN (RESID   3    AND NAME HN   ) (RESID   3    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HA   ) (RESID   3    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HA   ) (RESID   3    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID   3    AND NAME HN   ) (RESID   3    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID   3    AND NAME HN   ) (RESID   3    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HD*  ) (RESID   3    AND NAME HE*  )   2.2  0.4  5.1
ASSIGN (RESID   3    AND NAME HB2  ) (RESID   3    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID   3    AND NAME HB1  ) (RESID   3    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID   3    AND NAME HD*  ) (RESID   8    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID   3    AND NAME HN   ) (RESID   3    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID   3    AND NAME HD*  ) (RESID   4    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID   3    AND NAME HD*  ) (RESID  40    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID   3    AND NAME HN   ) (RESID  39    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HB1  ) (RESID   8    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HD*  ) (RESID   7    AND NAME HB#  )   2.7  0.9  3.7
ASSIGN (RESID   3    AND NAME HD*  ) (RESID   8    AND NAME HD*  )   4.2  2.4  5.1
ASSIGN (RESID   3    AND NAME HZ   ) (RESID   8    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID   3    AND NAME HB2  ) (RESID   8    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID   3    AND NAME HD*  ) (RESID  88    AND NAME HG2# )   4.2  2.4  4.2
ASSIGN (RESID   3    AND NAME HE*  ) (RESID  88    AND NAME HG2# )   2.7  0.9  4.2
ASSIGN (RESID   3    AND NAME HZ   ) (RESID  88    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID   3    AND NAME HE*  ) (RESID  55    AND NAME HB   )   2.7  0.9  2.7
ASSIGN (RESID   3    AND NAME HD*  ) (RESID  55    AND NAME HB   )   2.7  0.9  2.7
ASSIGN (RESID   3    AND NAME HE*  ) (RESID  39    AND NAME HA   )   7.2  5.4  2.7
ASSIGN (RESID   3    AND NAME HN   ) (RESID  40    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID   3    AND NAME HB2  ) (RESID  38    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID   3    AND NAME HB2  ) (RESID  88    AND NAME HD#  )   5.2  3.4  1.8
ASSIGN (RESID   3    AND NAME HN   ) (RESID   4    AND NAME HA#  )   5.2  3.4  1.3
ASSIGN (RESID   3    AND NAME HE*  ) (RESID  40    AND NAME HN   )   5.2  3.4  2.7
ASSIGN (RESID   3    AND NAME HE*  ) (RESID  88    AND NAME HD#  )   5.2  3.4  4.2
ASSIGN (RESID   3    AND NAME HD*  ) (RESID  88    AND NAME HD#  )   5.2  3.4  4.2
ASSIGN (RESID   4    AND NAME HN   ) (RESID   4    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID   4    AND NAME HA#  ) (RESID   5    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID   7    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID   5    AND NAME HN   ) (RESID   5    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID   6    AND NAME HA   ) (RESID   6    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HA   ) (RESID   6    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID   6    AND NAME HA   ) (RESID   9    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HA   ) (RESID  10    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HN   ) (RESID   6    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID   6    AND NAME HN   ) (RESID   6    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HB1  ) (RESID 127    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HA   ) (RESID   9    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID   6    AND NAME HN   ) (RESID   6    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HB1  ) (RESID   7    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HN   ) (RESID   7    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID   7    AND NAME HN   ) (RESID   7    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID   7    AND NAME HN   ) (RESID   7    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID   7    AND NAME HA   ) (RESID   7    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID   7    AND NAME HA   ) (RESID  11    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   7    AND NAME HA   ) (RESID  10    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   7    AND NAME HA   ) (RESID  10    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID   7    AND NAME HB#  ) (RESID   8    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID   7    AND NAME HN   ) (RESID   8    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID   8    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID   8    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID   8    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID   8    AND NAME HA   ) (RESID   8    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   8    AND NAME HA   ) (RESID   8    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   8    AND NAME HA   ) (RESID   8    AND NAME HD*  )   2.2  0.4  2.7
ASSIGN (RESID   8    AND NAME HN   ) (RESID   8    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID   8    AND NAME HA   ) (RESID  11    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   8    AND NAME HA   ) (RESID   9    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID   9    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID  10    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   8    AND NAME HA   ) (RESID  11    AND NAME HB#  )   2.7  0.9  1.8
ASSIGN (RESID   8    AND NAME HB#  ) (RESID   9    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID   8    AND NAME HD*  ) (RESID  12    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID   8    AND NAME HD*  ) (RESID   9    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID   8    AND NAME HD*  ) (RESID  12    AND NAME HE#  )   2.2  0.4  2.7
ASSIGN (RESID   8    AND NAME HD*  ) (RESID  88    AND NAME HD#  )   4.2  2.4  4.2
ASSIGN (RESID   8    AND NAME HD*  ) (RESID  88    AND NAME HG2# )   4.2  2.4  4.2
ASSIGN (RESID   8    AND NAME HG   ) (RESID   8    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID   8    AND NAME HD*  ) (RESID  38    AND NAME HE*  )   2.2  0.4  5.1
ASSIGN (RESID   9    AND NAME HN   ) (RESID   9    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID   9    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID   9    AND NAME HA   ) (RESID   9    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID   9    AND NAME HA   ) (RESID  12    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   9    AND NAME HA   ) (RESID  10    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID  10    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID  11    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID 129    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID   9    AND NAME HB#  ) (RESID 124    AND NAME HG2# )   2.2  0.4  3.3
ASSIGN (RESID  10    AND NAME HN   ) (RESID  10    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  10    AND NAME HN   ) (RESID  10    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  10    AND NAME HA   ) (RESID  10    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  10    AND NAME HA   ) (RESID  12    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  10    AND NAME HA   ) (RESID  11    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  10    AND NAME HN   ) (RESID  11    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  10    AND NAME HN   ) (RESID  12    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  10    AND NAME HN   ) (RESID 129    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  10    AND NAME HA   ) (RESID 129    AND NAME HD*  )   2.2  0.4  2.7
ASSIGN (RESID  11    AND NAME HN   ) (RESID  11    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  11    AND NAME HN   ) (RESID  11    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  11    AND NAME HA   ) (RESID  11    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  11    AND NAME HA   ) (RESID  12    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  11    AND NAME HN   ) (RESID  12    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  11    AND NAME HN   ) (RESID  13    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  11    AND NAME HB#  ) (RESID  12    AND NAME HN   )   2.2  0.4  1.8
ASSIGN (RESID  11    AND NAME HB#  ) (RESID  13    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  11    AND NAME HA   ) (RESID  14    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  11    AND NAME HB#  ) (RESID  88    AND NAME HD#  )   2.2  0.4  3.3
ASSIGN (RESID  11    AND NAME HN   ) (RESID  88    AND NAME HD#  )   5.2  3.4  1.8
ASSIGN (RESID  12    AND NAME HN   ) (RESID  12    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  12    AND NAME HA   ) (RESID  13    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  12    AND NAME HN   ) (RESID  13    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  12    AND NAME HA   ) (RESID  15    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  12    AND NAME HN   ) (RESID  88    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  12    AND NAME HA   ) (RESID  88    AND NAME HD#  )   2.7  0.9  1.8
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  88    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  17    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  12    AND NAME HA   ) (RESID  17    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  12    AND NAME HA   ) (RESID  17    AND NAME HG   )   4.2  2.4  0.3
ASSIGN (RESID  12    AND NAME HN   ) (RESID  17    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  12    AND NAME HN   ) (RESID  14    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  13    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  13    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  13    AND NAME HA   ) (RESID  13    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  14    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  13    AND NAME HA   ) (RESID  14    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID 129    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  13    AND NAME HB#  ) (RESID  14    AND NAME HN   )   2.7  0.9  1.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  25    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  13    AND NAME HN   ) (RESID  88    AND NAME HD#  )   5.2  3.4  1.8
ASSIGN (RESID  14    AND NAME HN   ) (RESID  14    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  14    AND NAME HN   ) (RESID  14    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  14    AND NAME HN   ) (RESID  15    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  15    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  15    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  15    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  15    AND NAME HA   ) (RESID  15    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  16    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  15    AND NAME HB2  ) (RESID  92    AND NAME HG1# )   2.7  0.9  1.8
ASSIGN (RESID  15    AND NAME HB2  ) (RESID  92    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  15    AND NAME HE1  ) (RESID  88    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID  15    AND NAME HE1  ) (RESID  88    AND NAME HD#  )   2.7  0.9  1.8
ASSIGN (RESID  15    AND NAME HE1  ) (RESID  92    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  15    AND NAME HE1  ) (RESID  92    AND NAME HG1# )   4.2  2.4  1.8
ASSIGN (RESID  16    AND NAME HN   ) (RESID  16    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  16    AND NAME HN   ) (RESID  17    AND NAME HD*  )   7.2  5.4  2.7
ASSIGN (RESID  16    AND NAME HN   ) (RESID  17    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  17    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  17    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  17    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HA   ) (RESID  17    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HA   ) (RESID  17    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HA   ) (RESID  17    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HN   ) (RESID  17    AND NAME HG   )   2.2  0.4  0.3
ASSIGN (RESID  17    AND NAME HG   ) (RESID  17    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  28    AND NAME HZ2  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  28    AND NAME HE3  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  28    AND NAME HH2  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  18    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  28    AND NAME HE1  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HA   ) (RESID  18    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  18    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  17    AND NAME HG   ) (RESID  18    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  28    AND NAME HZ3  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  92    AND NAME HG1# )   2.7  0.9  4.2
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  92    AND NAME HG2# )   2.7  0.9  4.2
ASSIGN (RESID  17    AND NAME HB#  ) (RESID  28    AND NAME HE3  )   4.2  2.4  1.3
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  28    AND NAME HD1  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HB#  ) (RESID  17    AND NAME HD*  )   4.2  2.4  3.7
ASSIGN (RESID  17    AND NAME HB#  ) (RESID  17    AND NAME HG   )   2.2  0.4  1.3
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  19    AND NAME HN   )   7.2  5.4  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  20    AND NAME HD*  )   4.2  2.4  5.1
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  20    AND NAME HB2  )   2.7  0.9  2.7
ASSIGN (RESID  17    AND NAME HB#  ) (RESID  28    AND NAME HZ3  )   5.2  3.4  1.3
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  92    AND NAME HB   )   5.2  3.4  2.7
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  88    AND NAME HD#  )   7.2  5.4  4.2
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  96    AND NAME HN   )   5.2  3.4  2.7
ASSIGN (RESID  17    AND NAME HA   ) (RESID  28    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  20    AND NAME HE*  )   7.2  5.4  5.1
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  55    AND NAME HG2# )   7.2  5.4  4.2
ASSIGN (RESID  18    AND NAME HN   ) (RESID  18    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  18    AND NAME HN   ) (RESID  18    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  18    AND NAME HN   ) (RESID  18    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  18    AND NAME HA   ) (RESID  18    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  18    AND NAME HA   ) (RESID  18    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  18    AND NAME HA   ) (RESID  19    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  18    AND NAME HN   ) (RESID  25    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  18    AND NAME HN   ) (RESID  25    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  18    AND NAME HA   ) (RESID  28    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID  19    AND NAME HN   ) (RESID  19    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  19    AND NAME HN   ) (RESID  19    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  19    AND NAME HA   ) (RESID  19    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  19    AND NAME HN   ) (RESID  20    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  19    AND NAME HN   ) (RESID  24    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  19    AND NAME HN   ) (RESID  28    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID  20    AND NAME HN   ) (RESID  20    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  20    AND NAME HN   ) (RESID  20    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  20    AND NAME HA   ) (RESID  20    AND NAME HB2  )   2.2  0.4  0.3
ASSIGN (RESID  20    AND NAME HA   ) (RESID  20    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  20    AND NAME HB2  ) (RESID  20    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  20    AND NAME HB1  ) (RESID  20    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  20    AND NAME HA   ) (RESID  20    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  20    AND NAME HN   ) (RESID  20    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  20    AND NAME HD*  ) (RESID  21    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID  20    AND NAME HN   ) (RESID  28    AND NAME HE1  )   4.2  2.4  0.3
ASSIGN (RESID  20    AND NAME HA   ) (RESID  21    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  20    AND NAME HE*  ) (RESID  96    AND NAME HB#  )   4.2  2.4  3.7
ASSIGN (RESID  20    AND NAME HN   ) (RESID  21    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  20    AND NAME HE*  ) (RESID  21    AND NAME HN   )   5.2  3.4  2.7
ASSIGN (RESID  21    AND NAME HN   ) (RESID  21    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  21    AND NAME HA   ) (RESID  21    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  21    AND NAME HA   ) (RESID  22    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  21    AND NAME HN   ) (RESID  22    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  21    AND NAME HN   ) (RESID  22    AND NAME HA#  )   5.2  3.4  1.3
ASSIGN (RESID  21    AND NAME HA   ) (RESID  23    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  21    AND NAME HN   ) (RESID  23    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  22    AND NAME HN   ) (RESID  22    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  23    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  23    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  23    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  23    AND NAME HA   ) (RESID  23    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  23    AND NAME HA   ) (RESID  23    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  23    AND NAME HE*  ) (RESID 111    AND NAME HH2  )   4.2  2.4  2.7
ASSIGN (RESID  23    AND NAME HB2  ) (RESID  23    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  23    AND NAME HB1  ) (RESID  23    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  23    AND NAME HB1  ) (RESID  28    AND NAME HE1  )   4.2  2.4  0.3
ASSIGN (RESID  23    AND NAME HD*  ) (RESID  24    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID  23    AND NAME HD*  ) (RESID 111    AND NAME HZ2  )   4.2  2.4  2.7
ASSIGN (RESID  23    AND NAME HD*  ) (RESID 105    AND NAME HB#  )   4.2  2.4  3.7
ASSIGN (RESID  23    AND NAME HE*  ) (RESID 111    AND NAME HZ2  )   2.7  0.9  2.7
ASSIGN (RESID  23    AND NAME HE*  ) (RESID 105    AND NAME HB#  )   4.2  2.4  3.7
ASSIGN (RESID  23    AND NAME HD*  ) (RESID  28    AND NAME HE1  )   4.2  2.4  2.7
ASSIGN (RESID  23    AND NAME HN   ) (RESID  28    AND NAME HZ2  )   2.7  0.9  0.3
ASSIGN (RESID  23    AND NAME HE*  ) (RESID 111    AND NAME HE1  )   5.2  3.4  2.7
ASSIGN (RESID  23    AND NAME HE*  ) (RESID  99    AND NAME HG*  )   2.7  0.9  5.1
ASSIGN (RESID  23    AND NAME HN   ) (RESID  28    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  24    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  24    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  25    AND NAME HN   ) (RESID  25    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  25    AND NAME HN   ) (RESID  25    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  25    AND NAME HN   ) (RESID  26    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  25    AND NAME HN   ) (RESID  25    AND NAME HG   )   2.7  0.9  0.3
ASSIGN (RESID  25    AND NAME HN   ) (RESID  25    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  25    AND NAME HA   ) (RESID  25    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  25    AND NAME HB#  ) (RESID  25    AND NAME HD*  )   2.7  0.9  3.7
ASSIGN (RESID  25    AND NAME HB#  ) (RESID  26    AND NAME HN   )   2.7  0.9  1.3
ASSIGN (RESID  25    AND NAME HA   ) (RESID  26    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  25    AND NAME HD*  ) (RESID  28    AND NAME HD1  )   2.7  0.9  2.7
ASSIGN (RESID  25    AND NAME HN   ) (RESID  28    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID  25    AND NAME HA   ) (RESID  28    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID  26    AND NAME HN   ) (RESID  26    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  26    AND NAME HN   ) (RESID  27    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  26    AND NAME HN   ) (RESID  29    AND NAME HG*  )   4.2  2.4  2.7
ASSIGN (RESID  26    AND NAME HN   ) (RESID 120    AND NAME HG*  )   4.2  2.4  2.7
ASSIGN (RESID  26    AND NAME HN   ) (RESID  30    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  26    AND NAME HN   ) (RESID  29    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  26    AND NAME HN   ) (RESID  28    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  27    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  27    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  27    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HA   ) (RESID  27    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  27    AND NAME HA   ) (RESID  27    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  27    AND NAME HB2  ) (RESID  28    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  27    AND NAME HA   ) (RESID  30    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  28    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  27    AND NAME HA   ) (RESID  30    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID 120    AND NAME HG*  )   4.2  2.4  2.7
ASSIGN (RESID  27    AND NAME HA   ) (RESID 111    AND NAME HE1  )   2.7  0.9  0.3
ASSIGN (RESID  27    AND NAME HA   ) (RESID 123    AND NAME HE1  )   7.2  5.4  0.3
ASSIGN (RESID  27    AND NAME HB1  ) (RESID 111    AND NAME HE1  )   2.7  0.9  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  28    AND NAME HE1  )   7.2  5.4  0.3
ASSIGN (RESID  28    AND NAME HN   ) (RESID  28    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HA   ) (RESID  28    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  28    AND NAME HB#  ) (RESID  29    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID  28    AND NAME HN   ) (RESID  29    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HH2  ) (RESID  28    AND NAME HZ2  )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HE3  ) (RESID  28    AND NAME HZ3  )   2.2  0.4  0.3
ASSIGN (RESID  28    AND NAME HZ3  ) (RESID  28    AND NAME HH2  )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HE3  ) (RESID  28    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HD1  ) (RESID  28    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  28    AND NAME HZ3  ) (RESID  56    AND NAME HG   )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HE1  ) (RESID  28    AND NAME HZ2  )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HE1  ) (RESID  28    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HE1  ) (RESID  28    AND NAME HD1  )   2.2  0.4  0.3
ASSIGN (RESID  28    AND NAME HE3  ) (RESID  56    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  28    AND NAME HE3  ) (RESID  32    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  28    AND NAME HH2  ) (RESID  95    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  28    AND NAME HE3  ) (RESID  95    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  28    AND NAME HZ3  ) (RESID  95    AND NAME HB#  )   2.7  0.9  1.8
ASSIGN (RESID  28    AND NAME HZ3  ) (RESID 108    AND NAME HE1  )   7.2  5.4  0.3
ASSIGN (RESID  28    AND NAME HZ3  ) (RESID  98    AND NAME HG2# )   7.2  5.4  1.8
ASSIGN (RESID  28    AND NAME HH2  ) (RESID  99    AND NAME HG*  )   2.7  0.9  2.7
ASSIGN (RESID  28    AND NAME HH2  ) (RESID  99    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HZ2  ) (RESID  99    AND NAME HG*  )   2.7  0.9  2.7
ASSIGN (RESID  28    AND NAME HZ3  ) (RESID  99    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  28    AND NAME HE3  ) (RESID  88    AND NAME HD#  )   7.2  5.4  1.8
ASSIGN (RESID  29    AND NAME HN   ) (RESID  29    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  29    AND NAME HA   ) (RESID  29    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  29    AND NAME HN   ) (RESID  29    AND NAME HG1# )   4.2  2.4  1.8
ASSIGN (RESID  29    AND NAME HN   ) (RESID  29    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  29    AND NAME HA   ) (RESID  30    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  29    AND NAME HN   ) (RESID  30    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  29    AND NAME HB   ) (RESID  30    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  29    AND NAME HG*  ) (RESID  30    AND NAME HN   )   2.7  0.9  2.7
ASSIGN (RESID  30    AND NAME HN   ) (RESID  30    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  30    AND NAME HN   ) (RESID  30    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  30    AND NAME HN   ) (RESID  30    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  30    AND NAME HB2  ) (RESID  31    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  30    AND NAME HB1  ) (RESID  31    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  30    AND NAME HN   ) (RESID 120    AND NAME HG*  )   2.7  0.9  2.7
ASSIGN (RESID  30    AND NAME HB1  ) (RESID 123    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID  31    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  31    AND NAME HA   ) (RESID  31    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  31    AND NAME HA   ) (RESID  32    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HA   ) (RESID  34    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID  32    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  32    AND NAME HN   ) (RESID  32    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  32    AND NAME HN   ) (RESID  32    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  32    AND NAME HA   ) (RESID  32    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  32    AND NAME HA   ) (RESID  33    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  32    AND NAME HA   ) (RESID  35    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  32    AND NAME HN   ) (RESID  33    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  32    AND NAME HB#  ) (RESID  33    AND NAME HN   )   2.7  0.9  1.8
ASSIGN (RESID  32    AND NAME HB#  ) (RESID  38    AND NAME HE*  )   2.7  0.9  4.2
ASSIGN (RESID  32    AND NAME HB#  ) (RESID  35    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  32    AND NAME HB#  ) (RESID  38    AND NAME HD*  )   2.2  0.4  4.2
ASSIGN (RESID  32    AND NAME HN   ) (RESID  56    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  33    AND NAME HN   ) (RESID  33    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  33    AND NAME HA   ) (RESID  34    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  33    AND NAME HN   ) (RESID  34    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  33    AND NAME HA   ) (RESID  38    AND NAME HE*  )   4.2  2.4  2.7
ASSIGN (RESID  33    AND NAME HN   ) (RESID  38    AND NAME HE*  )   4.2  2.4  2.7
ASSIGN (RESID  33    AND NAME HN   ) (RESID  38    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  34    AND NAME HN   ) (RESID  34    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  34    AND NAME HN   ) (RESID  34    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  34    AND NAME HN   ) (RESID  34    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  34    AND NAME HA   ) (RESID  34    AND NAME HB2  )   2.2  0.4  0.3
ASSIGN (RESID  34    AND NAME HA   ) (RESID  34    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  34    AND NAME HN   ) (RESID  35    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  34    AND NAME HD*  ) (RESID  34    AND NAME HE*  )   2.7  0.9  5.1
ASSIGN (RESID  34    AND NAME HB2  ) (RESID  34    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  34    AND NAME HB1  ) (RESID  34    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  34    AND NAME HA   ) (RESID  34    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  34    AND NAME HE*  ) (RESID 114    AND NAME HB#  )   4.2  2.4  3.7
ASSIGN (RESID  34    AND NAME HE*  ) (RESID 123    AND NAME HZ2  )   4.2  2.4  2.7
ASSIGN (RESID  35    AND NAME HN   ) (RESID  35    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  35    AND NAME HN   ) (RESID  35    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  35    AND NAME HA   ) (RESID  35    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  35    AND NAME HN   ) (RESID  36    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  35    AND NAME HB#  ) (RESID  38    AND NAME HE*  )   4.2  2.4  3.7
ASSIGN (RESID  35    AND NAME HN   ) (RESID  38    AND NAME HE*  )   4.2  2.4  2.7
ASSIGN (RESID  36    AND NAME HN   ) (RESID  36    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HN   ) (RESID  36    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HN   ) (RESID  36    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HA   ) (RESID  37    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HB1  ) (RESID  39    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HB2  ) (RESID  39    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HN   ) (RESID  37    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  36    AND NAME HB1  ) (RESID  55    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  36    AND NAME HB2  ) (RESID  55    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  36    AND NAME HA   ) (RESID  42    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  37    AND NAME HN   ) (RESID  37    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  37    AND NAME HA   ) (RESID  37    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  37    AND NAME HA   ) (RESID  38    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  37    AND NAME HN   ) (RESID  38    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  37    AND NAME HA   ) (RESID  39    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  38    AND NAME HN   ) (RESID  38    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  38    AND NAME HN   ) (RESID  38    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  38    AND NAME HA   ) (RESID  38    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  38    AND NAME HB#  ) (RESID  38    AND NAME HD*  )   4.2  2.4  3.7
ASSIGN (RESID  39    AND NAME HN   ) (RESID  39    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  39    AND NAME HN   ) (RESID  39    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  39    AND NAME HN   ) (RESID  39    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  39    AND NAME HA   ) (RESID  39    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  39    AND NAME HA   ) (RESID  39    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  39    AND NAME HA   ) (RESID  41    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  39    AND NAME HB1  ) (RESID  42    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  39    AND NAME HA   ) (RESID  40    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  39    AND NAME HA   ) (RESID  42    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  39    AND NAME HN   ) (RESID  40    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  39    AND NAME HA   ) (RESID  40    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  40    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  40    AND NAME HA   ) (RESID  40    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  40    AND NAME HA   ) (RESID  40    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  40    AND NAME HN   ) (RESID  41    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  40    AND NAME HA   ) (RESID  55    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  40    AND NAME HA   ) (RESID  42    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  40    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  40    AND NAME HB   ) (RESID  40    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  40    AND NAME HN   ) (RESID  42    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  41    AND NAME HN   ) (RESID  41    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  41    AND NAME HN   ) (RESID  42    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  42    AND NAME HN   ) (RESID  42    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  42    AND NAME HN   ) (RESID  42    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  42    AND NAME HA   ) (RESID  42    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  42    AND NAME HA   ) (RESID  43    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  42    AND NAME HB#  ) (RESID  43    AND NAME HN   )   2.2  0.4  1.8
ASSIGN (RESID  42    AND NAME HB#  ) (RESID  43    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID  43    AND NAME HN   ) (RESID  43    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  43    AND NAME HA   ) (RESID  43    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  43    AND NAME HA   ) (RESID  44    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  43    AND NAME HA   ) (RESID  54    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  43    AND NAME HA   ) (RESID  53    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  43    AND NAME HN   ) (RESID  43    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  43    AND NAME HN   ) (RESID  43    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  43    AND NAME HB   ) (RESID  43    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  43    AND NAME HA   ) (RESID  51    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  44    AND NAME HN   ) (RESID  44    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  44    AND NAME HN   ) (RESID  44    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  44    AND NAME HA   ) (RESID  44    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  44    AND NAME HN   ) (RESID  52    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  44    AND NAME HN   ) (RESID  51    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  44    AND NAME HA   ) (RESID  45    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  44    AND NAME HN   ) (RESID  45    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  45    AND NAME HN   ) (RESID  45    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  45    AND NAME HN   ) (RESID  45    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  45    AND NAME HA   ) (RESID  45    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  45    AND NAME HA   ) (RESID  46    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  45    AND NAME HA   ) (RESID  52    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  45    AND NAME HA   ) (RESID  51    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  45    AND NAME HA   ) (RESID  51    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  46    AND NAME HN   ) (RESID  46    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  46    AND NAME HN   ) (RESID  46    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  46    AND NAME HN   ) (RESID  46    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  46    AND NAME HA   ) (RESID  46    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  46    AND NAME HA   ) (RESID  46    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  46    AND NAME HA   ) (RESID  47    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  46    AND NAME HB2  ) (RESID  47    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  46    AND NAME HB1  ) (RESID  47    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  46    AND NAME HB2  ) (RESID  48    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  46    AND NAME HB1  ) (RESID  48    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  46    AND NAME HN   ) (RESID  51    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  46    AND NAME HA   ) (RESID  48    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  46    AND NAME HN   ) (RESID  48    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  46    AND NAME HN   ) (RESID  49    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  47    AND NAME HN   ) (RESID  47    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  47    AND NAME HA   ) (RESID  47    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  47    AND NAME HB   ) (RESID  47    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  47    AND NAME HN   ) (RESID  48    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  47    AND NAME HN   ) (RESID  47    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  47    AND NAME HN   ) (RESID  49    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  48    AND NAME HN   ) (RESID  48    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  48    AND NAME HN   ) (RESID  48    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  48    AND NAME HN   ) (RESID  48    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  48    AND NAME HA   ) (RESID  48    AND NAME HB2  )   2.2  0.4  0.3
ASSIGN (RESID  48    AND NAME HA   ) (RESID  48    AND NAME HB1  )   2.2  0.4  0.3
ASSIGN (RESID  49    AND NAME HN   ) (RESID  49    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  49    AND NAME HN   ) (RESID  50    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  50    AND NAME HN   ) (RESID  50    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  50    AND NAME HN   ) (RESID  50    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  50    AND NAME HA   ) (RESID  51    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  51    AND NAME HN   ) (RESID  51    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  51    AND NAME HN   ) (RESID  51    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  51    AND NAME HA   ) (RESID  51    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID  51    AND NAME HB   ) (RESID  51    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  51    AND NAME HA   ) (RESID  51    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  51    AND NAME HA   ) (RESID  52    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  51    AND NAME HG2# ) (RESID  52    AND NAME HN   )   2.2  0.4  1.8
ASSIGN (RESID  51    AND NAME HG2# ) (RESID  53    AND NAME HE*  )   2.7  0.9  4.2
ASSIGN (RESID  51    AND NAME HG2# ) (RESID  53    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  51    AND NAME HN   ) (RESID  51    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  51    AND NAME HB   ) (RESID  52    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  51    AND NAME HB   ) (RESID  53    AND NAME HE*  )   2.7  0.9  2.7
ASSIGN (RESID  51    AND NAME HN   ) (RESID  53    AND NAME HE*  )   5.2  3.4  2.7
ASSIGN (RESID  51    AND NAME HG2# ) (RESID  59    AND NAME HA   )   5.2  3.4  1.8
ASSIGN (RESID  52    AND NAME HN   ) (RESID  52    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  52    AND NAME HN   ) (RESID  52    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  52    AND NAME HN   ) (RESID  52    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  52    AND NAME HA   ) (RESID  52    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  52    AND NAME HA   ) (RESID  53    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  52    AND NAME HA   ) (RESID  59    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  52    AND NAME HA   ) (RESID  53    AND NAME HE*  )   4.2  2.4  2.7
ASSIGN (RESID  52    AND NAME HA   ) (RESID  57    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  52    AND NAME HA   ) (RESID  53    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  52    AND NAME HN   ) (RESID  53    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  52    AND NAME HB1  ) (RESID  59    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  53    AND NAME HN   ) (RESID  53    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  53    AND NAME HN   ) (RESID  53    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  53    AND NAME HA   ) (RESID  53    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  53    AND NAME HA   ) (RESID  53    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  53    AND NAME HB2  ) (RESID  53    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  53    AND NAME HB1  ) (RESID  53    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  53    AND NAME HA   ) (RESID  54    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  53    AND NAME HN   ) (RESID  59    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  53    AND NAME HN   ) (RESID  57    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  53    AND NAME HN   ) (RESID  58    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  53    AND NAME HD*  ) (RESID  53    AND NAME HE*  )   2.2  0.4  5.1
ASSIGN (RESID  53    AND NAME HD*  ) (RESID  53    AND NAME HA   )   4.2  2.4  2.7
ASSIGN (RESID  53    AND NAME HD*  ) (RESID  60    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID  53    AND NAME HN   ) (RESID  53    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  53    AND NAME HE*  ) (RESID  60    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID  53    AND NAME HE*  ) (RESID  60    AND NAME HB#  )   2.7  0.9  3.7
ASSIGN (RESID  53    AND NAME HE*  ) (RESID  66    AND NAME HB#  )   4.2  2.4  3.7
ASSIGN (RESID  53    AND NAME HD*  ) (RESID  59    AND NAME HA   )   5.2  3.4  2.7
ASSIGN (RESID  53    AND NAME HN   ) (RESID  57    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  53    AND NAME HN   ) (RESID  60    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  54    AND NAME HN   ) (RESID  54    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  54    AND NAME HA#  ) (RESID  55    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID  54    AND NAME HN   ) (RESID  55    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  55    AND NAME HN   ) (RESID  55    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  55    AND NAME HA   ) (RESID  55    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  55    AND NAME HN   ) (RESID  55    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID  55    AND NAME HN   ) (RESID  55    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID  55    AND NAME HG2# ) (RESID  55    AND NAME HD#  )   4.2  2.4  3.3
ASSIGN (RESID  55    AND NAME HG2# ) (RESID  56    AND NAME HA   )   2.7  0.9  1.8
ASSIGN (RESID  55    AND NAME HG2# ) (RESID  56    AND NAME HN   )   2.7  0.9  1.8
ASSIGN (RESID  55    AND NAME HN   ) (RESID  55    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  55    AND NAME HG2# ) (RESID  56    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  55    AND NAME HG1# ) (RESID  56    AND NAME HD*  )   2.7  0.9  3.7
ASSIGN (RESID  55    AND NAME HN   ) (RESID  56    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  55    AND NAME HN   ) (RESID  57    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  55    AND NAME HG2# ) (RESID  88    AND NAME HD#  )   5.2  3.4  3.3
ASSIGN (RESID  56    AND NAME HN   ) (RESID  56    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  56    AND NAME HN   ) (RESID  56    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  56    AND NAME HA   ) (RESID  56    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  56    AND NAME HA   ) (RESID  56    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  56    AND NAME HA   ) (RESID  57    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  56    AND NAME HN   ) (RESID  57    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  56    AND NAME HD*  ) (RESID  91    AND NAME HB#  )   2.7  0.9  3.7
ASSIGN (RESID  56    AND NAME HB#  ) (RESID  56    AND NAME HD*  )   2.7  0.9  3.7
ASSIGN (RESID  56    AND NAME HB#  ) (RESID  56    AND NAME HG   )   4.2  2.4  1.3
ASSIGN (RESID  56    AND NAME HD*  ) (RESID 108    AND NAME HE3  )   4.2  2.4  2.7
ASSIGN (RESID  56    AND NAME HD*  ) (RESID 108    AND NAME HZ2  )   4.2  2.4  2.7
ASSIGN (RESID  56    AND NAME HB#  ) (RESID 108    AND NAME HZ2  )   4.2  2.4  1.3
ASSIGN (RESID  56    AND NAME HD*  ) (RESID 108    AND NAME HE1  )   4.2  2.4  2.7
ASSIGN (RESID  56    AND NAME HB#  ) (RESID 108    AND NAME HE1  )   4.2  2.4  1.3
ASSIGN (RESID  57    AND NAME HN   ) (RESID  57    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  57    AND NAME HN   ) (RESID  57    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  57    AND NAME HA   ) (RESID  58    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  57    AND NAME HN   ) (RESID  58    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  57    AND NAME HN   ) (RESID  58    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID  57    AND NAME HN   ) (RESID  58    AND NAME HD#  )   2.7  0.9  1.8
ASSIGN (RESID  58    AND NAME HN   ) (RESID  58    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  58    AND NAME HN   ) (RESID  58    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  58    AND NAME HA   ) (RESID  59    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  58    AND NAME HG2# ) (RESID  63    AND NAME HD1  )   4.2  2.4  1.8
ASSIGN (RESID  58    AND NAME HG2# ) (RESID  59    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  58    AND NAME HD#  ) (RESID  95    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  58    AND NAME HN   ) (RESID  59    AND NAME HA   )   7.2  5.4  0.3
ASSIGN (RESID  58    AND NAME HA   ) (RESID  59    AND NAME HG2  )   5.2  3.4  0.3
ASSIGN (RESID  58    AND NAME HN   ) (RESID  60    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  59    AND NAME HN   ) (RESID  59    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  59    AND NAME HN   ) (RESID  59    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  59    AND NAME HN   ) (RESID  59    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  59    AND NAME HA   ) (RESID  59    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  59    AND NAME HA   ) (RESID  59    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  59    AND NAME HA   ) (RESID  60    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  59    AND NAME HB2  ) (RESID  60    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  59    AND NAME HB1  ) (RESID  60    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  59    AND NAME HB1  ) (RESID  63    AND NAME HD1  )   2.2  0.4  0.3
ASSIGN (RESID  59    AND NAME HA   ) (RESID  61    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  59    AND NAME HA   ) (RESID  63    AND NAME HE1  )   7.2  5.4  0.3
ASSIGN (RESID  59    AND NAME HN   ) (RESID  60    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  60    AND NAME HN   ) (RESID  60    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  60    AND NAME HN   ) (RESID  60    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  60    AND NAME HA   ) (RESID  60    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  60    AND NAME HN   ) (RESID  61    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  60    AND NAME HA   ) (RESID  65    AND NAME HA   )   7.2  5.4  0.3
ASSIGN (RESID  60    AND NAME HA   ) (RESID  64    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  60    AND NAME HN   ) (RESID  62    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  60    AND NAME HN   ) (RESID  64    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  61    AND NAME HN   ) (RESID  61    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  61    AND NAME HN   ) (RESID  61    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  61    AND NAME HN   ) (RESID  61    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  61    AND NAME HN   ) (RESID  62    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  61    AND NAME HA   ) (RESID  72    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  61    AND NAME HN   ) (RESID  63    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  62    AND NAME HN   ) (RESID  62    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  62    AND NAME HH2  ) (RESID  62    AND NAME HZ2  )   2.2  0.4  0.3
ASSIGN (RESID  62    AND NAME HZ3  ) (RESID  62    AND NAME HH2  )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HN   ) (RESID  63    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HA   ) (RESID  63    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  63    AND NAME HZ3  )   2.2  0.4  0.3
ASSIGN (RESID  63    AND NAME HH2  ) (RESID  63    AND NAME HZ2  )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  63    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HD1  ) (RESID  63    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  63    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  76    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HZ3  ) (RESID  75    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HZ3  ) (RESID  63    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HB#  ) (RESID  76    AND NAME HA   )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HA   ) (RESID  75    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  63    AND NAME HA   ) (RESID  76    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  75    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  63    AND NAME HZ3  ) (RESID  75    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HZ3  ) (RESID  75    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HD1  ) (RESID  98    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  98    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HA   ) (RESID  76    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  63    AND NAME HZ2  ) (RESID  98    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  63    AND NAME HZ2  ) (RESID  98    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HE1  ) (RESID  63    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID  63    AND NAME HE1  ) (RESID  98    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  63    AND NAME HE1  ) (RESID  98    AND NAME HG1# )   7.2  5.4  1.3
ASSIGN (RESID  63    AND NAME HD1  ) (RESID  98    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  75    AND NAME HD*  )   2.7  0.9  2.7
ASSIGN (RESID  63    AND NAME HZ3  ) (RESID  75    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  75    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  63    AND NAME HN   ) (RESID  75    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  63    AND NAME HZ3  ) (RESID 101    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID  63    AND NAME HE3  ) (RESID  98    AND NAME HG2# )   7.2  5.4  1.8
ASSIGN (RESID  63    AND NAME HH2  ) (RESID  98    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  64    AND NAME HN   ) (RESID  64    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  64    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  78    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  64    AND NAME HB#  ) (RESID  80    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  78    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  64    AND NAME HN   ) (RESID  64    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  65    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  76    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  77    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  65    AND NAME HA   )   7.2  5.4  0.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  74    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  64    AND NAME HA   ) (RESID  74    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  65    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  65    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  65    AND NAME HA   ) (RESID  65    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  65    AND NAME HA   ) (RESID  66    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  65    AND NAME HA   ) (RESID  67    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  78    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  65    AND NAME HB#  ) (RESID  66    AND NAME HN   )   5.2  3.4  1.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  66    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  78    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  66    AND NAME HN   ) (RESID  66    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  66    AND NAME HN   ) (RESID  66    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  66    AND NAME HA   ) (RESID  66    AND NAME HB2  )   2.2  0.4  0.3
ASSIGN (RESID  66    AND NAME HA   ) (RESID  66    AND NAME HB1  )   2.2  0.4  0.3
ASSIGN (RESID  66    AND NAME HA   ) (RESID  67    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  66    AND NAME HN   ) (RESID  67    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  66    AND NAME HN   ) (RESID  67    AND NAME HA#  )   5.2  3.4  1.3
ASSIGN (RESID  66    AND NAME HN   ) (RESID  68    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  66    AND NAME HN   ) (RESID  69    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  67    AND NAME HN   ) (RESID  67    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  67    AND NAME HN   ) (RESID  68    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  68    AND NAME HN   ) (RESID  68    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  68    AND NAME HA   ) (RESID  68    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  68    AND NAME HN   ) (RESID  68    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  68    AND NAME HA   ) (RESID  69    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  69    AND NAME HA   ) (RESID  69    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  69    AND NAME HN   ) (RESID  69    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  69    AND NAME HB   ) (RESID  69    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  71    AND NAME HN   ) (RESID  71    AND NAME HA#  )   2.7  0.9  1.3
ASSIGN (RESID  71    AND NAME HA#  ) (RESID  72    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID  71    AND NAME HN   ) (RESID  72    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  72    AND NAME HN   ) (RESID  72    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  72    AND NAME HN   ) (RESID  72    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  72    AND NAME HA   ) (RESID  72    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  72    AND NAME HA   ) (RESID  73    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  72    AND NAME HA   ) (RESID  74    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  74    AND NAME HN   ) (RESID  74    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  74    AND NAME HA   ) (RESID  74    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  74    AND NAME HA   ) (RESID  75    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  74    AND NAME HA   ) (RESID  76    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  74    AND NAME HN   ) (RESID  74    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  74    AND NAME HN   ) (RESID  75    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  74    AND NAME HN   ) (RESID  76    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  75    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  75    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  75    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HA   ) (RESID  75    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HA   ) (RESID  75    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  75    AND NAME HG   )   2.7  0.9  0.3
ASSIGN (RESID  75    AND NAME HA   ) (RESID  76    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  76    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HB2  ) (RESID  76    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  75    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  75    AND NAME HB1  ) (RESID  76    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  75    AND NAME HG   ) (RESID  76    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  75    AND NAME HD*  ) (RESID  76    AND NAME HN   )   5.2  3.4  2.7
ASSIGN (RESID  76    AND NAME HN   ) (RESID  76    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  76    AND NAME HN   ) (RESID  76    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  76    AND NAME HN   ) (RESID  77    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  76    AND NAME HN   ) (RESID  78    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  76    AND NAME HA   ) (RESID  76    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  76    AND NAME HA   ) (RESID  77    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  76    AND NAME HB#  ) (RESID  78    AND NAME HG2# )   2.2  0.4  2.8
ASSIGN (RESID  76    AND NAME HN   ) (RESID  77    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  76    AND NAME HN   ) (RESID  77    AND NAME HB#  )   7.2  5.4  1.3
ASSIGN (RESID  76    AND NAME HN   ) (RESID  78    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  77    AND NAME HA   ) (RESID  77    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  77    AND NAME HB#  ) (RESID  78    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID  77    AND NAME HN   ) (RESID  77    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  77    AND NAME HN   ) (RESID  78    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  77    AND NAME HA   ) (RESID  78    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  78    AND NAME HN   ) (RESID  78    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  78    AND NAME HA   ) (RESID  78    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  78    AND NAME HA   ) (RESID  78    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  78    AND NAME HN   ) (RESID  78    AND NAME HG1# )   2.7  0.9  1.3
ASSIGN (RESID  78    AND NAME HN   ) (RESID  78    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  79    AND NAME HA   ) (RESID  79    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  79    AND NAME HA   ) (RESID  80    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  80    AND NAME HN   ) (RESID  80    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  80    AND NAME HA   ) (RESID  83    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  80    AND NAME HN   ) (RESID  81    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  81    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  82    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  81    AND NAME HA   ) (RESID  84    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  83    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  82    AND NAME HN   ) (RESID  82    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  82    AND NAME HN   ) (RESID  82    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  82    AND NAME HA   ) (RESID  82    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  82    AND NAME HN   ) (RESID  83    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  82    AND NAME HB#  ) (RESID  83    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  82    AND NAME HA   ) (RESID  84    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  83    AND NAME HN   ) (RESID  83    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  83    AND NAME HN   ) (RESID  83    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  83    AND NAME HA   ) (RESID  83    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  83    AND NAME HA   ) (RESID  83    AND NAME HD*  )   2.2  0.4  2.7
ASSIGN (RESID  83    AND NAME HA   ) (RESID  84    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  83    AND NAME HN   ) (RESID  84    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  83    AND NAME HN   ) (RESID  83    AND NAME HG   )   2.7  0.9  0.3
ASSIGN (RESID  83    AND NAME HN   ) (RESID  83    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  84    AND NAME HN   ) (RESID  84    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  84    AND NAME HA   ) (RESID  84    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  84    AND NAME HN   ) (RESID  84    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  84    AND NAME HA   ) (RESID  85    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  85    AND NAME HN   ) (RESID  85    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  85    AND NAME HN   ) (RESID  85    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  85    AND NAME HA   ) (RESID  85    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  85    AND NAME HA   ) (RESID  86    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  86    AND NAME HN   ) (RESID  86    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  86    AND NAME HN   ) (RESID  86    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  86    AND NAME HA   ) (RESID  86    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  86    AND NAME HN   ) (RESID  87    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  87    AND NAME HA   ) (RESID  87    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  87    AND NAME HA   ) (RESID  87    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  87    AND NAME HA   ) (RESID  88    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  87    AND NAME HN   ) (RESID  87    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  87    AND NAME HN   ) (RESID  87    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  87    AND NAME HN   ) (RESID  87    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  88    AND NAME HN   ) (RESID  88    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  88    AND NAME HN   ) (RESID  88    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  88    AND NAME HG1# ) (RESID  89    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID  88    AND NAME HG2# ) (RESID  89    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  88    AND NAME HD#  ) (RESID  89    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  88    AND NAME HN   ) (RESID  88    AND NAME HG1# )   2.7  0.9  1.3
ASSIGN (RESID  88    AND NAME HD#  ) (RESID  88    AND NAME HG1# )   4.2  2.4  2.8
ASSIGN (RESID  88    AND NAME HD#  ) (RESID  92    AND NAME HG2# )   2.2  0.4  3.3
ASSIGN (RESID  88    AND NAME HB   ) (RESID  88    AND NAME HD#  )   2.7  0.9  1.8
ASSIGN (RESID  88    AND NAME HD#  ) (RESID  88    AND NAME HG2# )   2.2  0.4  3.3
ASSIGN (RESID  88    AND NAME HB   ) (RESID  88    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  88    AND NAME HB   ) (RESID  88    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID  89    AND NAME HA   ) (RESID  92    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  89    AND NAME HA   ) (RESID  92    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID  89    AND NAME HA   ) (RESID  90    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  89    AND NAME HN   ) (RESID  90    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  89    AND NAME HN   ) (RESID  89    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  89    AND NAME HA   ) (RESID  89    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  89    AND NAME HB   ) (RESID  89    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  89    AND NAME HG2# ) (RESID  90    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  89    AND NAME HG2# ) (RESID  93    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  90    AND NAME HN   ) (RESID  90    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  90    AND NAME HN   ) (RESID  90    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  90    AND NAME HA   ) (RESID  90    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  90    AND NAME HA   ) (RESID  93    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  90    AND NAME HN   ) (RESID  91    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  90    AND NAME HB#  ) (RESID  91    AND NAME HN   )   2.7  0.9  1.8
ASSIGN (RESID  91    AND NAME HN   ) (RESID  91    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  91    AND NAME HN   ) (RESID  91    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  91    AND NAME HA   ) (RESID  92    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  91    AND NAME HA   ) (RESID  94    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  91    AND NAME HB#  ) (RESID  92    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID  91    AND NAME HN   ) (RESID  92    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  92    AND NAME HN   ) (RESID  92    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  92    AND NAME HN   ) (RESID  92    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  92    AND NAME HA   ) (RESID  92    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID  92    AND NAME HA   ) (RESID  92    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  92    AND NAME HA   ) (RESID  92    AND NAME HG1# )   2.2  0.4  1.8
ASSIGN (RESID  92    AND NAME HN   ) (RESID  92    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  92    AND NAME HN   ) (RESID  92    AND NAME HG1# )   4.2  2.4  1.8
ASSIGN (RESID  92    AND NAME HA   ) (RESID  95    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  92    AND NAME HN   ) (RESID  93    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  92    AND NAME HA   ) (RESID  95    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  92    AND NAME HG2# ) (RESID  93    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  92    AND NAME HB   ) (RESID  93    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  92    AND NAME HG1# ) (RESID  93    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  92    AND NAME HG1# ) (RESID  96    AND NAME HA   )   2.7  0.9  1.8
ASSIGN (RESID  92    AND NAME HB   ) (RESID  92    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  92    AND NAME HB   ) (RESID  92    AND NAME HG1# )   2.7  0.9  1.8
ASSIGN (RESID  92    AND NAME HN   ) (RESID  94    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  93    AND NAME HN   ) (RESID  93    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  93    AND NAME HN   ) (RESID  93    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  93    AND NAME HN   ) (RESID  93    AND NAME HB1  )   2.2  0.4  0.3
ASSIGN (RESID  93    AND NAME HA   ) (RESID  93    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  93    AND NAME HA   ) (RESID  93    AND NAME HB1  )   2.2  0.4  0.3
ASSIGN (RESID  93    AND NAME HB2  ) (RESID  94    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  93    AND NAME HA   ) (RESID  96    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  93    AND NAME HN   ) (RESID  94    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  94    AND NAME HN   ) (RESID  94    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  94    AND NAME HN   ) (RESID  94    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  94    AND NAME HN   ) (RESID  94    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  94    AND NAME HA   ) (RESID  94    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  94    AND NAME HA   ) (RESID  95    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  94    AND NAME HB1  ) (RESID  95    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  94    AND NAME HA   ) (RESID  97    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  94    AND NAME HN   ) (RESID  95    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  95    AND NAME HN   ) (RESID  95    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  95    AND NAME HN   ) (RESID  95    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  95    AND NAME HA   ) (RESID  95    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  95    AND NAME HN   ) (RESID  96    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  95    AND NAME HN   ) (RESID  97    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  95    AND NAME HB#  ) (RESID  96    AND NAME HN   )   2.7  0.9  1.8
ASSIGN (RESID  95    AND NAME HB#  ) (RESID 108    AND NAME HH2  )   2.2  0.4  1.8
ASSIGN (RESID  95    AND NAME HB#  ) (RESID 108    AND NAME HZ2  )   2.7  0.9  1.8
ASSIGN (RESID  95    AND NAME HA   ) (RESID 108    AND NAME HZ2  )   2.7  0.9  0.3
ASSIGN (RESID  95    AND NAME HN   ) (RESID  98    AND NAME HG2# )   7.2  5.4  1.8
ASSIGN (RESID  96    AND NAME HN   ) (RESID  96    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  96    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID  96    AND NAME HA   ) (RESID  96    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  97    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  97    AND NAME HN   ) (RESID  97    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  97    AND NAME HA   ) (RESID  98    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  97    AND NAME HN   ) (RESID  98    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  97    AND NAME HN   ) (RESID  99    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  98    AND NAME HN   ) (RESID  98    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID  98    AND NAME HN   ) (RESID  98    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HN   ) (RESID  98    AND NAME HG1# )   2.7  0.9  1.3
ASSIGN (RESID  98    AND NAME HN   ) (RESID  98    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HN   ) (RESID  99    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  98    AND NAME HG2# ) (RESID  99    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HB   ) (RESID  99    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  98    AND NAME HG2# ) (RESID 108    AND NAME HZ3  )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HG2# ) (RESID 108    AND NAME HZ2  )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HN   ) (RESID  98    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  98    AND NAME HG2# ) (RESID  99    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HA   ) (RESID  98    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID  98    AND NAME HG2# ) (RESID  98    AND NAME HD#  )   2.7  0.9  3.3
ASSIGN (RESID  98    AND NAME HB   ) (RESID  98    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  98    AND NAME HD#  ) (RESID 108    AND NAME HZ2  )   2.7  0.9  1.8
ASSIGN (RESID  98    AND NAME HG2# ) (RESID 108    AND NAME HE1  )   5.2  3.4  1.8
ASSIGN (RESID  98    AND NAME HG1# ) (RESID  99    AND NAME HN   )   5.2  3.4  1.3
ASSIGN (RESID  98    AND NAME HG2# ) (RESID  99    AND NAME HB   )   7.2  5.4  1.8
ASSIGN (RESID  98    AND NAME HG2# ) (RESID 107    AND NAME HN   )   5.2  3.4  1.8
ASSIGN (RESID  98    AND NAME HG2# ) (RESID 108    AND NAME HE3  )   5.2  3.4  1.8
ASSIGN (RESID  99    AND NAME HN   ) (RESID  99    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  99    AND NAME HN   ) (RESID  99    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  99    AND NAME HA   ) (RESID  99    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID  99    AND NAME HN   ) (RESID  99    AND NAME HG*  )   2.7  0.9  2.7
ASSIGN (RESID  99    AND NAME HN   ) (RESID 100    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  99    AND NAME HA   ) (RESID 100    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  99    AND NAME HB   ) (RESID 100    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  99    AND NAME HG*  ) (RESID 108    AND NAME HZ3  )   2.7  0.9  2.7
ASSIGN (RESID  99    AND NAME HB   ) (RESID 108    AND NAME HZ3  )   4.2  2.4  0.3
ASSIGN (RESID  99    AND NAME HN   ) (RESID 108    AND NAME HZ3  )   5.2  3.4  0.3
ASSIGN (RESID 100    AND NAME HN   ) (RESID 100    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 100    AND NAME HN   ) (RESID 100    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 100    AND NAME HA   ) (RESID 100    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 100    AND NAME HN   ) (RESID 101    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 101    AND NAME HN   ) (RESID 101    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 101    AND NAME HN   ) (RESID 101    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 101    AND NAME HA   ) (RESID 101    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 101    AND NAME HA   ) (RESID 102    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 102    AND NAME HN   ) (RESID 102    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID 104    AND NAME HN   ) (RESID 104    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID 104    AND NAME HN   ) (RESID 105    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 104    AND NAME HA#  ) (RESID 105    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 105    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 105    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 105    AND NAME HA   ) (RESID 105    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 105    AND NAME HA   ) (RESID 105    AND NAME HE#  )   2.7  0.9  0.3
ASSIGN (RESID 105    AND NAME HB#  ) (RESID 108    AND NAME HE3  )   4.2  2.4  1.3
ASSIGN (RESID 105    AND NAME HA   ) (RESID 108    AND NAME HE3  )   2.2  0.4  0.3
ASSIGN (RESID 105    AND NAME HA   ) (RESID 108    AND NAME HZ3  )   2.7  0.9  0.3
ASSIGN (RESID 105    AND NAME HE#  ) (RESID 105    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 105    AND NAME HB#  ) (RESID 111    AND NAME HZ2  )   4.2  2.4  1.3
ASSIGN (RESID 105    AND NAME HB#  ) (RESID 108    AND NAME HZ3  )   5.2  3.4  1.3
ASSIGN (RESID 105    AND NAME HB#  ) (RESID 111    AND NAME HE1  )   5.2  3.4  1.3
ASSIGN (RESID 105    AND NAME HE#  ) (RESID 111    AND NAME HE1  )   5.2  3.4  0.3
ASSIGN (RESID 105    AND NAME HB#  ) (RESID 106    AND NAME HN   )   5.2  3.4  1.3
ASSIGN (RESID 106    AND NAME HN   ) (RESID 106    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 106    AND NAME HA   ) (RESID 106    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 106    AND NAME HA   ) (RESID 107    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 106    AND NAME HN   ) (RESID 107    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 107    AND NAME HN   ) (RESID 107    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 107    AND NAME HN   ) (RESID 107    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID 107    AND NAME HA   ) (RESID 107    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID 107    AND NAME HA   ) (RESID 108    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 107    AND NAME HB#  ) (RESID 108    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID 107    AND NAME HB#  ) (RESID 108    AND NAME HE3  )   2.7  0.9  1.8
ASSIGN (RESID 107    AND NAME HN   ) (RESID 108    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 107    AND NAME HN   ) (RESID 109    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID 108    AND NAME HN   ) (RESID 108    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 108    AND NAME HH2  ) (RESID 108    AND NAME HZ2  )   2.7  0.9  0.3
ASSIGN (RESID 108    AND NAME HE3  ) (RESID 108    AND NAME HZ3  )   2.7  0.9  0.3
ASSIGN (RESID 108    AND NAME HZ3  ) (RESID 108    AND NAME HH2  )   2.7  0.9  0.3
ASSIGN (RESID 108    AND NAME HE3  ) (RESID 108    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 108    AND NAME HA   ) (RESID 108    AND NAME HD1  )   4.2  2.4  0.3
ASSIGN (RESID 108    AND NAME HN   ) (RESID 108    AND NAME HE3  )   4.2  2.4  0.3
ASSIGN (RESID 108    AND NAME HN   ) (RESID 108    AND NAME HZ3  )   5.2  3.4  0.3
ASSIGN (RESID 109    AND NAME HA   ) (RESID 109    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID 109    AND NAME HA   ) (RESID 112    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 109    AND NAME HB   )   2.7  0.9  0.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 110    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 111    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 109    AND NAME HG*  )   2.7  0.9  2.7
ASSIGN (RESID 109    AND NAME HG*  ) (RESID 110    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID 109    AND NAME HB   ) (RESID 110    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 109    AND NAME HA   ) (RESID 110    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 112    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID 110    AND NAME HN   ) (RESID 110    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 110    AND NAME HA   ) (RESID 110    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID 110    AND NAME HA   ) (RESID 113    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 110    AND NAME HN   ) (RESID 110    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID 110    AND NAME HN   ) (RESID 111    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 111    AND NAME HN   ) (RESID 111    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 111    AND NAME HN   ) (RESID 112    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID 111    AND NAME HE3  ) (RESID 111    AND NAME HZ3  )   2.2  0.4  0.3
ASSIGN (RESID 111    AND NAME HZ3  ) (RESID 111    AND NAME HH2  )   2.7  0.9  0.3
ASSIGN (RESID 111    AND NAME HE3  ) (RESID 112    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 111    AND NAME HE3  ) (RESID 112    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 111    AND NAME HE1  ) (RESID 116    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 111    AND NAME HZ2  ) (RESID 116    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID 112    AND NAME HN   ) (RESID 112    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 112    AND NAME HN   ) (RESID 112    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 112    AND NAME HN   ) (RESID 113    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 112    AND NAME HB#  ) (RESID 113    AND NAME HN   )   2.7  0.9  1.3
ASSIGN (RESID 112    AND NAME HA   ) (RESID 116    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 112    AND NAME HN   ) (RESID 116    AND NAME HB#  )   7.2  5.4  1.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 113    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 113    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 113    AND NAME HA   ) (RESID 113    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 113    AND NAME HB#  ) (RESID 114    AND NAME HN   )   2.7  0.9  1.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 114    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 114    AND NAME HN   ) (RESID 114    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 114    AND NAME HA   ) (RESID 114    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 114    AND NAME HN   ) (RESID 114    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 114    AND NAME HN   ) (RESID 115    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 115    AND NAME HN   ) (RESID 115    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 115    AND NAME HN   ) (RESID 115    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 115    AND NAME HA   ) (RESID 115    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 116    AND NAME HN   ) (RESID 116    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 116    AND NAME HN   ) (RESID 116    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 116    AND NAME HA   ) (RESID 116    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 116    AND NAME HA   ) (RESID 117    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID 116    AND NAME HB#  ) (RESID 117    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID 116    AND NAME HN   ) (RESID 117    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID 117    AND NAME HN   ) (RESID 117    AND NAME HA#  )   2.7  0.9  1.3
ASSIGN (RESID 117    AND NAME HN   ) (RESID 118    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 118    AND NAME HN   ) (RESID 118    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 118    AND NAME HN   ) (RESID 118    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID 118    AND NAME HA   ) (RESID 118    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID 118    AND NAME HA   ) (RESID 119    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 118    AND NAME HN   ) (RESID 118    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID 118    AND NAME HB   ) (RESID 118    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID 118    AND NAME HG2# ) (RESID 119    AND NAME HN   )   4.2  2.4  1.8
ASSIGN (RESID 119    AND NAME HN   ) (RESID 119    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 119    AND NAME HA   ) (RESID 119    AND NAME HB2  )   2.2  0.4  0.3
ASSIGN (RESID 119    AND NAME HA   ) (RESID 119    AND NAME HB1  )   2.2  0.4  0.3
ASSIGN (RESID 119    AND NAME HA   ) (RESID 120    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID 119    AND NAME HN   ) (RESID 119    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID 119    AND NAME HN   ) (RESID 119    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID 119    AND NAME HA   ) (RESID 121    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 120    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 120    AND NAME HA   ) (RESID 120    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 121    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 120    AND NAME HG*  )   2.7  0.9  2.7
ASSIGN (RESID 120    AND NAME HG*  ) (RESID 121    AND NAME HN   )   4.2  2.4  2.7
ASSIGN (RESID 120    AND NAME HA   ) (RESID 123    AND NAME HE1  )   4.2  2.4  0.3
ASSIGN (RESID 121    AND NAME HN   ) (RESID 121    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 121    AND NAME HA   ) (RESID 121    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 121    AND NAME HN   ) (RESID 121    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 121    AND NAME HA   ) (RESID 122    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 121    AND NAME HN   ) (RESID 122    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 121    AND NAME HN   ) (RESID 123    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID 121    AND NAME HN   ) (RESID 123    AND NAME HD1  )   5.2  3.4  0.3
ASSIGN (RESID 122    AND NAME HN   ) (RESID 122    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 122    AND NAME HA   ) (RESID 122    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID 122    AND NAME HN   ) (RESID 122    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID 122    AND NAME HA   ) (RESID 123    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 122    AND NAME HB#  ) (RESID 123    AND NAME HN   )   2.7  0.9  1.8
ASSIGN (RESID 123    AND NAME HN   ) (RESID 123    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 123    AND NAME HN   ) (RESID 123    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID 123    AND NAME HN   ) (RESID 123    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID 123    AND NAME HA   ) (RESID 123    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID 123    AND NAME HA   ) (RESID 123    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID 123    AND NAME HB1  ) (RESID 124    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 123    AND NAME HH2  ) (RESID 123    AND NAME HZ2  )   2.2  0.4  0.3
ASSIGN (RESID 123    AND NAME HE3  ) (RESID 123    AND NAME HZ3  )   2.2  0.4  0.3
ASSIGN (RESID 123    AND NAME HE3  ) (RESID 123    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID 123    AND NAME HE3  ) (RESID 123    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID 123    AND NAME HE3  ) (RESID 123    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 123    AND NAME HZ2  ) (RESID 123    AND NAME HE3  )   4.2  2.4  0.3
ASSIGN (RESID 123    AND NAME HE1  ) (RESID 123    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 124    AND NAME HN   ) (RESID 124    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 124    AND NAME HA   ) (RESID 124    AND NAME HB   )   2.2  0.4  0.3
ASSIGN (RESID 124    AND NAME HN   ) (RESID 124    AND NAME HG1# )   2.7  0.9  1.3
ASSIGN (RESID 124    AND NAME HN   ) (RESID 124    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID 124    AND NAME HN   ) (RESID 125    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID 124    AND NAME HB   ) (RESID 124    AND NAME HD#  )   2.7  0.9  1.8
ASSIGN (RESID 124    AND NAME HB   ) (RESID 124    AND NAME HG2# )   2.2  0.4  1.8
ASSIGN (RESID 125    AND NAME HN   ) (RESID 125    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 125    AND NAME HN   ) (RESID 125    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 125    AND NAME HA   ) (RESID 125    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 125    AND NAME HB#  ) (RESID 126    AND NAME HN   )   4.2  2.4  1.3
ASSIGN (RESID 125    AND NAME HA   ) (RESID 126    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID 125    AND NAME HN   ) (RESID 126    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID 126    AND NAME HN   ) (RESID 126    AND NAME HA#  )   2.7  0.9  1.3
ASSIGN (RESID 126    AND NAME HN   ) (RESID 127    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 127    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 127    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 127    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID 127    AND NAME HA   ) (RESID 127    AND NAME HB2  )   2.2  0.4  0.3
ASSIGN (RESID 127    AND NAME HA   ) (RESID 127    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID 127    AND NAME HB1  ) (RESID 128    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 128    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 127    AND NAME HA   ) (RESID 128    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 127    AND NAME HB1  ) (RESID 129    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID 127    AND NAME HA   ) (RESID 129    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID 128    AND NAME HN   ) (RESID 128    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 128    AND NAME HA   ) (RESID 128    AND NAME HB#  )   2.2  0.4  1.3
ASSIGN (RESID 128    AND NAME HA   ) (RESID 129    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID 128    AND NAME HN   ) (RESID 129    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 129    AND NAME HN   ) (RESID 129    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 129    AND NAME HA   ) (RESID 129    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID 129    AND NAME HA   ) (RESID 129    AND NAME HD*  )   2.2  0.4  2.7
ASSIGN (RESID 129    AND NAME HN   ) (RESID 129    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 129    AND NAME HN   ) (RESID 129    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID 129    AND NAME HN   ) (RESID 129    AND NAME HG   )   2.7  0.9  0.3
ASSIGN (RESID 129    AND NAME HB#  ) (RESID 129    AND NAME HG   )   2.2  0.4  1.3
ASSIGN (RESID   1    AND NAME HB#  ) (RESID   1    AND NAME HG#  )   2.7  0.9  2.3
ASSIGN (RESID   1    AND NAME HB#  ) (RESID   1    AND NAME HA   )   2.7  0.9  1.3
ASSIGN (RESID   1    AND NAME HB#  ) (RESID  86    AND NAME HA   )   4.2  2.4  1.3
ASSIGN (RESID   1    AND NAME HG#  ) (RESID   1    AND NAME HA   )   2.7  0.9  1.3
ASSIGN (RESID   1    AND NAME HD#  ) (RESID   1    AND NAME HE#  )   4.2  2.4  2.3
ASSIGN (RESID   1    AND NAME HD#  ) (RESID   1    AND NAME HG#  )   2.7  0.9  2.3
ASSIGN (RESID   1    AND NAME HE#  ) (RESID   1    AND NAME HG#  )   2.7  0.9  2.3
ASSIGN (RESID   1    AND NAME HE#  ) (RESID  86    AND NAME HA   )   4.2  2.4  1.3
ASSIGN (RESID   2    AND NAME HA   ) (RESID  39    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   2    AND NAME HA   ) (RESID  40    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HG1# ) (RESID  38    AND NAME HB2  )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HG1# ) (RESID  39    AND NAME HB2  )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HG2# ) (RESID  39    AND NAME HB1  )   4.2  2.4  1.8
ASSIGN (RESID   2    AND NAME HG2# ) (RESID  39    AND NAME HB2  )   2.7  0.9  1.8
ASSIGN (RESID   2    AND NAME HG2# ) (RESID   1    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID   3    AND NAME HB1  ) (RESID  38    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HB1  ) (RESID   8    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HB1  ) (RESID   7    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID   3    AND NAME HB2  ) (RESID   8    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HB2  ) (RESID   8    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HB2  ) (RESID  38    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   4    AND NAME HA#  ) (RESID   7    AND NAME HB#  )   4.2  2.4  2.3
ASSIGN (RESID   5    AND NAME HA   ) (RESID   5    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID   5    AND NAME HA   ) (RESID   5    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID   6    AND NAME HB1  ) (RESID 127    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   6    AND NAME HB1  ) (RESID   9    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID   6    AND NAME HB2  ) (RESID   9    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID   7    AND NAME HB#  ) (RESID   7    AND NAME HG#  )   2.7  0.9  2.3
ASSIGN (RESID   9    AND NAME HB#  ) (RESID  12    AND NAME HB1  )   4.2  2.4  1.8
ASSIGN (RESID  12    AND NAME HA   ) (RESID  12    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  12    AND NAME HA   ) (RESID  12    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  12    AND NAME HA   ) (RESID  12    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  12    AND NAME HB2  ) (RESID  17    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  12    AND NAME HB2  ) (RESID  25    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  12    AND NAME HB2  ) (RESID  12    AND NAME HG#  )   2.7  0.9  1.3
ASSIGN (RESID  12    AND NAME HG#  ) (RESID  88    AND NAME HD#  )   4.2  2.4  2.8
ASSIGN (RESID  12    AND NAME HG#  ) (RESID  17    AND NAME HD*  )   4.2  2.4  3.7
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  17    AND NAME HG   )   2.7  0.9  0.3
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  28    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  28    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  28    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  28    AND NAME HE3  )   4.2  2.4  0.3
ASSIGN (RESID  12    AND NAME HE#  ) (RESID  28    AND NAME HD1  )   4.2  2.4  0.3
ASSIGN (RESID  13    AND NAME HA   ) (RESID  13    AND NAME HG#  )   2.7  0.9  1.3
ASSIGN (RESID  13    AND NAME HA   ) (RESID  13    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  13    AND NAME HA   ) (RESID  13    AND NAME HE#  )   4.2  2.4  1.3
ASSIGN (RESID  13    AND NAME HA   ) (RESID  25    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  14    AND NAME HA   ) (RESID  14    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  14    AND NAME HA   ) (RESID  14    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  15    AND NAME HA   ) (RESID  92    AND NAME HG1# )   4.2  2.4  1.8
ASSIGN (RESID  15    AND NAME HB1  ) (RESID  92    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  15    AND NAME HB1  ) (RESID  92    AND NAME HG1# )   4.2  2.4  1.8
ASSIGN (RESID  17    AND NAME HA   ) (RESID  20    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  17    AND NAME HB2  ) (RESID  12    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HD*  ) (RESID  12    AND NAME HB1  )   4.2  2.4  2.7
ASSIGN (RESID  20    AND NAME HB1  ) (RESID  17    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  20    AND NAME HB1  ) (RESID  17    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  21    AND NAME HA   ) (RESID  21    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  21    AND NAME HA   ) (RESID  21    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  21    AND NAME HB#  ) (RESID  21    AND NAME HG#  )   2.7  0.9  2.3
ASSIGN (RESID  21    AND NAME HB#  ) (RESID  21    AND NAME HD#  )   4.2  2.4  2.3
ASSIGN (RESID  24    AND NAME HA   ) (RESID  24    AND NAME HB1  )   2.2  0.4  0.3
ASSIGN (RESID  24    AND NAME HA   ) (RESID  24    AND NAME HB2  )   2.2  0.4  0.3
ASSIGN (RESID  24    AND NAME HA   ) (RESID  19    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  25    AND NAME HA   ) (RESID  28    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  25    AND NAME HA   ) (RESID  28    AND NAME HD1  )   2.7  0.9  0.3
ASSIGN (RESID  25    AND NAME HB#  ) (RESID  18    AND NAME HA   )   4.2  2.4  1.3
ASSIGN (RESID  25    AND NAME HB#  ) (RESID  18    AND NAME HB1  )   4.2  2.4  1.3
ASSIGN (RESID  25    AND NAME HB#  ) (RESID  18    AND NAME HB2  )   4.2  2.4  1.3
ASSIGN (RESID  25    AND NAME HD*  ) (RESID  18    AND NAME HB1  )   4.2  2.4  2.7
ASSIGN (RESID  25    AND NAME HD*  ) (RESID  18    AND NAME HB2  )   4.2  2.4  2.7
ASSIGN (RESID  25    AND NAME HD*  ) (RESID  13    AND NAME HB#  )   4.2  2.4  3.7
ASSIGN (RESID  25    AND NAME HD*  ) (RESID  17    AND NAME HD*  )   4.2  2.4  5.1
ASSIGN (RESID  25    AND NAME HD*  ) (RESID   9    AND NAME HA   )   4.2  2.4  2.7
ASSIGN (RESID  27    AND NAME HB1  ) (RESID 105    AND NAME HE#  )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HB2  ) (RESID 105    AND NAME HE#  )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HA   ) (RESID  31    AND NAME HB#  )   2.7  0.9  1.8
ASSIGN (RESID  28    AND NAME HA   ) (RESID 105    AND NAME HE#  )   2.7  0.9  0.3
ASSIGN (RESID  28    AND NAME HA   ) (RESID  28    AND NAME HD1  )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HB#  ) (RESID  17    AND NAME HD*  )   4.2  2.4  3.7
ASSIGN (RESID  29    AND NAME HA   ) (RESID   8    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  29    AND NAME HG2# ) (RESID  28    AND NAME HD1  )   4.2  2.4  1.8
ASSIGN (RESID  29    AND NAME HG2# ) (RESID  28    AND NAME HB2  )   4.2  2.4  1.8
ASSIGN (RESID  29    AND NAME HG2# ) (RESID   8    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  29    AND NAME HG1# ) (RESID   8    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  29    AND NAME HG1# ) (RESID 123    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID  29    AND NAME HG1# ) (RESID  30    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID  29    AND NAME HG1# ) (RESID 123    AND NAME HD1  )   4.2  2.4  1.8
ASSIGN (RESID  31    AND NAME HA   ) (RESID 111    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HB#  ) (RESID 111    AND NAME HB1  )   4.2  2.4  1.8
ASSIGN (RESID  31    AND NAME HB#  ) (RESID 111    AND NAME HB2  )   4.2  2.4  1.8
ASSIGN (RESID  31    AND NAME HB#  ) (RESID 105    AND NAME HE#  )   4.2  2.4  1.8
ASSIGN (RESID  31    AND NAME HB#  ) (RESID  56    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  33    AND NAME HA   ) (RESID  37    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  33    AND NAME HA   ) (RESID  33    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  33    AND NAME HA   ) (RESID  33    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  33    AND NAME HA   ) (RESID  33    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  33    AND NAME HB1  ) (RESID  33    AND NAME HG#  )   2.7  0.9  1.3
ASSIGN (RESID  33    AND NAME HB2  ) (RESID  33    AND NAME HG#  )   2.7  0.9  1.3
ASSIGN (RESID  33    AND NAME HG#  ) (RESID  33    AND NAME HD#  )   2.7  0.9  2.3
ASSIGN (RESID  33    AND NAME HD#  ) (RESID  33    AND NAME HE#  )   2.7  0.9  2.3
ASSIGN (RESID  35    AND NAME HA   ) (RESID  35    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  36    AND NAME HB1  ) (RESID  42    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  36    AND NAME HB2  ) (RESID  42    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  38    AND NAME HB1  ) (RESID   2    AND NAME HG1# )   4.2  2.4  1.8
ASSIGN (RESID  38    AND NAME HB2  ) (RESID   3    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  38    AND NAME HB2  ) (RESID  55    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  40    AND NAME HA   ) (RESID  55    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  40    AND NAME HA   ) (RESID  55    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  40    AND NAME HG2# ) (RESID  86    AND NAME HA   )   2.7  0.9  1.8
ASSIGN (RESID  41    AND NAME HA   ) (RESID  41    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  41    AND NAME HA   ) (RESID  41    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  41    AND NAME HA   ) (RESID  84    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  41    AND NAME HA   ) (RESID  84    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  41    AND NAME HB1  ) (RESID  84    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  43    AND NAME HA   ) (RESID  53    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  43    AND NAME HG2# ) (RESID  53    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID  43    AND NAME HB   ) (RESID  51    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID  45    AND NAME HA   ) (RESID  51    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  51    AND NAME HA   ) (RESID  45    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  51    AND NAME HG2# ) (RESID  45    AND NAME HB#  )   4.2  2.4  2.8
ASSIGN (RESID  55    AND NAME HD#  ) (RESID  38    AND NAME HB1  )   4.2  2.4  1.8
ASSIGN (RESID  55    AND NAME HD#  ) (RESID   8    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  55    AND NAME HG2# ) (RESID   8    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  55    AND NAME HD#  ) (RESID  56    AND NAME HD*  )   4.2  2.4  4.2
ASSIGN (RESID  55    AND NAME HG2# ) (RESID  91    AND NAME HB#  )   4.2  2.4  2.8
ASSIGN (RESID  57    AND NAME HA   ) (RESID  57    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  57    AND NAME HA   ) (RESID  57    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  66    AND NAME HA   ) (RESID  80    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  66    AND NAME HB1  ) (RESID  80    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  66    AND NAME HB2  ) (RESID  80    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  70    AND NAME HA   ) (RESID  70    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  76    AND NAME HB#  ) (RESID  78    AND NAME HA   )   4.2  2.4  1.3
ASSIGN (RESID  78    AND NAME HA   ) (RESID  79    AND NAME HD#  )   2.7  0.9  1.3
ASSIGN (RESID  78    AND NAME HB#  ) (RESID  79    AND NAME HD#  )   2.7  0.9  1.3
ASSIGN (RESID  78    AND NAME HG2# ) (RESID  64    AND NAME HB1  )   4.2  2.4  1.8
ASSIGN (RESID  78    AND NAME HG2# ) (RESID  64    AND NAME HB2  )   4.2  2.4  1.8
ASSIGN (RESID  78    AND NAME HG2# ) (RESID  79    AND NAME HD#  )   4.2  2.4  2.8
ASSIGN (RESID  78    AND NAME HG1# ) (RESID  79    AND NAME HD#  )   4.2  2.4  2.3
ASSIGN (RESID  78    AND NAME HD#  ) (RESID  79    AND NAME HD#  )   4.2  2.4  2.8
ASSIGN (RESID  81    AND NAME HA   ) (RESID  84    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  81    AND NAME HA   ) (RESID  84    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  86    AND NAME HB#  ) (RESID  40    AND NAME HG2# )   4.2  2.4  2.8
ASSIGN (RESID  86    AND NAME HB#  ) (RESID   1    AND NAME HG#  )   4.2  2.4  2.3
ASSIGN (RESID  86    AND NAME HB#  ) (RESID   1    AND NAME HD#  )   4.2  2.4  2.3
ASSIGN (RESID  92    AND NAME HA   ) (RESID  91    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  92    AND NAME HG1# ) (RESID  93    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID  92    AND NAME HG1# ) (RESID  95    AND NAME HB#  )   2.7  0.9  3.3
ASSIGN (RESID  92    AND NAME HG2# ) (RESID  95    AND NAME HB#  )   2.7  0.9  3.3
ASSIGN (RESID  93    AND NAME HA   ) (RESID  96    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  93    AND NAME HB1  ) (RESID  90    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  93    AND NAME HB2  ) (RESID  90    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  94    AND NAME HA   ) (RESID  97    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  96    AND NAME HA   ) (RESID  96    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  96    AND NAME HA   ) (RESID  96    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  96    AND NAME HB#  ) (RESID  96    AND NAME HG#  )   2.2  0.4  2.3
ASSIGN (RESID  96    AND NAME HG#  ) (RESID  96    AND NAME HE#  )   2.7  0.9  2.3
ASSIGN (RESID  96    AND NAME HG#  ) (RESID  96    AND NAME HD#  )   2.7  0.9  2.3
ASSIGN (RESID  96    AND NAME HD#  ) (RESID  96    AND NAME HE#  )   2.7  0.9  2.3
ASSIGN (RESID  96    AND NAME HD#  ) (RESID  17    AND NAME HD*  )   4.2  2.4  3.7
ASSIGN (RESID  96    AND NAME HE#  ) (RESID  17    AND NAME HD*  )   4.2  2.4  3.7
ASSIGN (RESID  98    AND NAME HA   ) (RESID  95    AND NAME HA    )   4.2  2.4  0.3
ASSIGN (RESID  98    AND NAME HA   ) (RESID  95    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HB   ) (RESID  95    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  98    AND NAME HD#  ) (RESID  95    AND NAME HA   )   4.2  2.4  1.8
ASSIGN (RESID  98    AND NAME HG2# ) (RESID 107    AND NAME HB#  )   4.2  2.4  3.3
ASSIGN (RESID  98    AND NAME HD#  ) (RESID  58    AND NAME HD#  )   4.2  2.4  3.3
ASSIGN (RESID 108    AND NAME HB#  ) (RESID 111    AND NAME HB1  )   4.2  2.4  1.3
ASSIGN (RESID 108    AND NAME HB#  ) (RESID 111    AND NAME HB2  )   4.2  2.4  1.3
ASSIGN (RESID 111    AND NAME HA   ) (RESID 115    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 113    AND NAME HB#  ) (RESID 109    AND NAME HG*  )   4.2  2.4  3.7
ASSIGN (RESID 116    AND NAME HB#  ) (RESID 116    AND NAME HG#  )   2.2  0.4  2.3
ASSIGN (RESID 116    AND NAME HG#  ) (RESID 116    AND NAME HD#  )   2.2  0.4  2.3
ASSIGN (RESID 118    AND NAME HA   ) (RESID 118    AND NAME HG2# )   2.7  0.9  1.8
ASSIGN (RESID 121    AND NAME HA   ) (RESID 124    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID 121    AND NAME HA   ) (RESID 124    AND NAME HG1# )   4.2  2.4  1.3
ASSIGN (RESID 123    AND NAME HB#  ) (RESID  29    AND NAME HG1# )   4.2  2.4  2.8
ASSIGN (RESID 123    AND NAME HB#  ) (RESID  29    AND NAME HG2# )   4.2  2.4  2.8
ASSIGN (RESID 124    AND NAME HG2# ) (RESID  26    AND NAME HA#  )   4.2  2.4  2.8
ASSIGN (RESID 124    AND NAME HD#  ) (RESID  26    AND NAME HA#  )   4.2  2.4  2.8
ASSIGN (RESID 124    AND NAME HD#  ) (RESID 121    AND NAME HG#  )   4.2  2.4  2.8
ASSIGN (RESID   2    AND NAME HN   ) (RESID  39    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID   3    AND NAME HN   ) (RESID   8    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID   3    AND NAME HN   ) (RESID  38    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   3    AND NAME HN   ) (RESID  39    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID   3    AND NAME HN   ) (RESID  40    AND NAME HB   )   5.2  3.4  0.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID  38    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID   5    AND NAME HN   ) (RESID  38    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID   8    AND NAME HN   ) (RESID   3    AND NAME HE*  )   4.2  2.4  2.7
ASSIGN (RESID   9    AND NAME HN   ) (RESID 124    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  11    AND NAME HN   ) (RESID 129    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  12    AND NAME HN   ) (RESID  25    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  14    AND NAME HN   ) (RESID  25    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  17    AND NAME HN   ) (RESID  12    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  12    AND NAME HA   )   7.2  5.4  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  25    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  19    AND NAME HN   ) (RESID  25    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  19    AND NAME HN   ) (RESID  28    AND NAME HD1  )   7.2  5.4  0.3
ASSIGN (RESID  20    AND NAME HN   ) (RESID  28    AND NAME HZ2  )   4.2  2.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  19    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID 120    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HN   ) (RESID 105    AND NAME HE#  )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID  56    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  31    AND NAME HN   ) (RESID 105    AND NAME HE#  )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID 111    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID 111    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID  39    AND NAME HN   ) (RESID   2    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  39    AND NAME HN   ) (RESID   2    AND NAME HG1# )   5.2  3.4  1.8
ASSIGN (RESID  39    AND NAME HN   ) (RESID   2    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  39    AND NAME HN   ) (RESID  55    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  39    AND NAME HN   ) (RESID  55    AND NAME HD#  )   5.2  3.4  1.8
ASSIGN (RESID  40    AND NAME HN   ) (RESID  55    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  42    AND NAME HN   ) (RESID  54    AND NAME HN   )   7.2  5.4  0.3
ASSIGN (RESID  45    AND NAME HN   ) (RESID  51    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  46    AND NAME HN   ) (RESID  51    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  54    AND NAME HN   ) (RESID  42    AND NAME HB#  )   5.2  3.4  1.8
ASSIGN (RESID  59    AND NAME HN   ) (RESID  98    AND NAME HD#  )   5.2  3.4  1.8
ASSIGN (RESID  60    AND NAME HN   ) (RESID  51    AND NAME HB   )   5.2  3.4  0.3
ASSIGN (RESID  61    AND NAME HN   ) (RESID  50    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  61    AND NAME HN   ) (RESID  50    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HN   ) (RESID  58    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  64    AND NAME HN   ) (RESID  58    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  64    AND NAME HN   ) (RESID  74    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  78    AND NAME HG1# )   5.2  3.4  1.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  79    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  65    AND NAME HN   ) (RESID  74    AND NAME HD#  )   5.2  3.4  1.3
ASSIGN (RESID  80    AND NAME HN   ) (RESID  66    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  86    AND NAME HN   ) (RESID  40    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  88    AND NAME HN   ) (RESID   3    AND NAME HE*  )   5.2  3.4  2.7
ASSIGN (RESID  88    AND NAME HN   ) (RESID   3    AND NAME HZ   )   4.2  2.4  0.3
ASSIGN (RESID  91    AND NAME HN   ) (RESID  84    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  92    AND NAME HN   ) (RESID  17    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  95    AND NAME HN   ) (RESID  17    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  98    AND NAME HN   ) (RESID 108    AND NAME HZ2  )   5.2  3.4  0.3
ASSIGN (RESID  99    AND NAME HN   ) (RESID  20    AND NAME HE*  )   5.2  3.4  2.7
ASSIGN (RESID 100    AND NAME HN   ) (RESID  20    AND NAME HE*  )   5.2  3.4  2.7
ASSIGN (RESID 103    AND NAME HN   ) (RESID  98    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID 104    AND NAME HN   ) (RESID  99    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 104    AND NAME HN   ) (RESID  99    AND NAME HG*  )   4.2  2.4  2.7
ASSIGN (RESID 111    AND NAME HN   ) (RESID  31    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID 116    AND NAME HN   ) (RESID 111    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID   6    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID 128    AND NAME HN   ) (RESID   6    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID 128    AND NAME HN   ) (RESID   6    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 129    AND NAME HN   ) (RESID   6    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID   2    AND NAME HN   ) (RESID   1    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID   2    AND NAME HN   ) (RESID   1    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID   3    AND NAME HN   ) (RESID   3    AND NAME HE*  )   5.2  3.4  2.7
ASSIGN (RESID   3    AND NAME HN   ) (RESID   4    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID   3    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID   3    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID   5    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID   7    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID   7    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   4    AND NAME HN   ) (RESID   3    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   5    AND NAME HN   ) (RESID   5    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID   5    AND NAME HN   ) (RESID   5    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID   6    AND NAME HN   ) (RESID   4    AND NAME HA#  )   5.2  3.4  1.3
ASSIGN (RESID   6    AND NAME HN   ) (RESID   5    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID   6    AND NAME HN   ) (RESID   5    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID   6    AND NAME HN   ) (RESID   9    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID   7    AND NAME HN   ) (RESID   3    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID   7    AND NAME HN   ) (RESID   4    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID   7    AND NAME HN   ) (RESID   6    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   7    AND NAME HN   ) (RESID   7    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID   5    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID   7    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   8    AND NAME HN   ) (RESID   7    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID   6    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID   6    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID   7    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID  12    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID   9    AND NAME HN   ) (RESID   5    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  10    AND NAME HN   ) (RESID   8    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  11    AND NAME HN   ) (RESID   9    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  11    AND NAME HN   ) (RESID  12    AND NAME HG#  )   5.2  3.4  1.3
ASSIGN (RESID  11    AND NAME HN   ) (RESID   8    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  12    AND NAME HN   ) (RESID   8    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  12    AND NAME HN   ) (RESID  12    AND NAME HG#  )   2.7  0.9  1.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID   9    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  11    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  12    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  15    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  13    AND NAME HN   ) (RESID  16    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  14    AND NAME HN   ) (RESID  12    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  14    AND NAME HN   ) (RESID  13    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  14    AND NAME HN   ) (RESID  16    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  14    AND NAME HN   ) (RESID  15    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  12    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  13    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  14    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  14    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  15    AND NAME HN   ) (RESID  17    AND NAME HD*  )   7.2  5.4  2.7
ASSIGN (RESID  16    AND NAME HN   ) (RESID  15    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  16    AND NAME HN   ) (RESID  18    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  16    AND NAME HN   ) (RESID  17    AND NAME HG   )   4.2  2.4  0.3
ASSIGN (RESID  16    AND NAME HN   ) (RESID  15    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  16    AND NAME HN   ) (RESID  15    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  16    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  18    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  17    AND NAME HN   ) (RESID  18    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID  18    AND NAME HN   ) (RESID  19    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  18    AND NAME HN   ) (RESID  20    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  20    AND NAME HN   ) (RESID  17    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  20    AND NAME HN   ) (RESID  19    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  20    AND NAME HN   ) (RESID  19    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  20    AND NAME HN   ) (RESID  23    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  21    AND NAME HN   ) (RESID  20    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  21    AND NAME HN   ) (RESID  20    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  21    AND NAME HN   ) (RESID  21    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  21    AND NAME HN   ) (RESID  21    AND NAME HG#  )   5.2  3.4  1.3
ASSIGN (RESID  22    AND NAME HN   ) (RESID  19    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  22    AND NAME HN   ) (RESID  20    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  22    AND NAME HN   ) (RESID  20    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  22    AND NAME HN   ) (RESID  21    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  19    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  20    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  22    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  23    AND NAME HN   ) (RESID  21    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  23    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  23    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  24    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  24    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  25    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  27    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  27    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  27    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  24    AND NAME HN   ) (RESID  27    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  25    AND NAME HN   ) (RESID  24    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID  26    AND NAME HN   ) (RESID  27    AND NAME HD#  )   5.2  3.4  1.3
ASSIGN (RESID  26    AND NAME HN   ) (RESID  28    AND NAME HD1  )   5.2  3.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  25    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  26    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  27    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  29    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  27    AND NAME HN   ) (RESID  28    AND NAME HD1  )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HN   ) (RESID  25    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HN   ) (RESID  27    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  28    AND NAME HN   ) (RESID  29    AND NAME HB   )   5.2  3.4  0.3
ASSIGN (RESID  28    AND NAME HN   ) (RESID  29    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  28    AND NAME HN   ) (RESID  30    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  29    AND NAME HN   ) (RESID  28    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  29    AND NAME HN   ) (RESID  30    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID  29    AND NAME HN   ) (RESID  30    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID  29    AND NAME HN   ) (RESID  25    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  29    AND NAME HN   ) (RESID  28    AND NAME HD1  )   5.2  3.4  0.3
ASSIGN (RESID  30    AND NAME HN   ) (RESID  31    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID  27    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID  29    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID  30    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  31    AND NAME HN   ) (RESID  33    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  32    AND NAME HN   ) (RESID  30    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  32    AND NAME HN   ) (RESID  29    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  32    AND NAME HN   ) (RESID  31    AND NAME HB#  )   2.2  0.4  1.8
ASSIGN (RESID  33    AND NAME HN   ) (RESID  31    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  33    AND NAME HN   ) (RESID  29    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  33    AND NAME HN   ) (RESID  33    AND NAME HB1  )   2.7  0.9  0.3
ASSIGN (RESID  33    AND NAME HN   ) (RESID  33    AND NAME HB2  )   2.7  0.9  0.3
ASSIGN (RESID  33    AND NAME HN   ) (RESID  33    AND NAME HD#  )   5.2  3.4  1.3
ASSIGN (RESID  33    AND NAME HN   ) (RESID  33    AND NAME HG#  )   5.2  3.4  1.3
ASSIGN (RESID  33    AND NAME HN   ) (RESID  35    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  34    AND NAME HN   ) (RESID  32    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  34    AND NAME HN   ) (RESID  33    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  34    AND NAME HN   ) (RESID  33    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  34    AND NAME HN   ) (RESID  33    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  35    AND NAME HN   ) (RESID  32    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  35    AND NAME HN   ) (RESID  33    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  35    AND NAME HN   ) (RESID  34    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  35    AND NAME HN   ) (RESID  35    AND NAME HG#  )   2.7  0.9  1.3
ASSIGN (RESID  35    AND NAME HN   ) (RESID  37    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HN   ) (RESID  32    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  36    AND NAME HN   ) (RESID  32    AND NAME HB#  )   5.2  3.4  1.8
ASSIGN (RESID  36    AND NAME HN   ) (RESID  35    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  36    AND NAME HN   ) (RESID  34    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  38    AND NAME HN   ) (RESID  38    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  39    AND NAME HN   ) (RESID  38    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  39    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  39    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  39    AND NAME HD#  )   5.2  3.4  1.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  41    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  41    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID  40    AND NAME HN   ) (RESID  41    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  41    AND NAME HN   ) (RESID  40    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  41    AND NAME HN   ) (RESID  40    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  41    AND NAME HN   ) (RESID  41    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  42    AND NAME HN   ) (RESID  39    AND NAME HD#  )   5.2  3.4  1.3
ASSIGN (RESID  42    AND NAME HN   ) (RESID  40    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  42    AND NAME HN   ) (RESID  41    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  42    AND NAME HN   ) (RESID  41    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  42    AND NAME HN   ) (RESID  43    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  43    AND NAME HN   ) (RESID  44    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  44    AND NAME HN   ) (RESID  43    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  44    AND NAME HN   ) (RESID  43    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  46    AND NAME HN   ) (RESID  45    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  46    AND NAME HN   ) (RESID  46    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  46    AND NAME HN   ) (RESID  50    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  47    AND NAME HN   ) (RESID  46    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  48    AND NAME HN   ) (RESID  47    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  48    AND NAME HN   ) (RESID  47    AND NAME HG2# )   4.2  2.4  1.8
ASSIGN (RESID  48    AND NAME HN   ) (RESID  50    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  49    AND NAME HN   ) (RESID  47    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  49    AND NAME HN   ) (RESID  48    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  49    AND NAME HN   ) (RESID  48    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID  49    AND NAME HN   ) (RESID  48    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID  50    AND NAME HN   ) (RESID  49    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  51    AND NAME HN   ) (RESID  52    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  51    AND NAME HN   ) (RESID  52    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  52    AND NAME HN   ) (RESID  53    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  52    AND NAME HN   ) (RESID  53    AND NAME HE*  )   5.2  3.4  2.7
ASSIGN (RESID  53    AND NAME HN   ) (RESID  51    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  54    AND NAME HN   ) (RESID  52    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  54    AND NAME HN   ) (RESID  57    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  54    AND NAME HN   ) (RESID  53    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  54    AND NAME HN   ) (RESID  53    AND NAME HE*  )   5.2  3.4  2.7
ASSIGN (RESID  54    AND NAME HN   ) (RESID  53    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  56    AND NAME HN   ) (RESID  55    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  56    AND NAME HN   ) (RESID  55    AND NAME HB   )   5.2  3.4  0.3
ASSIGN (RESID  56    AND NAME HN   ) (RESID  57    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  56    AND NAME HN   ) (RESID  58    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  57    AND NAME HN   ) (RESID  57    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID  60    AND NAME HN   ) (RESID  61    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID  62    AND NAME HN   ) (RESID  61    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  62    AND NAME HN   ) (RESID  62    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  62    AND NAME HN   ) (RESID  63    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HN   ) (RESID  62    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  63    AND NAME HN   ) (RESID  62    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HN   ) (RESID  63    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  63    AND NAME HN   ) (RESID  64    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  64    AND NAME HN   ) (RESID  65    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  67    AND NAME HN   ) (RESID  68    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  67    AND NAME HN   ) (RESID  69    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  68    AND NAME HN   ) (RESID  67    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID  68    AND NAME HN   ) (RESID  69    AND NAME HN   )   2.2  0.4  0.3
ASSIGN (RESID  69    AND NAME HN   ) (RESID  68    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  69    AND NAME HN   ) (RESID  70    AND NAME HD#  )   5.2  3.4  1.3
ASSIGN (RESID  69    AND NAME HN   ) (RESID  69    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  71    AND NAME HN   ) (RESID  69    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  71    AND NAME HN   ) (RESID  70    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  72    AND NAME HN   ) (RESID  69    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  72    AND NAME HN   ) (RESID  70    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID  72    AND NAME HN   ) (RESID  73    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  73    AND NAME HN   ) (RESID  73    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  73    AND NAME HN   ) (RESID  73    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  73    AND NAME HN   ) (RESID  74    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  74    AND NAME HN   ) (RESID  73    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  74    AND NAME HN   ) (RESID  75    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID  74    AND NAME HN   ) (RESID  75    AND NAME HG   )   4.2  2.4  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  76    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  75    AND NAME HN   ) (RESID  77    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  77    AND NAME HN   ) (RESID  77    AND NAME HA   )   2.2  0.4  0.3
ASSIGN (RESID  77    AND NAME HN   ) (RESID  78    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID  77    AND NAME HN   ) (RESID  78    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID  78    AND NAME HN   ) (RESID  79    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  80    AND NAME HN   ) (RESID  79    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  80    AND NAME HN   ) (RESID  80    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  80    AND NAME HN   ) (RESID  80    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  80    AND NAME HN   ) (RESID  82    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  79    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  79    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  80    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  80    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  81    AND NAME HN   ) (RESID  84    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  82    AND NAME HN   ) (RESID  81    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  82    AND NAME HN   ) (RESID  79    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  82    AND NAME HN   ) (RESID  83    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  82    AND NAME HN   ) (RESID  84    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  83    AND NAME HN   ) (RESID  85    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  84    AND NAME HN   ) (RESID  85    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID  85    AND NAME HN   ) (RESID  84    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID  85    AND NAME HN   ) (RESID  84    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID  85    AND NAME HN   ) (RESID  84    AND NAME HG   )   4.2  2.4  0.3
ASSIGN (RESID  85    AND NAME HN   ) (RESID  86    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  86    AND NAME HN   ) (RESID  87    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  86    AND NAME HN   ) (RESID  87    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID  86    AND NAME HN   ) (RESID  87    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID  88    AND NAME HN   ) (RESID  87    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID  88    AND NAME HN   ) (RESID  88    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID  88    AND NAME HN   ) (RESID  89    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  89    AND NAME HN   ) (RESID  88    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  89    AND NAME HN   ) (RESID  87    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  89    AND NAME HN   ) (RESID  90    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  89    AND NAME HN   ) (RESID  91    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  90    AND NAME HN   ) (RESID  87    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  91    AND NAME HN   ) (RESID  93    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  91    AND NAME HN   ) (RESID  89    AND NAME HA   )   7.2  5.4  0.3
ASSIGN (RESID  92    AND NAME HN   ) (RESID  88    AND NAME HD#  )   5.2  3.4  1.8
ASSIGN (RESID  92    AND NAME HN   ) (RESID  88    AND NAME HG*  )   5.2  3.4  0.3
ASSIGN (RESID  92    AND NAME HN   ) (RESID  93    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  93    AND NAME HN   ) (RESID  92    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  94    AND NAME HN   ) (RESID  93    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  94    AND NAME HN   ) (RESID  95    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID  94    AND NAME HN   ) (RESID  92    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  95    AND NAME HN   ) (RESID  93    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  95    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  92    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  94    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  96    AND NAME HD#  )   4.2  2.4  1.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  96    AND NAME HG#  )   5.2  3.4  1.3
ASSIGN (RESID  96    AND NAME HN   ) (RESID  94    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  97    AND NAME HN   ) (RESID  96    AND NAME HG#  )   5.2  3.4  1.3
ASSIGN (RESID  97    AND NAME HN   ) (RESID  97    AND NAME HB#  )   2.7  0.9  1.3
ASSIGN (RESID  97    AND NAME HN   ) (RESID  93    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  97    AND NAME HN   ) (RESID  96    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  98    AND NAME HN   ) (RESID  99    AND NAME HB   )   5.2  3.4  0.3
ASSIGN (RESID  98    AND NAME HN   ) (RESID  99    AND NAME HG*  )   5.2  3.4  2.7
ASSIGN (RESID  98    AND NAME HN   ) (RESID 100    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID  98    AND NAME HN   ) (RESID  96    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID  99    AND NAME HN   ) (RESID  98    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID  99    AND NAME HN   ) (RESID  97    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 100    AND NAME HN   ) (RESID  97    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID 100    AND NAME HN   ) (RESID  99    AND NAME HG*  )   4.2  2.4  2.7
ASSIGN (RESID 101    AND NAME HN   ) (RESID 100    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 102    AND NAME HN   ) (RESID 100    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 102    AND NAME HN   ) (RESID 101    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 102    AND NAME HN   ) (RESID 103    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 103    AND NAME HN   ) (RESID  99    AND NAME HG*  )   4.2  2.4  2.7
ASSIGN (RESID 103    AND NAME HN   ) (RESID 102    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID 103    AND NAME HN   ) (RESID 103    AND NAME HD#  )   5.2  3.4  1.3
ASSIGN (RESID 104    AND NAME HN   ) (RESID 103    AND NAME HA   )   2.7  0.9  0.3
ASSIGN (RESID 104    AND NAME HN   ) (RESID 106    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 105    AND NAME HG#  )   5.2  3.4  1.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 106    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 106    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 106    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 107    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 105    AND NAME HN   ) (RESID 105    AND NAME HE#  )   4.2  2.4  0.3
ASSIGN (RESID 107    AND NAME HN   ) (RESID 106    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID 107    AND NAME HN   ) (RESID 106    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID 107    AND NAME HN   ) (RESID 108    AND NAME HE3  )   4.2  2.4  0.3
ASSIGN (RESID 107    AND NAME HN   ) (RESID 108    AND NAME HZ3  )   4.2  2.4  0.3
ASSIGN (RESID 108    AND NAME HN   ) (RESID 106    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 108    AND NAME HN   ) (RESID 109    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 108    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 108    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 109    AND NAME HN   ) (RESID 110    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID 110    AND NAME HN   ) (RESID 108    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 110    AND NAME HN   ) (RESID 108    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 110    AND NAME HN   ) (RESID 112    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 111    AND NAME HN   ) (RESID 108    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 111    AND NAME HN   ) (RESID 112    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 111    AND NAME HN   ) (RESID 110    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 111    AND NAME HN   ) (RESID 110    AND NAME HB#  )   4.2  2.4  1.8
ASSIGN (RESID 112    AND NAME HN   ) (RESID 111    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 112    AND NAME HN   ) (RESID 110    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 112    AND NAME HN   ) (RESID 112    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 110    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 112    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 114    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 114    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 115    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 113    AND NAME HN   ) (RESID 109    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 114    AND NAME HN   ) (RESID 111    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 114    AND NAME HN   ) (RESID 116    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 115    AND NAME HN   ) (RESID 114    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 115    AND NAME HN   ) (RESID 116    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID 115    AND NAME HN   ) (RESID 116    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 115    AND NAME HN   ) (RESID 116    AND NAME HN   )   2.7  0.9  0.3
ASSIGN (RESID 115    AND NAME HN   ) (RESID 111    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 116    AND NAME HN   ) (RESID 115    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 116    AND NAME HN   ) (RESID 116    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID 116    AND NAME HN   ) (RESID 113    AND NAME HN   )   5.2  3.4  0.3
ASSIGN (RESID 117    AND NAME HN   ) (RESID 116    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID 118    AND NAME HN   ) (RESID 116    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 118    AND NAME HN   ) (RESID 117    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID 119    AND NAME HN   ) (RESID 120    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 119    AND NAME HB1  )   4.2  2.4  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 119    AND NAME HB2  )   4.2  2.4  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 120    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 122    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 120    AND NAME HN   ) (RESID 123    AND NAME HN   )   4.2  2.4  0.3
ASSIGN (RESID 121    AND NAME HN   ) (RESID 121    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID 122    AND NAME HN   ) (RESID 119    AND NAME HA   )   5.2  3.4  0.3
ASSIGN (RESID 122    AND NAME HN   ) (RESID 121    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 122    AND NAME HN   ) (RESID 121    AND NAME HG#  )   4.2  2.4  1.3
ASSIGN (RESID 123    AND NAME HN   ) (RESID 124    AND NAME HD#  )   5.2  3.4  1.8
ASSIGN (RESID 123    AND NAME HN   ) (RESID 124    AND NAME HG2# )   5.2  3.4  1.8
ASSIGN (RESID 123    AND NAME HN   ) (RESID 125    AND NAME HB#  )   5.2  3.4  1.3
ASSIGN (RESID 124    AND NAME HN   ) (RESID 121    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 124    AND NAME HN   ) (RESID 122    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 124    AND NAME HN   ) (RESID 123    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 124    AND NAME HN   ) (RESID 125    AND NAME HB#  )   4.2  2.4  1.3
ASSIGN (RESID 125    AND NAME HN   ) (RESID 122    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 125    AND NAME HN   ) (RESID 124    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 125    AND NAME HN   ) (RESID 124    AND NAME HD#  )   4.2  2.4  1.8
ASSIGN (RESID 125    AND NAME HN   ) (RESID 124    AND NAME HB   )   4.2  2.4  0.3
ASSIGN (RESID 125    AND NAME HN   ) (RESID 123    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID 125    AND NAME HN   ) (RESID 123    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 126    AND NAME HN   ) (RESID 127    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID 126    AND NAME HN   ) (RESID 127    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 124    AND NAME HA   )   4.2  2.4  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 124    AND NAME HB   )   5.2  3.4  0.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 126    AND NAME HA#  )   4.2  2.4  1.3
ASSIGN (RESID 127    AND NAME HN   ) (RESID 129    AND NAME HD*  )   4.2  2.4  2.7
ASSIGN (RESID 128    AND NAME HN   ) (RESID 129    AND NAME HD*  )   5.2  3.4  2.7
ASSIGN (RESID 129    AND NAME HN   ) (RESID 127    AND NAME HB1  )   5.2  3.4  0.3
ASSIGN (RESID 129    AND NAME HN   ) (RESID 127    AND NAME HB2  )   5.2  3.4  0.3
ASSIGN (RESID 129    AND NAME HN   ) (RESID 128    AND NAME HB#  )   4.2  2.4  1.3

! Dihedral angle restraints from spin-spin coupling constants
! Phi restraints

ASSIGN (RESID   1 AND NAME C) (RESID   2 AND NAME N)
       (RESID   2 AND NAME CA) (RESID   2 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID   4 AND NAME C) (RESID   5 AND NAME N)
       (RESID   5 AND NAME CA) (RESID   5 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID   5 AND NAME C) (RESID   6 AND NAME N)
       (RESID   6 AND NAME CA) (RESID   6 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID   6 AND NAME C) (RESID   7 AND NAME N)
       (RESID   7 AND NAME CA) (RESID   7 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID   7 AND NAME C) (RESID   8 AND NAME N)
       (RESID   8 AND NAME CA) (RESID   8 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID   8 AND NAME C) (RESID   9 AND NAME N)
       (RESID   9 AND NAME CA) (RESID   9 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID   9 AND NAME C) (RESID   10 AND NAME N)
       (RESID  10 AND NAME CA) (RESID   10 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  10 AND NAME C) (RESID   11 AND NAME N)
       (RESID  11 AND NAME CA) (RESID   11 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  11 AND NAME C) (RESID   12 AND NAME N)
       (RESID  12 AND NAME CA) (RESID   12 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  12 AND NAME C) (RESID   13 AND NAME N)
       (RESID  13 AND NAME CA) (RESID   13 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  13 AND NAME C) (RESID   14 AND NAME N)
       (RESID  14 AND NAME CA) (RESID   14 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  14 AND NAME C) (RESID   15 AND NAME N)
       (RESID  15  AND NAME CA) (RESID   15 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  26 AND NAME C) (RESID  27 AND NAME N)
       (RESID  27 AND NAME CA) (RESID  27 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  29 AND NAME C) (RESID   30 AND NAME N)
       (RESID  30 AND NAME CA) (RESID  30 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  30 AND NAME C) (RESID   31 AND NAME N)
       (RESID  31 AND NAME CA) (RESID   31 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  31 AND NAME C) (RESID   32 AND NAME N)
       (RESID  32 AND NAME CA) (RESID  32 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  32 AND NAME C) (RESID   33 AND NAME N)
       (RESID  33 AND NAME CA) (RESID  33 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  35 AND NAME C) (RESID  36 AND NAME N)
       (RESID  36 AND NAME CA) (RESID  36 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  38 AND NAME C) (RESID  39 AND NAME N)
       (RESID  39 AND NAME CA) (RESID  39 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  40 AND NAME C) (RESID  41 AND NAME N)
       (RESID  41 AND NAME CA) (RESID  41 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  42 AND NAME C) (RESID  43 AND NAME N)
       (RESID  43 AND NAME CA) (RESID  43 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  43 AND NAME C) (RESID  44 AND NAME N)
       (RESID  44 AND NAME CA) (RESID  44 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  45 AND NAME C) (RESID  46 AND NAME N)
       (RESID  46 AND NAME CA) (RESID  46 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  50 AND NAME C) (RESID  51 AND NAME N)
       (RESID  51 AND NAME CA) (RESID  51 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  51 AND NAME C) (RESID  52 AND NAME N)
       (RESID  52 AND NAME CA) (RESID  52 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  52 AND NAME C) (RESID  53 AND NAME N)
       (RESID  53 AND NAME CA) (RESID  53 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  55 AND NAME C) (RESID  56 AND NAME N)
       (RESID  56 AND NAME CA) (RESID  56 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  61 AND NAME C) (RESID  62 AND NAME N)
       (RESID  62 AND NAME CA) (RESID  62 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  64 AND NAME C) (RESID  65 AND NAME N)
       (RESID  65 AND NAME CA) (RESID  65 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  65 AND NAME C) (RESID  66 AND NAME N)
       (RESID  66 AND NAME CA) (RESID  66 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  67 AND NAME C) (RESID  68 AND NAME N)
       (RESID  68 AND NAME CA) (RESID  68 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  68 AND NAME C) (RESID  69 AND NAME N)
       (RESID  69 AND NAME CA) (RESID  69 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  79 AND NAME C) (RESID  80 AND NAME N)
       (RESID  80 AND NAME CA) (RESID  80 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  80 AND NAME C) (RESID  81 AND NAME N)
       (RESID  81 AND NAME CA) (RESID  81 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  83 AND NAME C) (RESID  84 AND NAME N)
       (RESID  84 AND NAME CA) (RESID  84 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  88 AND NAME C) (RESID  89 AND NAME N)
       (RESID  89 AND NAME CA) (RESID  89 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  89 AND NAME C) (RESID  90 AND NAME N)
       (RESID  90 AND NAME CA) (RESID  90 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  92 AND NAME C) (RESID  93 AND NAME N)
       (RESID  93 AND NAME CA) (RESID  93 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  95 AND NAME C) (RESID  96 AND NAME N)
       (RESID  96 AND NAME CA) (RESID  96 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID  97 AND NAME C) (RESID  98 AND NAME N)
       (RESID  98 AND NAME CA) (RESID  98 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID 107 AND NAME C) (RESID  108 AND NAME N)
       (RESID 108 AND NAME CA) (RESID  108 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID  108 AND NAME C) (RESID  109 AND NAME N)
       (RESID  109 AND NAME CA) (RESID  109 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID 111 AND NAME C) (RESID 112 AND NAME N)
       (RESID 112 AND NAME CA) (RESID 112 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID 113 AND NAME C) (RESID  114 AND NAME N)
       (RESID 114 AND NAME CA) (RESID 114 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID 114 AND NAME C) (RESID  115 AND NAME N)
       (RESID 115 AND NAME CA) (RESID 115 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID 117 AND NAME C) (RESID  118 AND NAME N)
       (RESID 118 AND NAME CA) (RESID 118 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID 119 AND NAME C) (RESID  120 AND NAME N)
       (RESID 120 AND NAME CA) (RESID 120 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID 120 AND NAME C) (RESID  121 AND NAME N)
       (RESID 121 AND NAME CA) (RESID 121 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID 121 AND NAME C) (RESID  122 AND NAME N)
       (RESID 122 AND NAME CA) (RESID 122 AND NAME C) 1 -60.0 30.0 2
ASSIGN (RESID 123 AND NAME C) (RESID  124 AND NAME N)
       (RESID 124 AND NAME CA) (RESID 124 AND NAME C) 1 -120.0 40.0 2
ASSIGN (RESID 128 AND NAME C) (RESID  129 AND NAME N)
       (RESID 129 AND NAME CA) (RESID  129 AND NAME C) 1 -120.0 40.0 2

! CHI1 restraints (from J-coupling data).

ASSIGN (RESID   3 AND NAME N) (RESID   3 AND NAME CA)
       (RESID   3 AND NAME CB) (RESID   3 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID   6 AND NAME N) (RESID   6 AND NAME CA)
       (RESID   6 AND NAME CB) (RESID   6 AND NAME SG)  1  -60.0 30.0 2
ASSIGN (RESID  15 AND NAME N) (RESID  15 AND NAME CA)
       (RESID  15 AND NAME CB) (RESID  15 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  18 AND NAME N) (RESID  18 AND NAME CA)
       (RESID  18 AND NAME CB) (RESID  18 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  20 AND NAME N) (RESID  20 AND NAME CA)
       (RESID  20 AND NAME CB) (RESID  20 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  23 AND NAME N) (RESID  23 AND NAME CA)
       (RESID  23 AND NAME CB) (RESID  23 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  27 AND NAME N) (RESID  27 AND NAME CA)
       (RESID  27 AND NAME CB) (RESID  27 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  30 AND NAME N) (RESID  30 AND NAME CA)
       (RESID  30 AND NAME CB) (RESID  30 AND NAME SG)  1  180.0 30.0 2
ASSIGN (RESID  34 AND NAME N) (RESID  34 AND NAME CA)
       (RESID  34 AND NAME CB) (RESID  34 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  39 AND NAME N) (RESID  39 AND NAME CA)
       (RESID  39 AND NAME CB) (RESID  39 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  46 AND NAME N) (RESID  46 AND NAME CA)
       (RESID  46 AND NAME CB) (RESID  46 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  48 AND NAME N) (RESID  48 AND NAME CA)
       (RESID  48 AND NAME CB) (RESID  48 AND NAME CG)  1   60.0 30.0 2
ASSIGN (RESID  52 AND NAME N) (RESID  52 AND NAME CA)
       (RESID  52 AND NAME CB) (RESID  52 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  53 AND NAME N) (RESID  53 AND NAME CA)
       (RESID  53 AND NAME CB) (RESID  53 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  59 AND NAME N) (RESID  59 AND NAME CA)
       (RESID  59 AND NAME CB) (RESID  59 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  61 AND NAME N) (RESID  61 AND NAME CA)
       (RESID  61 AND NAME CB) (RESID  61 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  64 AND NAME N) (RESID  64 AND NAME CA)
       (RESID  64 AND NAME CB) (RESID  64 AND NAME SG)  1   60.0 30.0 2
ASSIGN (RESID  66 AND NAME N) (RESID  66 AND NAME CA)
       (RESID  66 AND NAME CB) (RESID  66 AND NAME CG)  1   60.0 30.0 2
ASSIGN (RESID  75 AND NAME N) (RESID  75 AND NAME CA)
       (RESID  75 AND NAME CB) (RESID  75 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  87 AND NAME N) (RESID  87 AND NAME CA)
       (RESID  87 AND NAME CB) (RESID  87 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  94 AND NAME N) (RESID  94 AND NAME CA)
       (RESID  94 AND NAME CB) (RESID  94 AND NAME SG)  1  180.0 30.0 2
ASSIGN (RESID 119 AND NAME N) (RESID 119 AND NAME CA)
       (RESID 119 AND NAME CB) (RESID 119 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID 123 AND NAME N) (RESID 123 AND NAME CA)
       (RESID 123 AND NAME CB) (RESID 123 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID 127 AND NAME N) (RESID 127 AND NAME CA)
       (RESID 127 AND NAME CB) (RESID 127 AND NAME SG)  1  -60.0 30.0 2
ASSIGN (RESID   2 AND NAME N) (RESID   2 AND NAME CA)
       (RESID   2 AND NAME CB) (RESID   2 AND NAME CG1) 1  180.0 30.0 2
ASSIGN (RESID   8 AND NAME N) (RESID   8 AND NAME CA)
       (RESID   8 AND NAME CB) (RESID   8 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  12 AND NAME N) (RESID  12 AND NAME CA)
       (RESID  12 AND NAME CB) (RESID  12 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  17 AND NAME N) (RESID  17 AND NAME CA)
       (RESID  17 AND NAME CB) (RESID  17 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  24 AND NAME N) (RESID  24 AND NAME CA)
       (RESID  24 AND NAME CB) (RESID  24 AND NAME OG)  1   60.0 30.0 2
ASSIGN (RESID  28 AND NAME N) (RESID  28 AND NAME CA)
       (RESID  28 AND NAME CB) (RESID  28 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  29 AND NAME N) (RESID  29 AND NAME CA)
       (RESID  29 AND NAME CB) (RESID  29 AND NAME CG1) 1  180.0 30.0 2
ASSIGN (RESID  33 AND NAME N) (RESID  33 AND NAME CA)
       (RESID  33 AND NAME CB) (RESID  33 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  36 AND NAME N) (RESID  36 AND NAME CA)
       (RESID  36 AND NAME CB) (RESID  36 AND NAME OG)  1   60.0 30.0 2
ASSIGN (RESID  38 AND NAME N) (RESID  38 AND NAME CA)
       (RESID  38 AND NAME CB) (RESID  38 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  40 AND NAME N) (RESID  40 AND NAME CA)
       (RESID  40 AND NAME CB) (RESID  40 AND NAME OG1) 1   60.0 30.0 2
ASSIGN (RESID  41 AND NAME N) (RESID  41 AND NAME CA)
       (RESID  41 AND NAME CB) (RESID  41 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  43 AND NAME N) (RESID  43 AND NAME CA)
       (RESID  43 AND NAME CB) (RESID  43 AND NAME OG1) 1   60.0 30.0 2
ASSIGN (RESID  47 AND NAME N) (RESID  47 AND NAME CA)
       (RESID  47 AND NAME CB) (RESID  47 AND NAME OG1)  1   60.0 30.0 2
ASSIGN (RESID  50 AND NAME N) (RESID  50 AND NAME CA)
       (RESID  50 AND NAME CB) (RESID  50 AND NAME OG)  1   60.0 30.0 2
ASSIGN (RESID  51 AND NAME N) (RESID  51 AND NAME CA)
       (RESID  51 AND NAME CB) (RESID  51 AND NAME OG1) 1  -60.0 30.0 2
ASSIGN (RESID  57 AND NAME N) (RESID  57 AND NAME CA)
       (RESID  57 AND NAME CB) (RESID  57 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  60 AND NAME N) (RESID  60 AND NAME CA)
       (RESID  60 AND NAME CB) (RESID  60 AND NAME OG)  1   60.0 30.0 2
ASSIGN (RESID  65 AND NAME N) (RESID  65 AND NAME CA)
       (RESID  65 AND NAME CB) (RESID  65 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  69 AND NAME N) (RESID  69 AND NAME CA)
       (RESID  69 AND NAME CB) (RESID  69 AND NAME OG1) 1  -60.0 30.0 2
ASSIGN (RESID  74 AND NAME N) (RESID  74 AND NAME CA)
       (RESID  74 AND NAME CB) (RESID  74 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID  80 AND NAME N) (RESID  80 AND NAME CA)
       (RESID  80 AND NAME CB) (RESID  80 AND NAME SG)  1  -60.0 30.0 2
ASSIGN (RESID  81 AND NAME N) (RESID  81 AND NAME CA)
       (RESID  81 AND NAME CB) (RESID  81 AND NAME OG)  1   60.0 30.0 2
ASSIGN (RESID  84 AND NAME N) (RESID  84 AND NAME CA)
       (RESID  84 AND NAME CB) (RESID  84 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID  88 AND NAME N) (RESID  88 AND NAME CA)
       (RESID  88 AND NAME CB) (RESID  88 AND NAME CG1)  1   60.0 30.0 2
ASSIGN (RESID  89 AND NAME N) (RESID  89 AND NAME CA)
       (RESID  89 AND NAME CB) (RESID  89 AND NAME OG1) 1  -60.0 30.0 2
ASSIGN (RESID  92 AND NAME N) (RESID  92 AND NAME CA)
       (RESID  92 AND NAME CB) (RESID  92 AND NAME CG1) 1  180.0 30.0 2
ASSIGN (RESID 105 AND NAME N) (RESID 105 AND NAME CA)
       (RESID 105 AND NAME CB) (RESID 105 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID 106 AND NAME N) (RESID 106 AND NAME CA)
       (RESID 106 AND NAME CB) (RESID 106 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID 111 AND NAME N) (RESID 111 AND NAME CA)
       (RESID 111 AND NAME CB) (RESID 111 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID 114 AND NAME N) (RESID 114 AND NAME CA)
       (RESID 114 AND NAME CB) (RESID 114 AND NAME CG)  1  -60.0 30.0 2
ASSIGN (RESID 116 AND NAME N) (RESID 116 AND NAME CA)
       (RESID 116 AND NAME CB) (RESID 116 AND NAME CG)  1  180.0 30.0 2
ASSIGN (RESID 118 AND NAME N) (RESID 118 AND NAME CA)
       (RESID 118 AND NAME CB) (RESID 118 AND NAME OG1) 1   60.0 30.0 2
ASSIGN (RESID 120 AND NAME N) (RESID 120 AND NAME CA)
       (RESID 120 AND NAME CB) (RESID 120 AND NAME CG1) 1  -60.0 30.0 2
ASSIGN (RESID 124 AND NAME N) (RESID 124 AND NAME CA)
       (RESID 124 AND NAME CB) (RESID 124 AND NAME CG1) 1  60.0 30.0 2

! Hydrogen bond restraints

!* H-bonds in first helix.
ASSIGN (RESID  10    AND NAME HN   ) (RESID   6    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  10    AND NAME N    ) (RESID   6    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  11    AND NAME HN   ) (RESID   7    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  11    AND NAME N    ) (RESID   7    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  12    AND NAME HN   ) (RESID   8    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  12    AND NAME N    ) (RESID   8    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  13    AND NAME HN   ) (RESID   9    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  13    AND NAME N    ) (RESID   9    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  14    AND NAME HN   ) (RESID  10    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  14    AND NAME N    ) (RESID  10    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  15    AND NAME HN   ) (RESID  11    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  15    AND NAME N    ) (RESID  11    AND NAME O    )  2.8 0.5 0.5
!* H-bonds in second helix.
ASSIGN (RESID  29    AND NAME HN   ) (RESID  25    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  29    AND NAME N    ) (RESID  25    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  30    AND NAME HN   ) (RESID  26    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  30    AND NAME N    ) (RESID  26    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  31    AND NAME HN   ) (RESID  27    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  31    AND NAME N    ) (RESID  27    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  32    AND NAME HN   ) (RESID  28    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  32    AND NAME N    ) (RESID  28    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  33    AND NAME HN   ) (RESID  29    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  33    AND NAME N    ) (RESID  29    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  34    AND NAME HN   ) (RESID  30    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  34    AND NAME N    ) (RESID  30    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  35    AND NAME HN   ) (RESID  31    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  35    AND NAME N    ) (RESID  31    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  36    AND NAME HN   ) (RESID  32    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  36    AND NAME N    ) (RESID  32    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  37    AND NAME HN   ) (RESID  33    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  37    AND NAME N    ) (RESID  33    AND NAME O    )  2.8 0.5 0.5
!* H-bonds for third helix.
ASSIGN (RESID  93    AND NAME HN   ) (RESID  89    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  93    AND NAME N    ) (RESID  89    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  94    AND NAME HN   ) (RESID  90    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  94    AND NAME N    ) (RESID  90    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  95    AND NAME HN   ) (RESID  91    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  95    AND NAME N    ) (RESID  91    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  96    AND NAME HN   ) (RESID  92    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  96    AND NAME N    ) (RESID  92    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  97    AND NAME HN   ) (RESID  93    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  97    AND NAME N    ) (RESID  93    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  98    AND NAME HN   ) (RESID  94    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  98    AND NAME N    ) (RESID  94    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  99    AND NAME HN   ) (RESID  95    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  99    AND NAME N    ) (RESID  95    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID 100    AND NAME HN   ) (RESID  96    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID 100    AND NAME N    ) (RESID  96    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID 101    AND NAME HN   ) (RESID  97    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID 101    AND NAME N    ) (RESID  97    AND NAME O    )  2.8 0.5 0.5
!* H-bonds between strands 1 and 2.
ASSIGN (RESID  42    AND NAME O    ) (RESID  54    AND NAME HN   )  1.8 0.5 0.5
ASSIGN (RESID  42    AND NAME O    ) (RESID  54    AND NAME N    )  2.8 0.5 0.5
ASSIGN (RESID  44    AND NAME HN   ) (RESID  52    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  44    AND NAME N    ) (RESID  52    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  44    AND NAME O    ) (RESID  52    AND NAME HN   )  1.8 0.5 0.5
ASSIGN (RESID  44    AND NAME O    ) (RESID  52    AND NAME N    )  2.8 0.5 0.5
ASSIGN (RESID  46    AND NAME HN   ) (RESID  50    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  46    AND NAME N    ) (RESID  50    AND NAME O    )  2.8 0.5 0.5
!* H-bonds between strands 2 and 3.
ASSIGN (RESID  53    AND NAME HN   ) (RESID  58    AND NAME O    )  1.8 0.5 0.5
ASSIGN (RESID  53    AND NAME N    ) (RESID  58    AND NAME O    )  2.8 0.5 0.5
ASSIGN (RESID  53    AND NAME O    ) (RESID  58    AND NAME HN   )  1.8 0.5 0.5
ASSIGN (RESID  53    AND NAME O    ) (RESID  58    AND NAME N    )  2.8 0.5 0.5

! Restraints from residual dipolar couplings

!  5% DMPC:DHPC (2.9:1.0)

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 2    and name N   )
       ( resid 2    and name HN  )  -16.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 3    and name N   )
       ( resid 3    and name HN  )  2.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 4    and name N   )
       ( resid 4    and name HN  )   -9.7    2.0
       
assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 6    and name N   )
       ( resid 6    and name HN  )   -18.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 7    and name N   )
       ( resid 7    and name HN  )   -18.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 8    and name N   )
       ( resid 8    and name HN  )   -16.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 9    and name N   )
       ( resid 9    and name HN  )   -16.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 10   and name N   )
       ( resid 10   and name HN  )    -22.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 12   and name N   )
       ( resid 12   and name HN  )    -14.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 14   and name N   )
       ( resid 14   and name HN  )   -23.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 15   and name N   )
       ( resid 15   and name HN  )   -19.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 16   and name N   )
       ( resid 16   and name HN  )   9.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 17   and name N   )
       ( resid 17   and name HN  )   -20.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 18   and name N   )
       ( resid 18   and name HN  )    -9.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 19   and name N   )
       ( resid 19   and name HN  )    -10.2    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 20   and name N   )
       ( resid 20   and name HN  )    -22.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 21   and name N   )
       ( resid 21   and name HN  )  -9.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 22   and name N   )
       ( resid 22   and name HN  )  -6.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 23   and name N   )
       ( resid 23   and name HN  )   6.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 25   and name N   )
       ( resid 25   and name HN  )   9.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 26   and name N   )
       ( resid 26   and name HN  )   16.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 27   and name N   )
       ( resid 27   and name HN  )   -8.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 28   and name N   )
       ( resid 28   and name HN  )    14.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 29   and name N   )
       ( resid 29   and name HN  )    15.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 30   and name N   )
       ( resid 30   and name HN  )    -1.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 31   and name N   )
       ( resid 31   and name HN  )    -5.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 32   and name N   )
       ( resid 32   and name HN  )    13.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 33   and name N   )
       ( resid 33   and name HN  )   7.6    2.0
       
assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 34   and name N   )
       ( resid 34   and name HN  )   -5.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 35   and name N   )
       ( resid 35   and name HN  )   9.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 36   and name N   )
       ( resid 36   and name HN  )    18.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 37   and name N   )
       ( resid 37   and name HN  )   -14.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 38   and name N   )
       ( resid 38   and name HN  )   -14.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 39   and name N   )
       ( resid 39   and name HN  )   -7.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 40   and name N   )
       ( resid 40   and name HN  )    -0.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 41   and name N   )
       ( resid 41   and name HN  )    2.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 42   and name N   )
       ( resid 42   and name HN  )   24.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 43   and name N   )
       ( resid 43   and name HN  )    -23.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 44   and name N   )
       ( resid 44   and name HN  )   -21.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 45   and name N   )
       ( resid 45   and name HN  )   -22.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 46   and name N   )
       ( resid 46   and name HN  )   -9.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 49   and name N   )
       ( resid 49   and name HN  )   -4.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 50   and name N   )
       ( resid 50   and name HN  )   -8.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 51   and name N   )
       ( resid 51   and name HN  )   -17.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 52   and name N   )
       ( resid 52   and name HN  )    -20.0    2.0
       
assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 54   and name N   )
       ( resid 54   and name HN  )    -10.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 55   and name N   )
       ( resid 55   and name HN  )    -10.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 56   and name N   )
       ( resid 56   and name HN  )   4.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 57   and name N   )
       ( resid 57   and name HN  )   -17.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 58   and name N   )
       ( resid 58   and name HN  )   -13.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 59   and name N   )
       ( resid 59   and name HN  )   1.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 60   and name N   )
       ( resid 60   and name HN  )  -24.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 61   and name N   )
       ( resid 61   and name HN  )   6.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 62   and name N   )
       ( resid 62   and name HN  )    -4.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 63   and name N   )
       ( resid 63   and name HN  )    -18.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 64   and name N   )
       ( resid 64   and name HN  )    -4.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 65   and name N   )
       ( resid 65   and name HN  )    2.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 66   and name N   )
       ( resid 66   and name HN  )    -7.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 67   and name N   )
       ( resid 67   and name HN  )    -15.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 68   and name N   )
       ( resid 68   and name HN  )    29.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 69   and name N   )
       ( resid 69   and name HN  )   -6.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 72   and name N   )
       ( resid 72   and name HN  )   0.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 73   and name N   )
       ( resid 73   and name HN  )   -2.2    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 74   and name N   )
       ( resid 74   and name HN  )   -16.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 76   and name N   )
       ( resid 76   and name HN  )    -7.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 77   and name N   )
       ( resid 77   and name HN  )   1.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 78   and name N   )
       ( resid 78   and name HN  )    -3.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 80   and name N   )
       ( resid 80   and name HN  )    27.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 81   and name N   )
       ( resid 81   and name HN  )    24.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 82   and name N   )
       ( resid 82   and name HN  )    -0.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 83   and name N   )
       ( resid 83   and name HN  )    29.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 84   and name N   )
       ( resid 84   and name HN  )   14.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 85   and name N   )
       ( resid 85   and name HN  )   -14.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 87   and name N   )
       ( resid 87   and name HN  )    27.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 88   and name N   )
       ( resid 88   and name HN  )   25.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 89   and name N   )
       ( resid 89   and name HN  )   -12.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 90   and name N   )
       ( resid 90   and name HN  )    -18.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 91   and name N   )
       ( resid 91   and name HN  )   -13.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 92   and name N   )
       ( resid 92   and name HN  )    -14.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 93   and name N   )
       ( resid 93   and name HN  )   -16.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 94   and name N   )
       ( resid 94   and name HN  )   -20.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 95   and name N   )
       ( resid 95   and name HN  )   -17.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 96   and name N   )
       ( resid 96   and name HN  )   -14.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 97   and name N   )
       ( resid 97   and name HN  )   -17.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 99   and name N   )
       ( resid 99   and name HN  )   -14.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 100  and name N   )
       ( resid 100  and name HN  )    -5.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 101  and name N   )
       ( resid 101  and name HN  )    -22.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 102  and name N   )
       ( resid 102  and name HN  )    4.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 104  and name N   )
       ( resid 104  and name HN  )    -10.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 105  and name N   )
       ( resid 105  and name HN  )   11.7    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 106  and name N   )
       ( resid 106  and name HN  )   -20.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 107  and name N   )
       ( resid 107  and name HN  )   -1.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 108  and name N   )
       ( resid 108  and name HN  )    12.6   2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 109  and name N   )
       ( resid 109  and name HN  )   19.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 111  and name N   )
       ( resid 111  and name HN  )   15.1    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 112  and name N   )
       ( resid 112  and name HN  )   23.8    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 113  and name N   )
       ( resid 113  and name HN  )    11.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 114  and name N   )
       ( resid 114  and name HN  )    3.6    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 115  and name N   )
       ( resid 115  and name HN  )    18.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 116  and name N   )
       ( resid 116  and name HN  )    31.5    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 118  and name N   )
       ( resid 118  and name HN  )    8.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 120  and name N   )
       ( resid 120  and name HN  )    -19.6    2.0


assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 123  and name N   )
       ( resid 123  and name HN  )    -18.3    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 124  and name N   )
       ( resid 124  and name HN  )    -8.9    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 125  and name N   )
       ( resid 125  and name HN  )   2.4    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 127  and name N   )
       ( resid 127  and name HN  )    -13.0    2.0

assign ( resid 501  and name OO  )
       ( resid 501  and name Z   )
       ( resid 501  and name X   )
       ( resid 501  and name Y   )
       ( resid 129  and name N   )
       ( resid 129  and name HN  )    10.8    2.0

! 7.5% DMPC:DHPC:CTAB (2.9:1.0:0.1)

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 2    and name N   )
       ( resid 2    and name HN  )  -7.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 3    and name N   )
       ( resid 3    and name HN  )  8.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 4    and name N   )
       ( resid 4    and name HN  )   -13.5    2.0
       
assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 6    and name N   )
       ( resid 6    and name HN  )   -5.5    2.0
       
assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 7    and name N   )
       ( resid 7    and name HN  )   -14.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 8    and name N   )
       ( resid 8    and name HN  )   -14.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 9    and name N   )
       ( resid 9    and name HN  )   -7.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 10   and name N   )
       ( resid 10   and name HN  )    -11.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 12   and name N   )
       ( resid 12   and name HN  )    -8.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 14   and name N   )
       ( resid 14   and name HN  )   -14.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 15   and name N   )
       ( resid 15   and name HN  )   -13.6    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 16   and name N   )
       ( resid 16   and name HN  )   17.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 17   and name N   )
       ( resid 17   and name HN  )   -7.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 18   and name N   )
       ( resid 18   and name HN  )    -11.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 19   and name N   )
       ( resid 19   and name HN  )    -12.7    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 20   and name N   )
       ( resid 20   and name HN  )    -13.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 21   and name N   )
       ( resid 21   and name HN  )  -14.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 22   and name N   )
       ( resid 22   and name HN  )  -9.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 23   and name N   )
       ( resid 23   and name HN  )   2.7    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 25   and name N   )
       ( resid 25   and name HN  )   1.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 26   and name N   )
       ( resid 26   and name HN  )   8.6   2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 27   and name N   )
       ( resid 27   and name HN  )   -11.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 28   and name N   )
       ( resid 28   and name HN  )    7.6    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 29   and name N   )
       ( resid 29   and name HN  )    6.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 30   and name N   )
       ( resid 30   and name HN  )    -4.3    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 31   and name N   )
       ( resid 31   and name HN  )    -7.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 32   and name N   )
       ( resid 32   and name HN  )    4.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 33   and name N   )
       ( resid 33   and name HN  )   1.1    2.0
       
assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 34   and name N   )
       ( resid 34   and name HN  )   -8.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 35   and name N   )
       ( resid 35   and name HN  )   1.2    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 36   and name N   )
       ( resid 36   and name HN  )    9.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 37   and name N   )
       ( resid 37   and name HN  )   -11.6    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 38   and name N   )
       ( resid 38   and name HN  )   -2.7    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 39   and name N   )
       ( resid 39   and name HN  )   -8.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 40   and name N   )
       ( resid 40   and name HN  )    7.3    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 41   and name N   )
       ( resid 41   and name HN  )    10.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 42   and name N   )
       ( resid 42   and name HN  )   15.6    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 43   and name N   )
       ( resid 43   and name HN  )    -15.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 44   and name N   )
       ( resid 44   and name HN  )   -14.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 46   and name N   )
       ( resid 46   and name HN  )   -9.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 49   and name N   )
       ( resid 49   and name HN  )   1.7    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 50   and name N   )
       ( resid 50   and name HN  )   -11.2    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 51   and name N   )
       ( resid 51   and name HN  )   -14.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 52   and name N   )
       ( resid 52   and name HN  )    -17.1    2.0
       
assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 54   and name N   )
       ( resid 54   and name HN  )    -11.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 55   and name N   )
       ( resid 55   and name HN  )    -13.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 56   and name N   )
       ( resid 56   and name HN  )   -0.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 57   and name N   )
       ( resid 57   and name HN  )   -6.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 58   and name N   )
       ( resid 58   and name HN  )   -7.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 59   and name N   )
       ( resid 59   and name HN  )   -1.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 60   and name N   )
       ( resid 60   and name HN  )   -12.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 61   and name N   )
       ( resid 61   and name HN  )   4.3    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 62   and name N   )
       ( resid 62   and name HN  )    2.2    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 63   and name N   )
       ( resid 63   and name HN  )    -13.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 64   and name N   )
       ( resid 64   and name HN  )    -10.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 65   and name N   )
       ( resid 65   and name HN  )    -3.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 66   and name N   )
       ( resid 66   and name HN  )    -5.6    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 67   and name N   )
       ( resid 67   and name HN  )    -11.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 68   and name N   )
       ( resid 68   and name HN  )    22.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 72   and name N   )
       ( resid 72   and name HN  )   -2.3    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 73   and name N   )
       ( resid 73   and name HN  )   -1.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 76   and name N   )
       ( resid 76   and name HN  )    -11.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 77   and name N   )
       ( resid 77   and name HN  )   0.2    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 78   and name N   )
       ( resid 78   and name HN  )    -6.7    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 80   and name N   )
       ( resid 80   and name HN  )    25.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 81   and name N   )
       ( resid 81   and name HN  )    23.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 82   and name N   )
       ( resid 82   and name HN  )    10.3    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 83   and name N   )
       ( resid 83   and name HN  )    22.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 84   and name N   )
       ( resid 84   and name HN  )   11.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 85   and name N   )
       ( resid 85   and name HN  )   -7.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 87   and name N   )
       ( resid 87   and name HN  )   22.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 89   and name N   )
       ( resid 89   and name HN  )   -6.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 90   and name N   )
       ( resid 90   and name HN  )    -11.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 91   and name N   )
       ( resid 91   and name HN  )   -2.2    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 92   and name N   )
       ( resid 92   and name HN  )    -8.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 93   and name N   )
       ( resid 93   and name HN  )   -10.6    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 94   and name N   )
       ( resid 94   and name HN  )   -10.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 95   and name N   )
       ( resid 95   and name HN  )   -7.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 96   and name N   )
       ( resid 96   and name HN  )   -11.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 97   and name N   )
       ( resid 97   and name HN  )   -11.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 99   and name N   )
       ( resid 99   and name HN  )   -7.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 100  and name N   )
       ( resid 100  and name HN  )    -5.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 101  and name N   )
       ( resid 101  and name HN  )    -11.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 102  and name N   )
       ( resid 102  and name HN  )     9.7    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 104  and name N   )
       ( resid 104  and name HN  )    -7.4    2.0


assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 105  and name N   )
       ( resid 105  and name HN  )   8.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 106  and name N   )
       ( resid 106  and name HN  )   -14.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 107  and name N   )
       ( resid 107  and name HN  )   -6.3    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 109  and name N   )
       ( resid 109  and name HN  )   11.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 110  and name N   )
       ( resid 110  and name HN  )   -3.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 111  and name N   )
       ( resid 111  and name HN  )   15.5    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 112  and name N   )
       ( resid 112  and name HN  )   16.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 113  and name N   )
       ( resid 113  and name HN  )    4.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 114  and name N   )
       ( resid 114  and name HN  )    0.0    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 116  and name N   )
       ( resid 116  and name HN  )    21.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 118  and name N   )
       ( resid 118  and name HN  )    3.9    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 120  and name N   )
       ( resid 120  and name HN  )    -7.4    2.0


assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 123  and name N   )
       ( resid 123  and name HN  )    -4.8    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 124  and name N   )
       ( resid 124  and name HN  )    -8.7    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 125  and name N   )
       ( resid 125  and name HN  )   -2.1    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 127  and name N   )
       ( resid 127  and name HN  )    -6.4    2.0

assign ( resid 502 and name OO  )
       ( resid 502 and name Z   )
       ( resid 502 and name X   )
       ( resid 502 and name Y   )
       ( resid 129  and name N   )
       ( resid 129  and name HN  )    4.5    2.0



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           H1       LYS   1  -6.582  -9.854   2.859
    2    H2   LYS   1           H2       LYS   1  -7.896 -10.770   2.314
    3    H3   LYS   1           H3       LYS   1  -6.615 -11.525   3.119
    4    HA   LYS   1           HA       LYS   1  -5.717 -11.961   1.166
    5   1HB   LYS   1          1HB       LYS   1  -8.101 -10.429   0.402
    6   2HB   LYS   1          2HB       LYS   1  -6.814 -10.373  -0.794
    7   1HG   LYS   1          1HG       LYS   1  -6.922 -12.630  -1.221
    8   2HG   LYS   1          2HG       LYS   1  -7.634 -13.000   0.351
    9   1HD   LYS   1          1HD       LYS   1  -9.467 -13.251  -1.006
   10   2HD   LYS   1          2HD       LYS   1  -9.623 -11.548  -0.570
   11   1HE   LYS   1          1HE       LYS   1  -8.003 -12.186  -2.966
   12   2HE   LYS   1          2HE       LYS   1  -9.746 -12.418  -3.093
   13   1HZ   LYS   1          1HZ       LYS   1  -9.258  -9.952  -1.853
   14   2HZ   LYS   1          2HZ       LYS   1  -8.310 -10.029  -3.251
   15   3HZ   LYS   1          3HZ       LYS   1  -9.984 -10.248  -3.352
   16    H    VAL   2           H        VAL   2  -4.043 -10.626   2.466
   17    HA   VAL   2           HA       VAL   2  -3.299  -8.167   1.047
   18    HB   VAL   2           HB       VAL   2  -2.393  -9.314   3.691
   19   1HG1  VAL   2          1HG1      VAL   2  -0.751  -7.895   2.045
   20   2HG1  VAL   2          2HG1      VAL   2  -1.499  -6.611   2.994
   21   3HG1  VAL   2          3HG1      VAL   2  -0.636  -7.918   3.805
   22   1HG2  VAL   2          1HG2      VAL   2  -4.550  -7.695   3.025
   23   2HG2  VAL   2          2HG2      VAL   2  -3.886  -7.965   4.636
   24   3HG2  VAL   2          3HG2      VAL   2  -3.343  -6.587   3.679
   25    H    PHE   3           H        PHE   3  -1.308  -7.941   0.008
   26    HA   PHE   3           HA       PHE   3  -0.044 -10.330  -0.917
   27   1HB   PHE   3          1HB       PHE   3   0.570  -7.389  -1.227
   28   2HB   PHE   3          2HB       PHE   3   1.622  -8.634  -1.881
   29    HD1  PHE   3           HD1      PHE   3   0.227 -10.482  -3.286
   30    HD2  PHE   3           HD2      PHE   3  -0.867  -6.419  -2.676
   31    HE1  PHE   3           HE1      PHE   3  -1.118 -10.537  -5.342
   32    HE2  PHE   3           HE2      PHE   3  -2.215  -6.464  -4.724
   33    HZ   PHE   3           HZ       PHE   3  -2.344  -8.527  -6.067
   34    H    GLY   4           H        GLY   4   2.353 -10.586  -0.751
   35   1HA   GLY   4          1HA       GLY   4   3.985 -11.253   0.792
   36   2HA   GLY   4          2HA       GLY   4   3.158 -10.318   2.033
   37    H    ARG   5           H        ARG   5   5.987 -10.300   1.501
   38    HA   ARG   5           HA       ARG   5   6.291  -7.436   1.057
   39   1HB   ARG   5          1HB       ARG   5   8.188  -9.541   2.105
   40   2HB   ARG   5          2HB       ARG   5   8.649  -7.863   1.848
   41   1HG   ARG   5          1HG       ARG   5   7.936  -7.397   3.887
   42   2HG   ARG   5          2HG       ARG   5   6.296  -7.805   3.379
   43   1HD   ARG   5          1HD       ARG   5   6.570  -9.240   5.151
   44   2HD   ARG   5          2HD       ARG   5   7.101 -10.259   3.814
   45    HE   ARG   5           HE       ARG   5   9.424  -9.473   4.483
   46   1HH1  ARG   5          1HH1      ARG   5   6.788  -9.804   6.737
   47   2HH1  ARG   5          2HH1      ARG   5   7.818 -10.105   8.097
   48   1HH2  ARG   5          1HH2      ARG   5  10.788  -9.868   6.267
   49   2HH2  ARG   5          2HH2      ARG   5  10.092 -10.141   7.829
   50    H    CYS   6           H        CYS   6   8.008 -10.376  -0.026
   51    HA   CYS   6           HA       CYS   6   9.080  -8.892  -2.260
   52   1HB   CYS   6          1HB       CYS   6   9.334 -11.856  -1.802
   53   2HB   CYS   6          2HB       CYS   6  10.353 -10.804  -2.780
   54    H    GLU   7           H        GLU   7   6.633 -11.373  -1.701
   55    HA   GLU   7           HA       GLU   7   6.092 -12.216  -4.260
   56   1HB   GLU   7          1HB       GLU   7   4.602 -12.015  -1.778
   57   2HB   GLU   7          2HB       GLU   7   3.557 -11.724  -3.161
   58   1HG   GLU   7          1HG       GLU   7   3.565 -13.866  -3.756
   59   2HG   GLU   7          2HG       GLU   7   5.308 -14.013  -3.536
   60    H    LEU   8           H        LEU   8   4.832  -9.339  -2.642
   61    HA   LEU   8           HA       LEU   8   3.499  -8.262  -4.879
   62   1HB   LEU   8          1HB       LEU   8   3.008  -7.597  -2.570
   63   2HB   LEU   8          2HB       LEU   8   4.604  -6.893  -2.423
   64    HG   LEU   8           HG       LEU   8   2.509  -5.384  -2.865
   65   1HD1  LEU   8          1HD1      LEU   8   5.207  -5.118  -4.151
   66   2HD1  LEU   8          2HD1      LEU   8   4.000  -3.834  -4.208
   67   3HD1  LEU   8          3HD1      LEU   8   4.623  -4.390  -2.656
   68   1HD2  LEU   8          1HD2      LEU   8   2.046  -6.822  -4.989
   69   2HD2  LEU   8          2HD2      LEU   8   1.813  -5.075  -5.038
   70   3HD2  LEU   8          3HD2      LEU   8   3.272  -5.789  -5.722
   71    H    ALA   9           H        ALA   9   6.786  -7.820  -3.572
   72    HA   ALA   9           HA       ALA   9   7.548  -5.721  -5.285
   73   1HB   ALA   9          1HB       ALA   9   9.158  -7.792  -3.835
   74   2HB   ALA   9          2HB       ALA   9   8.912  -6.094  -3.421
   75   3HB   ALA   9          3HB       ALA   9   9.897  -6.528  -4.818
   76    H    ALA  10           H        ALA  10   8.134  -9.232  -5.629
   77    HA   ALA  10           HA       ALA  10   9.470  -9.216  -8.031
   78   1HB   ALA  10          1HB       ALA  10   8.366 -11.485  -8.391
   79   2HB   ALA  10          2HB       ALA  10   9.294 -11.281  -6.906
   80   3HB   ALA  10          3HB       ALA  10   7.533 -11.200  -6.863
   81    H    ALA  11           H        ALA  11   6.027  -8.942  -7.356
   82    HA   ALA  11           HA       ALA  11   5.161  -9.090 -10.030
   83   1HB   ALA  11          1HB       ALA  11   3.680  -7.509  -7.985
   84   2HB   ALA  11          2HB       ALA  11   3.787  -9.264  -7.840
   85   3HB   ALA  11          3HB       ALA  11   3.045  -8.540  -9.267
   86    H    MET  12           H        MET  12   6.238  -6.550  -8.010
   87    HA   MET  12           HA       MET  12   5.552  -4.339  -9.622
   88   1HB   MET  12          1HB       MET  12   8.060  -4.391  -7.982
   89   2HB   MET  12          2HB       MET  12   6.996  -3.046  -8.295
   90   1HG   MET  12          1HG       MET  12   6.163  -5.412  -6.667
   91   2HG   MET  12          2HG       MET  12   6.921  -3.980  -5.974
   92   1HE   MET  12          1HE       MET  12   6.090  -1.602  -6.801
   93   2HE   MET  12          2HE       MET  12   5.270  -1.885  -8.335
   94   3HE   MET  12          3HE       MET  12   4.385  -1.189  -6.978
   95    H    LYS  13           H        LYS  13   8.581  -6.180  -9.384
   96    HA   LYS  13           HA       LYS  13  10.093  -4.841 -11.262
   97   1HB   LYS  13          1HB       LYS  13  10.761  -6.800  -9.748
   98   2HB   LYS  13          2HB       LYS  13  10.118  -7.844 -11.009
   99   1HG   LYS  13          1HG       LYS  13  11.696  -6.710 -12.605
  100   2HG   LYS  13          2HG       LYS  13  12.435  -5.941 -11.199
  101   1HD   LYS  13          1HD       LYS  13  12.455  -8.483 -10.360
  102   2HD   LYS  13          2HD       LYS  13  12.537  -8.758 -12.102
  103   1HE   LYS  13          1HE       LYS  13  14.343  -6.672 -11.510
  104   2HE   LYS  13          2HE       LYS  13  14.603  -7.931 -10.305
  105   1HZ   LYS  13          1HZ       LYS  13  14.606  -9.494 -12.325
  106   2HZ   LYS  13          2HZ       LYS  13  14.880  -8.095 -13.235
  107   3HZ   LYS  13          3HZ       LYS  13  15.981  -8.553 -12.034
  108    H    ARG  14           H        ARG  14   7.882  -7.567 -11.772
  109    HA   ARG  14           HA       ARG  14   8.202  -7.722 -14.559
  110   1HB   ARG  14          1HB       ARG  14   5.922  -8.536 -12.754
  111   2HB   ARG  14          2HB       ARG  14   5.951  -8.879 -14.478
  112   1HG   ARG  14          1HG       ARG  14   7.429 -10.553 -14.254
  113   2HG   ARG  14          2HG       ARG  14   8.347  -9.715 -13.001
  114   1HD   ARG  14          1HD       ARG  14   7.316 -11.709 -12.089
  115   2HD   ARG  14          2HD       ARG  14   6.596 -10.269 -11.370
  116    HE   ARG  14           HE       ARG  14   4.963 -10.869 -13.471
  117   1HH1  ARG  14          1HH1      ARG  14   6.120 -12.612 -10.685
  118   2HH1  ARG  14          2HH1      ARG  14   4.706 -13.604 -10.558
  119   1HH2  ARG  14          1HH2      ARG  14   3.097 -12.170 -13.310
  120   2HH2  ARG  14          2HH2      ARG  14   2.988 -13.352 -12.050
  121    H    HIS  15           H        HIS  15   6.058  -5.811 -12.499
  122    HA   HIS  15           HA       HIS  15   4.500  -4.806 -14.654
  123   1HB   HIS  15          1HB       HIS  15   4.714  -4.307 -11.730
  124   2HB   HIS  15          2HB       HIS  15   3.957  -3.060 -12.715
  125    HD1  HIS  15           HD1      HIS  15   2.589  -5.052 -10.557
  126    HD2  HIS  15           HD2      HIS  15   2.327  -5.237 -14.700
  127    HE1  HIS  15           HE1      HIS  15   0.467  -6.310 -11.041
  128    HE2  HIS  15           HE2      HIS  15   0.284  -6.333 -13.553
  129    H    GLY  16           H        GLY  16   7.687  -4.139 -13.866
  130   1HA   GLY  16          1HA       GLY  16   7.695  -1.896 -15.588
  131   2HA   GLY  16          2HA       GLY  16   9.070  -2.586 -14.755
  132    H    LEU  17           H        LEU  17   7.655  -2.091 -12.034
  133    HA   LEU  17           HA       LEU  17   7.656   0.815 -12.076
  134   1HB   LEU  17          1HB       LEU  17   7.389  -0.826  -9.588
  135   2HB   LEU  17          2HB       LEU  17   6.767   0.778  -9.913
  136    HG   LEU  17           HG       LEU  17   5.603  -1.863 -10.507
  137   1HD1  LEU  17          1HD1      LEU  17   4.923   0.131  -8.878
  138   2HD1  LEU  17          2HD1      LEU  17   4.036   0.645 -10.314
  139   3HD1  LEU  17          3HD1      LEU  17   3.730  -0.942  -9.607
  140   1HD2  LEU  17          1HD2      LEU  17   5.451   0.439 -12.438
  141   2HD2  LEU  17          2HD2      LEU  17   5.780  -1.260 -12.773
  142   3HD2  LEU  17          3HD2      LEU  17   4.158  -0.752 -12.306
  143    H    ASP  18           H        ASP  18   9.925  -1.424 -12.007
  144    HA   ASP  18           HA       ASP  18  11.620  -0.483  -9.909
  145   1HB   ASP  18          1HB       ASP  18  12.183  -2.642 -10.412
  146   2HB   ASP  18          2HB       ASP  18  11.872  -2.445 -12.126
  147    H    ASN  19           H        ASN  19  11.857   1.680 -10.125
  148    HA   ASN  19           HA       ASN  19  12.842   3.625 -10.727
  149   1HB   ASN  19          1HB       ASN  19  14.752   1.716 -11.246
  150   2HB   ASN  19          2HB       ASN  19  14.618   2.534 -12.800
  151   2HD2  ASN  19          2HD2      ASN  19  14.378   5.053 -12.406
  152   1HD2  ASN  19          1HD2      ASN  19  15.620   5.716 -11.405
  153    H    TYR  20           H        TYR  20  10.514   2.773 -12.038
  154    HA   TYR  20           HA       TYR  20  10.660   3.309 -14.832
  155   1HB   TYR  20          1HB       TYR  20   8.744   2.133 -13.693
  156   2HB   TYR  20          2HB       TYR  20   8.280   3.677 -12.987
  157    HD1  TYR  20           HD1      TYR  20   8.934   2.108 -16.314
  158    HD2  TYR  20           HD2      TYR  20   6.729   4.991 -14.094
  159    HE1  TYR  20           HE1      TYR  20   7.591   2.611 -18.311
  160    HE2  TYR  20           HE2      TYR  20   5.379   5.500 -16.084
  161    HH   TYR  20           HH       TYR  20   5.791   5.283 -18.693
  162    H    ARG  21           H        ARG  21   9.476   5.337 -15.735
  163    HA   ARG  21           HA       ARG  21  10.756   7.583 -15.569
  164   1HB   ARG  21          1HB       ARG  21   7.802   7.179 -15.658
  165   2HB   ARG  21          2HB       ARG  21   8.410   8.821 -15.500
  166   1HG   ARG  21          1HG       ARG  21   9.695   7.221 -17.599
  167   2HG   ARG  21          2HG       ARG  21   7.983   7.565 -17.853
  168   1HD   ARG  21          1HD       ARG  21   8.509   9.610 -18.533
  169   2HD   ARG  21          2HD       ARG  21   9.194   9.952 -16.946
  170    HE   ARG  21           HE       ARG  21  11.011   8.512 -18.606
  171   1HH1  ARG  21          1HH1      ARG  21   9.716  11.682 -17.962
  172   2HH1  ARG  21          2HH1      ARG  21  11.111  12.515 -18.563
  173   1HH2  ARG  21          1HH2      ARG  21  12.851   9.601 -19.397
  174   2HH2  ARG  21          2HH2      ARG  21  12.892  11.332 -19.379
  175    H    GLY  22           H        GLY  22   8.537   6.537 -13.066
  176   1HA   GLY  22          1HA       GLY  22   8.071   7.388 -10.969
  177   2HA   GLY  22          2HA       GLY  22   8.969   8.836 -11.393
  178    H    TYR  23           H        TYR  23   9.029   5.850  -9.724
  179    HA   TYR  23           HA       TYR  23  11.893   6.215  -9.171
  180   1HB   TYR  23          1HB       TYR  23   9.629   6.004  -7.228
  181   2HB   TYR  23          2HB       TYR  23  11.249   5.502  -6.758
  182    HD1  TYR  23           HD1      TYR  23   9.451   8.396  -8.281
  183    HD2  TYR  23           HD2      TYR  23  12.693   7.084  -5.860
  184    HE1  TYR  23           HE1      TYR  23  10.012  10.735  -7.780
  185    HE2  TYR  23           HE2      TYR  23  13.263   9.420  -5.350
  186    HH   TYR  23           HH       TYR  23  12.016  12.035  -7.065
  187    H    SER  24           H        SER  24  12.629   4.385  -7.577
  188    HA   SER  24           HA       SER  24  12.505   1.979  -9.114
  189   1HB   SER  24          1HB       SER  24  14.238   1.169  -7.657
  190   2HB   SER  24          2HB       SER  24  14.591   2.852  -8.045
  191    HG   SER  24           HG       SER  24  13.046   2.471  -5.792
  192    H    LEU  25           H        LEU  25  12.198  -0.123  -8.149
  193    HA   LEU  25           HA       LEU  25   9.701  -0.635  -7.250
  194   1HB   LEU  25          1HB       LEU  25  12.263  -2.138  -6.810
  195   2HB   LEU  25          2HB       LEU  25  10.734  -2.763  -6.226
  196    HG   LEU  25           HG       LEU  25  11.693  -2.440  -9.037
  197   1HD1  LEU  25          1HD1      LEU  25  11.985  -4.570  -7.836
  198   2HD1  LEU  25          2HD1      LEU  25  10.236  -4.663  -7.619
  199   3HD1  LEU  25          3HD1      LEU  25  10.927  -4.719  -9.241
  200   1HD2  LEU  25          1HD2      LEU  25   8.845  -2.403  -8.100
  201   2HD2  LEU  25          2HD2      LEU  25   9.639  -1.349  -9.268
  202   3HD2  LEU  25          3HD2      LEU  25   9.290  -3.025  -9.688
  203    H    GLY  26           H        GLY  26  12.556  -0.389  -5.104
  204   1HA   GLY  26          1HA       GLY  26  12.702   0.369  -2.935
  205   2HA   GLY  26          2HA       GLY  26  11.463  -0.846  -2.671
  206    H    ASN  27           H        ASN  27  11.135   2.186  -4.482
  207    HA   ASN  27           HA       ASN  27   9.874   3.616  -2.381
  208   1HB   ASN  27          1HB       ASN  27   9.725   4.074  -5.365
  209   2HB   ASN  27          2HB       ASN  27   9.232   5.226  -4.128
  210   2HD2  ASN  27          2HD2      ASN  27  11.897   3.699  -5.729
  211   1HD2  ASN  27          1HD2      ASN  27  13.132   4.735  -5.106
  212    H    TRP  28           H        TRP  28   8.714   1.536  -4.929
  213    HA   TRP  28           HA       TRP  28   5.942   2.121  -4.617
  214   1HB   TRP  28          1HB       TRP  28   7.331  -0.245  -5.864
  215   2HB   TRP  28          2HB       TRP  28   5.608   0.105  -5.995
  216    HD1  TRP  28           HD1      TRP  28   8.961   1.102  -7.385
  217    HE1  TRP  28           HE1      TRP  28   8.632   2.788  -9.290
  218    HE3  TRP  28           HE3      TRP  28   3.978   1.991  -6.790
  219    HZ2  TRP  28           HZ2      TRP  28   6.518   4.294 -10.418
  220    HZ3  TRP  28           HZ3      TRP  28   2.856   3.558  -8.313
  221    HH2  TRP  28           HH2      TRP  28   4.104   4.692 -10.097
  222    H    VAL  29           H        VAL  29   8.085  -0.439  -3.391
  223    HA   VAL  29           HA       VAL  29   6.048  -1.903  -2.103
  224    HB   VAL  29           HB       VAL  29   9.017  -1.795  -1.553
  225   1HG1  VAL  29          1HG1      VAL  29   6.887  -3.141  -0.164
  226   2HG1  VAL  29          2HG1      VAL  29   8.015  -4.306  -0.859
  227   3HG1  VAL  29          3HG1      VAL  29   8.604  -3.050   0.230
  228   1HG2  VAL  29          1HG2      VAL  29   7.328  -3.403  -3.427
  229   2HG2  VAL  29          2HG2      VAL  29   8.842  -2.552  -3.735
  230   3HG2  VAL  29          3HG2      VAL  29   8.847  -4.053  -2.809
  231    H    CYS  30           H        CYS  30   8.433   0.424  -0.911
  232    HA   CYS  30           HA       CYS  30   7.672   0.405   1.767
  233   1HB   CYS  30          1HB       CYS  30   9.733   1.444   0.746
  234   2HB   CYS  30          2HB       CYS  30   8.720   2.795   0.251
  235    H    ALA  31           H        ALA  31   6.587   2.518  -0.886
  236    HA   ALA  31           HA       ALA  31   4.844   4.101   0.651
  237   1HB   ALA  31          1HB       ALA  31   5.737   4.545  -1.692
  238   2HB   ALA  31          2HB       ALA  31   4.056   4.978  -1.376
  239   3HB   ALA  31          3HB       ALA  31   4.435   3.500  -2.262
  240    H    ALA  32           H        ALA  32   4.248   1.186  -1.288
  241    HA   ALA  32           HA       ALA  32   1.451   1.123  -0.822
  242   1HB   ALA  32          1HB       ALA  32   2.903  -0.073  -2.630
  243   2HB   ALA  32          2HB       ALA  32   2.996  -1.357  -1.424
  244   3HB   ALA  32          3HB       ALA  32   1.427  -0.832  -2.033
  245    H    LYS  33           H        LYS  33   4.159  -0.652   0.664
  246    HA   LYS  33           HA       LYS  33   2.837  -2.339   2.340
  247   1HB   LYS  33          1HB       LYS  33   5.280  -2.277   2.079
  248   2HB   LYS  33          2HB       LYS  33   5.337  -0.772   2.983
  249   1HG   LYS  33          1HG       LYS  33   4.522  -1.898   4.968
  250   2HG   LYS  33          2HG       LYS  33   4.371  -3.409   4.069
  251   1HD   LYS  33          1HD       LYS  33   6.813  -3.337   3.636
  252   2HD   LYS  33          2HD       LYS  33   6.918  -1.902   4.658
  253   1HE   LYS  33          1HE       LYS  33   6.621  -3.080   6.579
  254   2HE   LYS  33          2HE       LYS  33   5.578  -4.277   5.811
  255   1HZ   LYS  33          1HZ       LYS  33   8.376  -4.252   4.993
  256   2HZ   LYS  33          2HZ       LYS  33   8.051  -4.808   6.556
  257   3HZ   LYS  33          3HZ       LYS  33   7.328  -5.559   5.225
  258    H    PHE  34           H        PHE  34   3.897   0.955   3.216
  259    HA   PHE  34           HA       PHE  34   2.446   0.858   5.656
  260   1HB   PHE  34          1HB       PHE  34   4.133   2.799   4.305
  261   2HB   PHE  34          2HB       PHE  34   2.984   3.463   5.448
  262    HD1  PHE  34           HD1      PHE  34   3.000   2.463   7.809
  263    HD2  PHE  34           HD2      PHE  34   6.162   1.933   5.012
  264    HE1  PHE  34           HE1      PHE  34   4.528   1.895   9.652
  265    HE2  PHE  34           HE2      PHE  34   7.697   1.362   6.848
  266    HZ   PHE  34           HZ       PHE  34   6.880   1.342   9.172
  267    H    GLU  35           H        GLU  35   1.618   1.720   2.458
  268    HA   GLU  35           HA       GLU  35  -0.432   3.573   2.991
  269   1HB   GLU  35          1HB       GLU  35   0.683   2.168   0.744
  270   2HB   GLU  35          2HB       GLU  35  -1.072   2.126   0.660
  271   1HG   GLU  35          1HG       GLU  35  -1.243   4.443   0.532
  272   2HG   GLU  35          2HG       GLU  35   0.389   4.690   1.155
  273    H    SER  36           H        SER  36  -0.601   0.123   2.168
  274    HA   SER  36           HA       SER  36  -3.205  -0.014   3.552
  275   1HB   SER  36          1HB       SER  36  -3.824  -1.698   1.721
  276   2HB   SER  36          2HB       SER  36  -3.740  -0.006   1.234
  277    HG   SER  36           HG       SER  36  -1.591  -0.455   0.494
  278    H    ASN  37           H        ASN  37  -0.182  -1.034   3.850
  279    HA   ASN  37           HA       ASN  37   0.841  -2.823   4.843
  280   1HB   ASN  37          1HB       ASN  37  -1.281  -2.446   6.371
  281   2HB   ASN  37          2HB       ASN  37  -1.809  -3.966   5.657
  282   2HD2  ASN  37          2HD2      ASN  37   0.571  -2.416   7.668
  283   1HD2  ASN  37          1HD2      ASN  37   1.201  -3.860   8.379
  284    H    PHE  38           H        PHE  38  -0.188  -2.866   2.136
  285    HA   PHE  38           HA       PHE  38  -0.140  -4.159   0.330
  286   1HB   PHE  38          1HB       PHE  38   0.723  -6.256   2.318
  287   2HB   PHE  38          2HB       PHE  38   0.575  -6.572   0.591
  288    HD1  PHE  38           HD1      PHE  38   1.616  -4.230  -0.677
  289    HD2  PHE  38           HD2      PHE  38   2.966  -6.175   2.857
  290    HE1  PHE  38           HE1      PHE  38   3.867  -3.315  -1.045
  291    HE2  PHE  38           HE2      PHE  38   5.221  -5.261   2.498
  292    HZ   PHE  38           HZ       PHE  38   5.677  -3.836   0.544
  293    H    ASN  39           H        ASN  39  -2.533  -3.838   2.131
  294    HA   ASN  39           HA       ASN  39  -4.061  -6.239   1.625
  295   1HB   ASN  39          1HB       ASN  39  -4.409  -4.827   3.668
  296   2HB   ASN  39          2HB       ASN  39  -5.041  -3.558   2.627
  297   2HD2  ASN  39          2HD2      ASN  39  -5.616  -6.908   1.924
  298   1HD2  ASN  39          1HD2      ASN  39  -7.294  -6.916   2.335
  299    H    THR  40           H        THR  40  -4.677  -6.637  -0.360
  300    HA   THR  40           HA       THR  40  -4.832  -4.708  -2.416
  301    HB   THR  40           HB       THR  40  -5.204  -6.469  -3.832
  302    HG1  THR  40           HG1      THR  40  -6.744  -7.975  -3.506
  303   1HG2  THR  40          1HG2      THR  40  -4.301  -7.849  -1.312
  304   2HG2  THR  40          2HG2      THR  40  -4.238  -8.564  -2.923
  305   3HG2  THR  40          3HG2      THR  40  -3.276  -7.133  -2.556
  306    H    GLN  41           H        GLN  41  -6.960  -5.766  -0.019
  307    HA   GLN  41           HA       GLN  41  -9.305  -4.657  -1.377
  308   1HB   GLN  41          1HB       GLN  41  -8.821  -6.763   0.639
  309   2HB   GLN  41          2HB       GLN  41 -10.282  -5.828   0.833
  310   1HG   GLN  41          1HG       GLN  41  -9.681  -6.926  -1.851
  311   2HG   GLN  41          2HG       GLN  41 -10.213  -8.042  -0.594
  312   2HE2  GLN  41          2HE2      GLN  41 -12.248  -8.505  -1.078
  313   1HE2  GLN  41          1HE2      GLN  41 -13.500  -7.350  -1.371
  314    H    ALA  42           H        ALA  42  -6.961  -3.517   0.530
  315    HA   ALA  42           HA       ALA  42  -8.299  -2.366   2.721
  316   1HB   ALA  42          1HB       ALA  42  -6.212  -1.925   3.287
  317   2HB   ALA  42          2HB       ALA  42  -5.664  -2.385   1.674
  318   3HB   ALA  42          3HB       ALA  42  -6.120  -0.714   2.008
  319    H    THR  43           H        THR  43  -9.523  -0.660   2.942
  320    HA   THR  43           HA       THR  43  -9.655   1.338   0.778
  321    HB   THR  43           HB       THR  43 -11.962   1.471   0.900
  322    HG1  THR  43           HG1      THR  43 -13.131   1.056   2.720
  323   1HG2  THR  43          1HG2      THR  43 -10.896  -1.120   0.733
  324   2HG2  THR  43          2HG2      THR  43 -12.331  -1.255   1.750
  325   3HG2  THR  43          3HG2      THR  43 -12.458  -0.563   0.133
  326    H    ASN  44           H        ASN  44  -9.437   3.462   1.446
  327    HA   ASN  44           HA       ASN  44  -9.502   3.951   4.348
  328   1HB   ASN  44          1HB       ASN  44  -7.305   4.294   2.478
  329   2HB   ASN  44          2HB       ASN  44  -7.699   5.801   3.301
  330   2HD2  ASN  44          2HD2      ASN  44  -6.300   2.699   3.567
  331   1HD2  ASN  44          1HD2      ASN  44  -5.823   2.805   5.224
  332    H    ARG  45           H        ARG  45 -11.353   5.060   4.576
  333    HA   ARG  45           HA       ARG  45 -12.161   7.054   2.642
  334   1HB   ARG  45          1HB       ARG  45 -13.699   5.453   3.960
  335   2HB   ARG  45          2HB       ARG  45 -13.485   6.572   5.299
  336   1HG   ARG  45          1HG       ARG  45 -14.756   8.182   4.342
  337   2HG   ARG  45          2HG       ARG  45 -14.286   7.735   2.702
  338   1HD   ARG  45          1HD       ARG  45 -15.738   5.575   3.862
  339   2HD   ARG  45          2HD       ARG  45 -16.655   7.062   4.099
  340    HE   ARG  45           HE       ARG  45 -15.984   5.804   1.556
  341   1HH1  ARG  45          1HH1      ARG  45 -17.384   8.501   3.261
  342   2HH1  ARG  45          2HH1      ARG  45 -18.273   9.072   1.889
  343   1HH2  ARG  45          1HH2      ARG  45 -17.151   6.549  -0.255
  344   2HH2  ARG  45          2HH2      ARG  45 -18.142   7.963  -0.109
  345    H    ASN  46           H        ASN  46 -11.879   9.190   2.790
  346    HA   ASN  46           HA       ASN  46 -10.665  10.246   5.257
  347   1HB   ASN  46          1HB       ASN  46 -10.473  11.638   2.607
  348   2HB   ASN  46          2HB       ASN  46  -9.393  11.739   3.994
  349   2HD2  ASN  46          2HD2      ASN  46  -7.810  10.208   4.274
  350   1HD2  ASN  46          1HD2      ASN  46  -7.386   9.062   3.052
  351    H    THR  47           H        THR  47 -11.010  12.746   5.354
  352    HA   THR  47           HA       THR  47 -13.856  13.139   5.572
  353    HB   THR  47           HB       THR  47 -13.247  15.364   6.505
  354    HG1  THR  47           HG1      THR  47 -11.192  16.033   6.510
  355   1HG2  THR  47          1HG2      THR  47 -13.177  13.024   7.746
  356   2HG2  THR  47          2HG2      THR  47 -11.468  13.428   7.900
  357   3HG2  THR  47          3HG2      THR  47 -12.693  14.513   8.558
  358    H    ASP  48           H        ASP  48 -11.492  13.745   3.208
  359    HA   ASP  48           HA       ASP  48 -12.632  16.087   2.045
  360   1HB   ASP  48          1HB       ASP  48 -11.202  15.415   0.058
  361   2HB   ASP  48          2HB       ASP  48 -10.345  15.692   1.570
  362    H    GLY  49           H        GLY  49 -13.562  12.841   2.084
  363   1HA   GLY  49          1HA       GLY  49 -15.445  13.354  -0.124
  364   2HA   GLY  49          2HA       GLY  49 -15.736  12.258   1.217
  365    H    SER  50           H        SER  50 -12.670  12.327  -0.439
  366    HA   SER  50           HA       SER  50 -13.341  10.143  -2.200
  367   1HB   SER  50          1HB       SER  50 -10.680  10.252  -2.438
  368   2HB   SER  50          2HB       SER  50 -11.743  11.399  -3.253
  369    HG   SER  50           HG       SER  50 -10.682  12.861  -2.192
  370    H    THR  51           H        THR  51 -11.721   8.258  -2.258
  371    HA   THR  51           HA       THR  51 -11.008   7.345   0.436
  372    HB   THR  51           HB       THR  51 -12.411   5.422  -1.380
  373    HG1  THR  51           HG1      THR  51 -14.337   6.057  -0.034
  374   1HG2  THR  51          1HG2      THR  51 -11.155   4.958   0.890
  375   2HG2  THR  51          2HG2      THR  51 -12.674   5.520   1.587
  376   3HG2  THR  51          3HG2      THR  51 -12.662   4.130   0.502
  377    H    ASP  52           H        ASP  52  -9.725   5.286   0.362
  378    HA   ASP  52           HA       ASP  52  -8.039   5.202  -2.056
  379   1HB   ASP  52          1HB       ASP  52  -7.252   4.658   0.816
  380   2HB   ASP  52          2HB       ASP  52  -6.185   4.525  -0.579
  381    H    TYR  53           H        TYR  53  -9.325   3.607  -3.008
  382    HA   TYR  53           HA       TYR  53  -9.559   1.060  -1.610
  383   1HB   TYR  53          1HB       TYR  53 -10.615   1.853  -4.330
  384   2HB   TYR  53          2HB       TYR  53 -10.990   0.374  -3.457
  385    HD1  TYR  53           HD1      TYR  53 -12.004   0.799  -1.025
  386    HD2  TYR  53           HD2      TYR  53 -12.150   3.561  -4.255
  387    HE1  TYR  53           HE1      TYR  53 -13.959   1.884  -0.001
  388    HE2  TYR  53           HE2      TYR  53 -14.103   4.657  -3.239
  389    HH   TYR  53           HH       TYR  53 -15.166   4.898  -1.085
  390    H    GLY  54           H        GLY  54  -7.163   0.646  -1.721
  391   1HA   GLY  54          1HA       GLY  54  -5.964   0.326  -4.284
  392   2HA   GLY  54          2HA       GLY  54  -6.534  -1.216  -3.666
  393    H    ILE  55           H        ILE  55  -4.253  -1.810  -3.784
  394    HA   ILE  55           HA       ILE  55  -2.987  -1.645  -1.241
  395    HB   ILE  55           HB       ILE  55  -2.650  -3.550  -2.861
  396   1HG1  ILE  55          1HG1      ILE  55  -0.127  -2.116  -1.988
  397   2HG1  ILE  55          2HG1      ILE  55  -1.109  -3.164  -0.970
  398   1HG2  ILE  55          1HG2      ILE  55  -1.825  -1.387  -4.551
  399   2HG2  ILE  55          2HG2      ILE  55  -0.510  -2.551  -4.387
  400   3HG2  ILE  55          3HG2      ILE  55  -2.092  -3.082  -4.959
  401   1HD1  ILE  55          1HD1      ILE  55  -0.563  -4.754  -3.136
  402   2HD1  ILE  55          2HD1      ILE  55   0.928  -3.834  -2.924
  403   3HD1  ILE  55          3HD1      ILE  55   0.278  -4.782  -1.586
  404    H    LEU  56           H        LEU  56  -2.969   0.198  -4.132
  405    HA   LEU  56           HA       LEU  56  -0.767   1.878  -3.149
  406   1HB   LEU  56          1HB       LEU  56  -1.291   0.821  -5.734
  407   2HB   LEU  56          2HB       LEU  56  -1.561   2.549  -5.825
  408    HG   LEU  56           HG       LEU  56   0.691   2.288  -6.442
  409   1HD1  LEU  56          1HD1      LEU  56   0.098   3.781  -4.293
  410   2HD1  LEU  56          2HD1      LEU  56   1.305   2.708  -3.585
  411   3HD1  LEU  56          3HD1      LEU  56   1.714   3.684  -4.996
  412   1HD2  LEU  56          1HD2      LEU  56   0.771   0.224  -4.267
  413   2HD2  LEU  56          2HD2      LEU  56   1.189   0.064  -5.974
  414   3HD2  LEU  56          3HD2      LEU  56   2.252   0.955  -4.885
  415    H    GLN  57           H        GLN  57  -3.917   1.642  -2.840
  416    HA   GLN  57           HA       GLN  57  -5.545   3.061  -2.198
  417   1HB   GLN  57          1HB       GLN  57  -3.489   5.231  -2.638
  418   2HB   GLN  57          2HB       GLN  57  -5.038   5.438  -1.832
  419   1HG   GLN  57          1HG       GLN  57  -4.223   3.618  -0.223
  420   2HG   GLN  57          2HG       GLN  57  -2.626   3.931  -0.901
  421   2HE2  GLN  57          2HE2      GLN  57  -4.261   4.509   1.715
  422   1HE2  GLN  57          1HE2      GLN  57  -3.774   6.122   2.098
  423    H    ILE  58           H        ILE  58  -6.499   2.305  -4.329
  424    HA   ILE  58           HA       ILE  58  -6.324   4.200  -6.496
  425    HB   ILE  58           HB       ILE  58  -8.299   1.939  -6.306
  426   1HG1  ILE  58          1HG1      ILE  58  -6.193   0.909  -5.793
  427   2HG1  ILE  58          2HG1      ILE  58  -6.555   0.553  -7.478
  428   1HG2  ILE  58          1HG2      ILE  58  -8.232   3.790  -8.144
  429   2HG2  ILE  58          2HG2      ILE  58  -6.889   2.837  -8.777
  430   3HG2  ILE  58          3HG2      ILE  58  -8.482   2.103  -8.593
  431   1HD1  ILE  58          1HD1      ILE  58  -4.670   2.688  -6.505
  432   2HD1  ILE  58          2HD1      ILE  58  -4.208   1.112  -7.147
  433   3HD1  ILE  58          3HD1      ILE  58  -5.009   2.289  -8.188
  434    H    ASN  59           H        ASN  59  -7.207   6.123  -5.873
  435    HA   ASN  59           HA       ASN  59  -9.607   6.346  -4.393
  436   1HB   ASN  59          1HB       ASN  59  -7.887   8.126  -4.508
  437   2HB   ASN  59          2HB       ASN  59  -8.276   8.377  -6.207
  438   2HD2  ASN  59          2HD2      ASN  59  -8.479  10.568  -4.951
  439   1HD2  ASN  59          1HD2      ASN  59 -10.094  10.983  -4.501
  440    H    SER  60           H        SER  60 -11.304   5.252  -5.303
  441    HA   SER  60           HA       SER  60 -11.873   5.179  -8.058
  442   1HB   SER  60          1HB       SER  60 -13.831   4.028  -7.475
  443   2HB   SER  60          2HB       SER  60 -12.727   3.652  -6.152
  444    HG   SER  60           HG       SER  60 -13.805   5.691  -5.222
  445    H    ARG  61           H        ARG  61 -12.256   7.708  -5.817
  446    HA   ARG  61           HA       ARG  61 -14.411   8.940  -7.379
  447   1HB   ARG  61          1HB       ARG  61 -14.259   8.791  -4.742
  448   2HB   ARG  61          2HB       ARG  61 -13.254  10.220  -4.940
  449   1HG   ARG  61          1HG       ARG  61 -15.179  11.174  -6.312
  450   2HG   ARG  61          2HG       ARG  61 -16.144   9.854  -5.648
  451   1HD   ARG  61          1HD       ARG  61 -15.758  10.614  -3.409
  452   2HD   ARG  61          2HD       ARG  61 -14.596  11.817  -3.967
  453    HE   ARG  61           HE       ARG  61 -17.458  11.937  -4.665
  454   1HH1  ARG  61          1HH1      ARG  61 -14.509  13.429  -3.561
  455   2HH1  ARG  61          2HH1      ARG  61 -15.190  15.020  -3.488
  456   1HH2  ARG  61          1HH2      ARG  61 -18.362  14.028  -4.571
  457   2HH2  ARG  61          2HH2      ARG  61 -17.379  15.360  -4.061
  458    H    TRP  62           H        TRP  62 -11.537   8.646  -8.168
  459    HA   TRP  62           HA       TRP  62 -11.222  11.305  -9.218
  460   1HB   TRP  62          1HB       TRP  62 -10.084  10.943  -6.770
  461   2HB   TRP  62          2HB       TRP  62  -8.745  10.528  -7.836
  462    HD1  TRP  62           HD1      TRP  62 -11.374  13.400  -7.933
  463    HE1  TRP  62           HE1      TRP  62 -10.105  15.609  -8.306
  464    HE3  TRP  62           HE3      TRP  62  -6.597  11.583  -8.060
  465    HZ2  TRP  62           HZ2      TRP  62  -7.434  16.467  -8.614
  466    HZ3  TRP  62           HZ3      TRP  62  -4.743  13.163  -8.399
  467    HH2  TRP  62           HH2      TRP  62  -5.154  15.555  -8.671
  468    H    TRP  63           H        TRP  63 -10.513   7.964  -9.297
  469    HA   TRP  63           HA       TRP  63  -8.896   8.403 -11.710
  470   1HB   TRP  63          1HB       TRP  63  -8.385   6.397  -9.508
  471   2HB   TRP  63          2HB       TRP  63  -7.613   6.323 -11.090
  472    HD1  TRP  63           HD1      TRP  63  -6.644   7.293  -7.828
  473    HE1  TRP  63           HE1      TRP  63  -4.906   9.198  -7.833
  474    HE3  TRP  63           HE3      TRP  63  -7.282   8.936 -12.598
  475    HZ2  TRP  63           HZ2      TRP  63  -3.945  11.158  -9.647
  476    HZ3  TRP  63           HZ3      TRP  63  -5.967  10.825 -13.403
  477    HH2  TRP  63           HH2      TRP  63  -4.309  11.920 -11.961
  478    H    CYS  64           H        CYS  64 -10.167   5.565 -10.031
  479    HA   CYS  64           HA       CYS  64 -11.148   4.570 -12.586
  480   1HB   CYS  64          1HB       CYS  64 -11.168   2.432 -11.657
  481   2HB   CYS  64          2HB       CYS  64  -9.826   3.195 -10.814
  482    H    ASN  65           H        ASN  65 -13.206   3.649 -12.872
  483    HA   ASN  65           HA       ASN  65 -15.289   5.198 -11.519
  484   1HB   ASN  65          1HB       ASN  65 -15.189   5.145 -14.014
  485   2HB   ASN  65          2HB       ASN  65 -15.523   3.416 -13.954
  486   2HD2  ASN  65          2HD2      ASN  65 -17.548   2.921 -14.315
  487   1HD2  ASN  65          1HD2      ASN  65 -18.925   3.889 -13.925
  488    H    ASP  66           H        ASP  66 -15.952   4.259  -9.692
  489    HA   ASP  66           HA       ASP  66 -16.276   1.352  -9.600
  490   1HB   ASP  66          1HB       ASP  66 -16.371   1.563  -7.210
  491   2HB   ASP  66          2HB       ASP  66 -15.017   2.529  -7.786
  492    H    GLY  67           H        GLY  67 -18.110   4.234  -9.881
  493   1HA   GLY  67          1HA       GLY  67 -20.542   2.748 -10.165
  494   2HA   GLY  67          2HA       GLY  67 -20.366   4.492 -10.282
  495    H    ARG  68           H        ARG  68 -19.099   3.145  -7.413
  496    HA   ARG  68           HA       ARG  68 -21.570   3.315  -5.921
  497   1HB   ARG  68          1HB       ARG  68 -18.722   2.726  -5.118
  498   2HB   ARG  68          2HB       ARG  68 -20.044   2.819  -3.961
  499   1HG   ARG  68          1HG       ARG  68 -20.973   1.089  -5.915
  500   2HG   ARG  68          2HG       ARG  68 -19.273   0.661  -5.720
  501   1HD   ARG  68          1HD       ARG  68 -19.704   0.625  -3.229
  502   2HD   ARG  68          2HD       ARG  68 -21.421   0.737  -3.613
  503    HE   ARG  68           HE       ARG  68 -19.780  -1.462  -4.675
  504   1HH1  ARG  68          1HH1      ARG  68 -22.500  -0.311  -2.826
  505   2HH1  ARG  68          2HH1      ARG  68 -23.203  -1.882  -2.640
  506   1HH2  ARG  68          1HH2      ARG  68 -20.699  -3.535  -4.435
  507   2HH2  ARG  68          2HH2      ARG  68 -22.180  -3.715  -3.555
  508    H    THR  69           H        THR  69 -19.425   5.544  -7.053
  509    HA   THR  69           HA       THR  69 -20.232   7.476  -5.000
  510    HB   THR  69           HB       THR  69 -17.481   7.737  -6.125
  511    HG1  THR  69           HG1      THR  69 -17.947   6.215  -3.780
  512   1HG2  THR  69          1HG2      THR  69 -19.078   8.825  -3.934
  513   2HG2  THR  69          2HG2      THR  69 -17.453   8.343  -3.444
  514   3HG2  THR  69          3HG2      THR  69 -17.671   9.503  -4.755
  515    HA   PRO  70           HA       PRO  70 -21.336   9.527  -8.840
  516   1HB   PRO  70          1HB       PRO  70 -22.505  11.692  -7.695
  517   2HB   PRO  70          2HB       PRO  70 -23.305  10.121  -7.815
  518   1HG   PRO  70          1HG       PRO  70 -21.874  11.344  -5.488
  519   2HG   PRO  70          2HG       PRO  70 -23.410  10.458  -5.516
  520   1HD   PRO  70          1HD       PRO  70 -21.082   9.307  -4.755
  521   2HD   PRO  70          2HD       PRO  70 -22.368   8.401  -5.577
  522    H    GLY  71           H        GLY  71 -20.309  11.010 -10.076
  523   1HA   GLY  71          1HA       GLY  71 -18.684  13.073  -8.763
  524   2HA   GLY  71          2HA       GLY  71 -19.185  13.076 -10.447
  525    H    SER  72           H        SER  72 -18.337  10.063 -10.299
  526    HA   SER  72           HA       SER  72 -15.560   9.971  -9.941
  527   1HB   SER  72          1HB       SER  72 -16.818   7.920 -10.017
  528   2HB   SER  72          2HB       SER  72 -17.391   8.273 -11.647
  529    HG   SER  72           HG       SER  72 -15.487   7.722 -12.460
  530    H    ARG  73           H        ARG  73 -13.957  10.815 -11.079
  531    HA   ARG  73           HA       ARG  73 -14.444  12.204 -13.532
  532   1HB   ARG  73          1HB       ARG  73 -12.427  12.175 -11.533
  533   2HB   ARG  73          2HB       ARG  73 -11.645  11.834 -13.071
  534   1HG   ARG  73          1HG       ARG  73 -11.823  13.948 -13.723
  535   2HG   ARG  73          2HG       ARG  73 -13.536  14.008 -13.303
  536   1HD   ARG  73          1HD       ARG  73 -12.924  15.428 -11.689
  537   2HD   ARG  73          2HD       ARG  73 -12.309  14.005 -10.848
  538    HE   ARG  73           HE       ARG  73 -10.161  14.577 -12.161
  539   1HH1  ARG  73          1HH1      ARG  73 -12.426  16.881 -10.855
  540   2HH1  ARG  73          2HH1      ARG  73 -11.236  18.120 -10.634
  541   1HH2  ARG  73          1HH2      ARG  73  -8.588  16.202 -11.873
  542   2HH2  ARG  73          2HH2      ARG  73  -9.054  17.734 -11.213
  543    H    ASN  74           H        ASN  74 -12.749   9.234 -12.630
  544    HA   ASN  74           HA       ASN  74 -12.133   7.387 -13.829
  545   1HB   ASN  74          1HB       ASN  74 -14.517   7.959 -14.872
  546   2HB   ASN  74          2HB       ASN  74 -13.547   8.351 -16.288
  547   2HD2  ASN  74          2HD2      ASN  74 -14.275   6.670 -17.521
  548   1HD2  ASN  74          1HD2      ASN  74 -13.895   5.018 -17.189
  549    H    LEU  75           H        LEU  75 -10.602   9.817 -13.796
  550    HA   LEU  75           HA       LEU  75  -9.470  10.670 -16.160
  551   1HB   LEU  75          1HB       LEU  75  -8.687  10.360 -13.335
  552   2HB   LEU  75          2HB       LEU  75  -7.369  10.576 -14.462
  553    HG   LEU  75           HG       LEU  75  -9.730  12.439 -14.060
  554   1HD1  LEU  75          1HD1      LEU  75  -8.170  12.469 -12.182
  555   2HD1  LEU  75          2HD1      LEU  75  -6.833  12.780 -13.290
  556   3HD1  LEU  75          3HD1      LEU  75  -8.109  13.981 -13.090
  557   1HD2  LEU  75          1HD2      LEU  75  -8.065  12.162 -16.298
  558   2HD2  LEU  75          2HD2      LEU  75  -9.188  13.476 -15.948
  559   3HD2  LEU  75          3HD2      LEU  75  -7.500  13.602 -15.451
  560    H    CYS  76           H        CYS  76  -8.597   8.121 -14.045
  561    HA   CYS  76           HA       CYS  76  -6.480   7.044 -15.612
  562   1HB   CYS  76          1HB       CYS  76  -7.284   6.989 -13.029
  563   2HB   CYS  76          2HB       CYS  76  -7.793   5.399 -13.577
  564    H    ASN  77           H        ASN  77  -9.882   6.505 -15.196
  565    HA   ASN  77           HA       ASN  77 -11.406   5.109 -16.175
  566   1HB   ASN  77          1HB       ASN  77 -10.293   6.436 -18.155
  567   2HB   ASN  77          2HB       ASN  77  -9.603   4.868 -18.560
  568   2HD2  ASN  77          2HD2      ASN  77 -11.888   6.807 -19.513
  569   1HD2  ASN  77          1HD2      ASN  77 -13.148   5.700 -19.925
  570    H    ILE  78           H        ILE  78 -10.069   3.746 -14.428
  571    HA   ILE  78           HA       ILE  78  -9.238   1.284 -15.782
  572    HB   ILE  78           HB       ILE  78  -7.518   0.973 -14.379
  573   1HG1  ILE  78          1HG1      ILE  78  -9.490   1.758 -12.331
  574   2HG1  ILE  78          2HG1      ILE  78  -8.281   0.481 -12.297
  575   1HG2  ILE  78          1HG2      ILE  78  -7.404   3.325 -15.265
  576   2HG2  ILE  78          2HG2      ILE  78  -7.929   3.862 -13.669
  577   3HG2  ILE  78          3HG2      ILE  78  -6.409   2.987 -13.847
  578   1HD1  ILE  78          1HD1      ILE  78  -6.582   2.325 -11.887
  579   2HD1  ILE  78          2HD1      ILE  78  -7.967   3.372 -11.576
  580   3HD1  ILE  78          3HD1      ILE  78  -7.697   1.946 -10.574
  581    HA   PRO  79           HA       PRO  79 -12.541  -0.761 -13.649
  582   1HB   PRO  79          1HB       PRO  79 -11.682  -3.314 -13.693
  583   2HB   PRO  79          2HB       PRO  79 -12.190  -2.481 -15.166
  584   1HG   PRO  79          1HG       PRO  79  -9.432  -3.016 -14.144
  585   2HG   PRO  79          2HG       PRO  79 -10.049  -3.106 -15.803
  586   1HD   PRO  79          1HD       PRO  79  -8.622  -0.983 -14.798
  587   2HD   PRO  79          2HD       PRO  79  -9.758  -0.866 -16.155
  588    H    CYS  80           H        CYS  80 -12.750  -0.334 -11.518
  589    HA   CYS  80           HA       CYS  80 -10.679  -0.523  -9.638
  590   1HB   CYS  80          1HB       CYS  80 -13.571  -0.658  -8.850
  591   2HB   CYS  80          2HB       CYS  80 -12.241   0.175  -8.051
  592    H    SER  81           H        SER  81 -13.602  -2.586  -9.861
  593    HA   SER  81           HA       SER  81 -12.834  -4.450  -7.962
  594   1HB   SER  81          1HB       SER  81 -14.370  -6.026  -9.313
  595   2HB   SER  81          2HB       SER  81 -15.073  -4.548  -8.655
  596    HG   SER  81           HG       SER  81 -15.716  -4.507 -10.715
  597    H    ALA  82           H        ALA  82 -11.733  -4.130 -11.258
  598    HA   ALA  82           HA       ALA  82 -10.719  -6.797 -11.496
  599   1HB   ALA  82          1HB       ALA  82 -11.328  -5.215 -13.394
  600   2HB   ALA  82          2HB       ALA  82  -9.837  -6.142 -13.568
  601   3HB   ALA  82          3HB       ALA  82  -9.770  -4.443 -13.098
  602    H    LEU  83           H        LEU  83  -9.703  -4.114  -9.782
  603    HA   LEU  83           HA       LEU  83  -6.883  -4.938  -9.800
  604   1HB   LEU  83          1HB       LEU  83  -6.288  -2.822  -9.165
  605   2HB   LEU  83          2HB       LEU  83  -7.748  -2.471 -10.069
  606    HG   LEU  83           HG       LEU  83  -8.766  -2.784  -7.567
  607   1HD1  LEU  83          1HD1      LEU  83  -5.925  -2.348  -7.263
  608   2HD1  LEU  83          2HD1      LEU  83  -6.867  -1.056  -6.518
  609   3HD1  LEU  83          3HD1      LEU  83  -7.144  -2.733  -6.049
  610   1HD2  LEU  83          1HD2      LEU  83  -9.072  -0.939  -9.258
  611   2HD2  LEU  83          2HD2      LEU  83  -9.064  -0.434  -7.568
  612   3HD2  LEU  83          3HD2      LEU  83  -7.635  -0.183  -8.571
  613    H    LEU  84           H        LEU  84  -9.713  -5.352  -8.090
  614    HA   LEU  84           HA       LEU  84  -8.285  -5.914  -5.583
  615   1HB   LEU  84          1HB       LEU  84 -11.257  -5.734  -5.729
  616   2HB   LEU  84          2HB       LEU  84 -10.179  -5.339  -4.402
  617    HG   LEU  84           HG       LEU  84 -10.013  -3.666  -6.850
  618   1HD1  LEU  84          1HD1      LEU  84 -12.492  -4.128  -5.659
  619   2HD1  LEU  84          2HD1      LEU  84 -11.949  -2.573  -5.029
  620   3HD1  LEU  84          3HD1      LEU  84 -12.061  -2.829  -6.771
  621   1HD2  LEU  84          1HD2      LEU  84  -9.834  -3.112  -3.892
  622   2HD2  LEU  84          2HD2      LEU  84  -8.489  -3.258  -5.024
  623   3HD2  LEU  84          3HD2      LEU  84  -9.618  -1.911  -5.166
  624    H    SER  85           H        SER  85  -8.121  -7.730  -7.666
  625    HA   SER  85           HA       SER  85  -9.654  -9.974  -6.560
  626   1HB   SER  85          1HB       SER  85  -9.867 -10.968  -8.787
  627   2HB   SER  85          2HB       SER  85 -10.577  -9.353  -8.782
  628    HG   SER  85           HG       SER  85  -8.017 -10.088  -9.760
  629    H    SER  86           H        SER  86  -7.166  -9.058  -5.847
  630    HA   SER  86           HA       SER  86  -5.172  -9.930  -5.143
  631   1HB   SER  86          1HB       SER  86  -6.392 -12.177  -5.254
  632   2HB   SER  86          2HB       SER  86  -5.696 -12.364  -6.863
  633    HG   SER  86           HG       SER  86  -3.975 -11.693  -4.773
  634    H    ASP  87           H        ASP  87  -5.930  -8.570  -7.695
  635    HA   ASP  87           HA       ASP  87  -3.457  -9.036  -9.211
  636   1HB   ASP  87          1HB       ASP  87  -5.697  -9.660 -10.233
  637   2HB   ASP  87          2HB       ASP  87  -6.061  -7.941 -10.242
  638    H    ILE  88           H        ILE  88  -2.062  -7.373  -8.965
  639    HA   ILE  88           HA       ILE  88  -3.074  -4.761  -8.182
  640    HB   ILE  88           HB       ILE  88  -0.454  -4.309  -8.348
  641   1HG1  ILE  88          1HG1      ILE  88  -0.386  -7.158  -7.442
  642   2HG1  ILE  88          2HG1      ILE  88  -0.310  -6.812  -9.168
  643   1HG2  ILE  88          1HG2      ILE  88  -2.109  -5.515  -6.186
  644   2HG2  ILE  88          2HG2      ILE  88  -0.385  -5.250  -5.919
  645   3HG2  ILE  88          3HG2      ILE  88  -1.435  -3.890  -6.318
  646   1HD1  ILE  88          1HD1      ILE  88   1.518  -5.149  -7.680
  647   2HD1  ILE  88          2HD1      ILE  88   1.802  -6.864  -7.382
  648   3HD1  ILE  88          3HD1      ILE  88   1.825  -6.240  -9.031
  649    H    THR  89           H        THR  89  -2.461  -6.352 -11.048
  650    HA   THR  89           HA       THR  89  -1.076  -4.667 -12.679
  651    HB   THR  89           HB       THR  89  -3.664  -5.866 -13.630
  652    HG1  THR  89           HG1      THR  89  -1.555  -7.153 -12.456
  653   1HG2  THR  89          1HG2      THR  89  -1.142  -4.931 -14.819
  654   2HG2  THR  89          2HG2      THR  89  -1.739  -6.467 -15.449
  655   3HG2  THR  89          3HG2      THR  89  -2.758  -5.029 -15.519
  656    H    ALA  90           H        ALA  90  -4.609  -4.470 -12.152
  657    HA   ALA  90           HA       ALA  90  -4.989  -2.158 -13.616
  658   1HB   ALA  90          1HB       ALA  90  -6.568  -3.865 -11.957
  659   2HB   ALA  90          2HB       ALA  90  -6.963  -2.176 -11.641
  660   3HB   ALA  90          3HB       ALA  90  -7.072  -2.815 -13.281
  661    H    SER  91           H        SER  91  -4.421  -2.580 -10.138
  662    HA   SER  91           HA       SER  91  -4.715   0.137  -9.427
  663   1HB   SER  91          1HB       SER  91  -2.878  -0.998  -7.634
  664   2HB   SER  91          2HB       SER  91  -4.623  -0.855  -7.420
  665    HG   SER  91           HG       SER  91  -4.785  -2.892  -8.546
  666    H    VAL  92           H        VAL  92  -1.992  -1.723 -10.562
  667    HA   VAL  92           HA       VAL  92  -0.114   0.361 -10.033
  668    HB   VAL  92           HB       VAL  92   0.168  -2.089 -11.769
  669   1HG1  VAL  92          1HG1      VAL  92   1.903   0.293 -11.439
  670   2HG1  VAL  92          2HG1      VAL  92   2.706  -1.277 -11.411
  671   3HG1  VAL  92          3HG1      VAL  92   1.739  -0.805 -12.809
  672   1HG2  VAL  92          1HG2      VAL  92   1.074  -1.343  -9.004
  673   2HG2  VAL  92          2HG2      VAL  92   0.152  -2.756  -9.520
  674   3HG2  VAL  92          3HG2      VAL  92   1.864  -2.624  -9.923
  675    H    ASN  93           H        ASN  93  -1.590  -0.868 -13.048
  676    HA   ASN  93           HA       ASN  93  -0.478   0.756 -14.849
  677   1HB   ASN  93          1HB       ASN  93  -1.968  -0.280 -16.108
  678   2HB   ASN  93          2HB       ASN  93  -2.818  -0.777 -14.668
  679   2HD2  ASN  93          2HD2      ASN  93  -4.747   0.110 -14.197
  680   1HD2  ASN  93          1HD2      ASN  93  -5.501   1.359 -15.123
  681    H    CYS  94           H        CYS  94  -3.087   1.528 -12.652
  682    HA   CYS  94           HA       CYS  94  -3.593   4.138 -13.554
  683   1HB   CYS  94          1HB       CYS  94  -4.904   2.633 -11.862
  684   2HB   CYS  94          2HB       CYS  94  -3.871   3.405 -10.661
  685    H    ALA  95           H        ALA  95  -1.484   2.944 -10.927
  686    HA   ALA  95           HA       ALA  95  -0.533   5.555 -10.294
  687   1HB   ALA  95          1HB       ALA  95  -0.297   4.150  -8.519
  688   2HB   ALA  95          2HB       ALA  95   0.302   2.819  -9.510
  689   3HB   ALA  95          3HB       ALA  95   1.346   4.197  -9.157
  690    H    LYS  96           H        LYS  96   0.657   2.987 -12.408
  691    HA   LYS  96           HA       LYS  96   3.190   3.881 -12.971
  692   1HB   LYS  96          1HB       LYS  96   1.589   1.947 -14.019
  693   2HB   LYS  96          2HB       LYS  96   1.574   3.114 -15.335
  694   1HG   LYS  96          1HG       LYS  96   3.798   2.839 -15.791
  695   2HG   LYS  96          2HG       LYS  96   4.189   2.351 -14.142
  696   1HD   LYS  96          1HD       LYS  96   4.148   0.233 -14.821
  697   2HD   LYS  96          2HD       LYS  96   2.417   0.409 -15.118
  698   1HE   LYS  96          1HE       LYS  96   4.568   1.106 -17.111
  699   2HE   LYS  96          2HE       LYS  96   3.705  -0.431 -17.077
  700   1HZ   LYS  96          1HZ       LYS  96   1.796   1.590 -17.039
  701   2HZ   LYS  96          2HZ       LYS  96   2.910   2.002 -18.243
  702   3HZ   LYS  96          3HZ       LYS  96   2.128   0.503 -18.292
  703    H    LYS  97           H        LYS  97   0.081   4.952 -13.888
  704    HA   LYS  97           HA       LYS  97   0.958   7.074 -15.664
  705   1HB   LYS  97          1HB       LYS  97  -1.557   5.791 -15.020
  706   2HB   LYS  97          2HB       LYS  97  -1.719   7.541 -14.963
  707   1HG   LYS  97          1HG       LYS  97  -2.113   7.337 -17.156
  708   2HG   LYS  97          2HG       LYS  97  -0.355   7.242 -17.278
  709   1HD   LYS  97          1HD       LYS  97  -0.381   4.908 -17.473
  710   2HD   LYS  97          2HD       LYS  97  -2.030   4.787 -16.854
  711   1HE   LYS  97          1HE       LYS  97  -2.109   4.398 -19.206
  712   2HE   LYS  97          2HE       LYS  97  -2.800   5.992 -18.903
  713   1HZ   LYS  97          1HZ       LYS  97  -0.049   6.290 -19.327
  714   2HZ   LYS  97          2HZ       LYS  97  -0.658   5.322 -20.574
  715   3HZ   LYS  97          3HZ       LYS  97  -1.323   6.852 -20.287
  716    H    ILE  98           H        ILE  98  -0.177   6.693 -12.357
  717    HA   ILE  98           HA       ILE  98  -0.506   9.383 -11.707
  718    HB   ILE  98           HB       ILE  98   0.271   7.083  -9.938
  719   1HG1  ILE  98          1HG1      ILE  98  -2.374   8.532 -10.201
  720   2HG1  ILE  98          2HG1      ILE  98  -1.986   7.063 -11.091
  721   1HG2  ILE  98          1HG2      ILE  98  -0.565   9.880  -9.178
  722   2HG2  ILE  98          2HG2      ILE  98  -0.390   8.529  -8.057
  723   3HG2  ILE  98          3HG2      ILE  98   1.020   9.150  -8.914
  724   1HD1  ILE  98          1HD1      ILE  98  -1.620   6.957  -8.168
  725   2HD1  ILE  98          2HD1      ILE  98  -3.277   7.072  -8.757
  726   3HD1  ILE  98          3HD1      ILE  98  -2.245   5.743  -9.283
  727    H    VAL  99           H        VAL  99   2.305   7.282 -11.311
  728    HA   VAL  99           HA       VAL  99   4.015   9.348 -10.365
  729    HB   VAL  99           HB       VAL  99   4.205   6.776 -10.052
  730   1HG1  VAL  99          1HG1      VAL  99   4.389   6.386 -12.537
  731   2HG1  VAL  99          2HG1      VAL  99   6.007   7.082 -12.440
  732   3HG1  VAL  99          3HG1      VAL  99   5.626   5.610 -11.546
  733   1HG2  VAL  99          1HG2      VAL  99   6.329   8.834 -10.265
  734   2HG2  VAL  99          2HG2      VAL  99   5.751   7.945  -8.857
  735   3HG2  VAL  99          3HG2      VAL  99   6.821   7.159 -10.017
  736    H    SER 100           H        SER 100   3.128   8.170 -13.518
  737    HA   SER 100           HA       SER 100   5.383   9.427 -14.838
  738   1HB   SER 100          1HB       SER 100   4.351   7.372 -15.773
  739   2HB   SER 100          2HB       SER 100   2.848   8.260 -16.023
  740    HG   SER 100           HG       SER 100   3.715   9.305 -17.671
  741    H    ASP 101           H        ASP 101   2.548  10.431 -13.467
  742    HA   ASP 101           HA       ASP 101   2.086  12.638 -15.330
  743   1HB   ASP 101          1HB       ASP 101   0.275  11.134 -14.084
  744   2HB   ASP 101          2HB       ASP 101   0.496  12.347 -12.827
  745    H    GLY 102           H        GLY 102   4.036  12.038 -12.728
  746   1HA   GLY 102          1HA       GLY 102   3.888  14.829 -11.780
  747   2HA   GLY 102          2HA       GLY 102   5.420  14.121 -12.267
  748    H    ASN 103           H        ASN 103   2.726  12.891 -10.287
  749    HA   ASN 103           HA       ASN 103   3.963  13.157  -7.799
  750   1HB   ASN 103          1HB       ASN 103   1.948  11.071  -8.656
  751   2HB   ASN 103          2HB       ASN 103   2.315  11.529  -6.996
  752   2HD2  ASN 103          2HD2      ASN 103   0.505  12.223  -9.784
  753   1HD2  ASN 103          1HD2      ASN 103  -0.288  13.644  -9.204
  754    H    GLY 104           H        GLY 104   6.083  12.473  -7.772
  755   1HA   GLY 104          1HA       GLY 104   7.856  10.964  -8.140
  756   2HA   GLY 104          2HA       GLY 104   6.684   9.717  -8.523
  757    H    MET 105           H        MET 105   5.203   9.201  -6.539
  758    HA   MET 105           HA       MET 105   5.203   7.931  -4.636
  759   1HB   MET 105          1HB       MET 105   8.022   8.845  -4.061
  760   2HB   MET 105          2HB       MET 105   7.181   7.461  -3.380
  761   1HG   MET 105          1HG       MET 105   8.402   7.794  -6.080
  762   2HG   MET 105          2HG       MET 105   8.605   6.492  -4.909
  763   1HE   MET 105          1HE       MET 105   6.779   4.896  -4.239
  764   2HE   MET 105          2HE       MET 105   5.307   5.866  -4.280
  765   3HE   MET 105          3HE       MET 105   5.425   4.400  -5.254
  766    H    ASN 106           H        ASN 106   5.285  11.072  -5.091
  767    HA   ASN 106           HA       ASN 106   5.364  11.937  -2.322
  768   1HB   ASN 106          1HB       ASN 106   5.431  13.209  -4.995
  769   2HB   ASN 106          2HB       ASN 106   4.695  14.137  -3.705
  770   2HD2  ASN 106          2HD2      ASN 106   6.002  15.311  -2.480
  771   1HD2  ASN 106          1HD2      ASN 106   7.713  15.115  -2.353
  772    H    ALA 107           H        ALA 107   3.064  11.279  -4.864
  773    HA   ALA 107           HA       ALA 107   0.848  12.686  -3.866
  774   1HB   ALA 107          1HB       ALA 107   1.313  10.581  -5.834
  775   2HB   ALA 107          2HB       ALA 107  -0.269  10.490  -5.060
  776   3HB   ALA 107          3HB       ALA 107   0.223  11.966  -5.890
  777    H    TRP 108           H        TRP 108   2.141   9.514  -3.111
  778    HA   TRP 108           HA       TRP 108  -0.065   8.861  -1.361
  779   1HB   TRP 108          1HB       TRP 108   2.546   7.403  -1.817
  780   2HB   TRP 108          2HB       TRP 108   1.126   6.763  -0.993
  781    HD1  TRP 108           HD1      TRP 108  -0.980   6.084  -2.513
  782    HE1  TRP 108           HE1      TRP 108  -1.192   5.561  -5.024
  783    HE3  TRP 108           HE3      TRP 108   3.463   8.031  -4.126
  784    HZ2  TRP 108           HZ2      TRP 108   0.321   5.928  -7.383
  785    HZ3  TRP 108           HZ3      TRP 108   4.004   7.907  -6.523
  786    HH2  TRP 108           HH2      TRP 108   2.466   6.877  -8.116
  787    H    VAL 109           H        VAL 109  -0.206   9.412   0.677
  788    HA   VAL 109           HA       VAL 109   1.822  10.903   1.994
  789    HB   VAL 109           HB       VAL 109  -0.284   9.870   3.657
  790   1HG1  VAL 109          1HG1      VAL 109   1.407  12.013   3.675
  791   2HG1  VAL 109          2HG1      VAL 109  -0.129  12.738   3.197
  792   3HG1  VAL 109          3HG1      VAL 109  -0.015  11.827   4.702
  793   1HG2  VAL 109          1HG2      VAL 109  -0.910  11.142   1.056
  794   2HG2  VAL 109          2HG2      VAL 109  -1.812   9.926   1.963
  795   3HG2  VAL 109          3HG2      VAL 109  -1.866  11.618   2.459
  796    H    ALA 110           H        ALA 110   0.989   7.537   2.033
  797    HA   ALA 110           HA       ALA 110   2.097   6.938   4.581
  798   1HB   ALA 110          1HB       ALA 110   2.235   4.760   2.656
  799   2HB   ALA 110          2HB       ALA 110   1.349   4.872   4.177
  800   3HB   ALA 110          3HB       ALA 110   0.651   5.536   2.699
  801    H    TRP 111           H        TRP 111   3.429   7.521   1.481
  802    HA   TRP 111           HA       TRP 111   5.977   6.290   2.138
  803   1HB   TRP 111          1HB       TRP 111   5.214   6.157  -0.179
  804   2HB   TRP 111          2HB       TRP 111   5.156   7.908  -0.285
  805    HD1  TRP 111           HD1      TRP 111   7.524   4.984  -0.543
  806    HE1  TRP 111           HE1      TRP 111   9.854   5.825  -1.243
  807    HE3  TRP 111           HE3      TRP 111   6.769  10.016  -0.023
  808    HZ2  TRP 111           HZ2      TRP 111  11.194   8.289  -1.538
  809    HZ3  TRP 111           HZ3      TRP 111   8.626  11.545  -0.534
  810    HH2  TRP 111           HH2      TRP 111  10.793  10.698  -1.275
  811    H    ARG 112           H        ARG 112   4.526   9.516   1.951
  812    HA   ARG 112           HA       ARG 112   7.062  10.754   2.685
  813   1HB   ARG 112          1HB       ARG 112   4.548  11.615   1.482
  814   2HB   ARG 112          2HB       ARG 112   5.139  12.715   2.718
  815   1HG   ARG 112          1HG       ARG 112   7.319  12.789   1.527
  816   2HG   ARG 112          2HG       ARG 112   6.594  11.825   0.240
  817   1HD   ARG 112          1HD       ARG 112   6.576  14.214  -0.298
  818   2HD   ARG 112          2HD       ARG 112   4.943  13.563  -0.160
  819    HE   ARG 112           HE       ARG 112   5.413  14.535   2.313
  820   1HH1  ARG 112          1HH1      ARG 112   5.732  15.905  -0.875
  821   2HH1  ARG 112          2HH1      ARG 112   5.399  17.523  -0.353
  822   1HH2  ARG 112          1HH2      ARG 112   4.973  16.661   3.009
  823   2HH2  ARG 112          2HH2      ARG 112   4.968  17.953   1.854
  824    H    ASN 113           H        ASN 113   6.174   9.048   4.611
  825    HA   ASN 113           HA       ASN 113   5.784  10.859   6.830
  826   1HB   ASN 113          1HB       ASN 113   3.483   9.932   5.812
  827   2HB   ASN 113          2HB       ASN 113   3.872   8.585   6.878
  828   2HD2  ASN 113          2HD2      ASN 113   2.648   8.782   8.608
  829   1HD2  ASN 113          1HD2      ASN 113   2.432  10.222   9.539
  830    H    ARG 114           H        ARG 114   5.459   7.382   6.167
  831    HA   ARG 114           HA       ARG 114   7.253   6.844   8.422
  832   1HB   ARG 114          1HB       ARG 114   5.057   5.363   7.087
  833   2HB   ARG 114          2HB       ARG 114   6.374   4.412   7.749
  834   1HG   ARG 114          1HG       ARG 114   5.005   4.461   9.561
  835   2HG   ARG 114          2HG       ARG 114   5.929   5.934   9.866
  836   1HD   ARG 114          1HD       ARG 114   4.133   7.202   8.669
  837   2HD   ARG 114          2HD       ARG 114   3.194   5.710   8.622
  838    HE   ARG 114           HE       ARG 114   3.782   7.334  10.973
  839   1HH1  ARG 114          1HH1      ARG 114   2.360   4.455   9.619
  840   2HH1  ARG 114          2HH1      ARG 114   1.382   4.128  11.010
  841   1HH2  ARG 114          1HH2      ARG 114   2.499   6.911  12.810
  842   2HH2  ARG 114          2HH2      ARG 114   1.461   5.524  12.824
  843    H    CYS 115           H        CYS 115   7.479   7.248   5.171
  844    HA   CYS 115           HA       CYS 115   9.601   5.224   4.918
  845   1HB   CYS 115          1HB       CYS 115   7.601   5.117   3.347
  846   2HB   CYS 115          2HB       CYS 115   8.228   6.590   2.615
  847    H    LYS 116           H        LYS 116   8.767   8.568   4.004
  848    HA   LYS 116           HA       LYS 116  11.174   9.289   2.849
  849   1HB   LYS 116          1HB       LYS 116   8.936  10.596   3.102
  850   2HB   LYS 116          2HB       LYS 116   9.659  11.214   4.581
  851   1HG   LYS 116          1HG       LYS 116  11.501  12.154   3.341
  852   2HG   LYS 116          2HG       LYS 116  10.895  11.439   1.845
  853   1HD   LYS 116          1HD       LYS 116   8.835  12.789   2.081
  854   2HD   LYS 116          2HD       LYS 116   9.531  13.553   3.511
  855   1HE   LYS 116          1HE       LYS 116  11.432  13.711   1.407
  856   2HE   LYS 116          2HE       LYS 116   9.876  14.249   0.778
  857   1HZ   LYS 116          1HZ       LYS 116  10.920  15.265   3.348
  858   2HZ   LYS 116          2HZ       LYS 116  11.377  15.969   1.879
  859   3HZ   LYS 116          3HZ       LYS 116   9.750  15.950   2.337
  860    H    GLY 117           H        GLY 117  13.000   8.556   3.869
  861   1HA   GLY 117          1HA       GLY 117  13.480   9.608   6.586
  862   2HA   GLY 117          2HA       GLY 117  14.692   9.728   5.321
  863    H    THR 118           H        THR 118  13.394   6.849   4.645
  864    HA   THR 118           HA       THR 118  15.134   5.420   6.545
  865    HB   THR 118           HB       THR 118  13.698   3.445   6.208
  866    HG1  THR 118           HG1      THR 118  12.592   3.581   4.383
  867   1HG2  THR 118          1HG2      THR 118  12.783   5.960   7.415
  868   2HG2  THR 118          2HG2      THR 118  11.501   4.792   7.098
  869   3HG2  THR 118          3HG2      THR 118  12.876   4.339   8.104
  870    H    ASP 119           H        ASP 119  14.687   2.934   4.952
  871    HA   ASP 119           HA       ASP 119  16.213   3.564   2.541
  872   1HB   ASP 119          1HB       ASP 119  17.548   2.727   4.611
  873   2HB   ASP 119          2HB       ASP 119  16.961   1.179   4.049
  874    H    VAL 120           H        VAL 120  14.822   3.005   0.989
  875    HA   VAL 120           HA       VAL 120  13.037   0.786   1.209
  876    HB   VAL 120           HB       VAL 120  12.472   1.291  -1.153
  877   1HG1  VAL 120          1HG1      VAL 120  11.915   2.775   1.109
  878   2HG1  VAL 120          2HG1      VAL 120  12.367   3.990  -0.087
  879   3HG1  VAL 120          3HG1      VAL 120  11.060   2.857  -0.431
  880   1HG2  VAL 120          1HG2      VAL 120  14.965   2.257  -1.402
  881   2HG2  VAL 120          2HG2      VAL 120  13.641   2.707  -2.476
  882   3HG2  VAL 120          3HG2      VAL 120  14.087   3.764  -1.137
  883    H    GLN 121           H        GLN 121  16.179   1.379  -0.198
  884    HA   GLN 121           HA       GLN 121  16.349  -0.829  -1.916
  885   1HB   GLN 121          1HB       GLN 121  17.982   1.117  -1.710
  886   2HB   GLN 121          2HB       GLN 121  18.648   0.290  -0.308
  887   1HG   GLN 121          1HG       GLN 121  20.035  -0.277  -2.113
  888   2HG   GLN 121          2HG       GLN 121  19.032  -1.696  -1.813
  889   2HE2  GLN 121          2HE2      GLN 121  18.807  -2.622  -3.735
  890   1HE2  GLN 121          1HE2      GLN 121  18.243  -1.837  -5.167
  891    H    ALA 122           H        ALA 122  16.408  -0.533   1.500
  892    HA   ALA 122           HA       ALA 122  17.498  -3.197   1.927
  893   1HB   ALA 122          1HB       ALA 122  17.336  -0.815   3.469
  894   2HB   ALA 122          2HB       ALA 122  16.474  -2.089   4.332
  895   3HB   ALA 122          3HB       ALA 122  18.157  -2.326   3.861
  896    H    TRP 123           H        TRP 123  14.466  -1.595   1.599
  897    HA   TRP 123           HA       TRP 123  12.830  -3.339   3.104
  898   1HB   TRP 123          1HB       TRP 123  12.385  -1.373   0.918
  899   2HB   TRP 123          2HB       TRP 123  11.114  -2.556   1.207
  900    HD1  TRP 123           HD1      TRP 123  11.454   0.788   1.937
  901    HE1  TRP 123           HE1      TRP 123  10.541   1.478   4.243
  902    HE3  TRP 123           HE3      TRP 123  11.290  -3.782   4.188
  903    HZ2  TRP 123           HZ2      TRP 123   9.856   0.216   6.663
  904    HZ3  TRP 123           HZ3      TRP 123  10.496  -3.964   6.490
  905    HH2  TRP 123           HH2      TRP 123   9.786  -1.981   7.715
  906    H    ILE 124           H        ILE 124  14.515  -3.790   0.177
  907    HA   ILE 124           HA       ILE 124  13.029  -6.288  -0.311
  908    HB   ILE 124           HB       ILE 124  13.727  -6.058  -2.715
  909   1HG1  ILE 124          1HG1      ILE 124  13.980  -3.122  -2.333
  910   2HG1  ILE 124          2HG1      ILE 124  15.372  -4.103  -1.890
  911   1HG2  ILE 124          1HG2      ILE 124  11.470  -5.378  -1.591
  912   2HG2  ILE 124          2HG2      ILE 124  11.982  -3.744  -2.013
  913   3HG2  ILE 124          3HG2      ILE 124  11.786  -4.960  -3.275
  914   1HD1  ILE 124          1HD1      ILE 124  14.433  -4.977  -4.423
  915   2HD1  ILE 124          2HD1      ILE 124  14.587  -3.219  -4.450
  916   3HD1  ILE 124          3HD1      ILE 124  15.972  -4.219  -4.010
  917    H    ARG 125           H        ARG 125  15.672  -5.315   1.062
  918    HA   ARG 125           HA       ARG 125  17.791  -6.583  -0.324
  919   1HB   ARG 125          1HB       ARG 125  17.645  -4.909   1.813
  920   2HB   ARG 125          2HB       ARG 125  17.997  -6.433   2.615
  921   1HG   ARG 125          1HG       ARG 125  19.635  -5.592   0.269
  922   2HG   ARG 125          2HG       ARG 125  19.932  -4.874   1.854
  923   1HD   ARG 125          1HD       ARG 125  19.787  -7.847   1.460
  924   2HD   ARG 125          2HD       ARG 125  21.284  -6.951   1.213
  925    HE   ARG 125           HE       ARG 125  20.160  -6.325   3.733
  926   1HH1  ARG 125          1HH1      ARG 125  21.869  -8.848   2.043
  927   2HH1  ARG 125          2HH1      ARG 125  22.601  -9.489   3.475
  928   1HH2  ARG 125          1HH2      ARG 125  21.120  -7.161   5.624
  929   2HH2  ARG 125          2HH2      ARG 125  22.175  -8.531   5.511
  930    H    GLY 126           H        GLY 126  17.522  -8.683  -0.863
  931   1HA   GLY 126          1HA       GLY 126  17.105 -10.570   1.369
  932   2HA   GLY 126          2HA       GLY 126  18.075 -10.914  -0.055
  933    H    CYS 127           H        CYS 127  15.362  -9.243  -1.004
  934    HA   CYS 127           HA       CYS 127  13.386 -11.225  -0.987
  935   1HB   CYS 127          1HB       CYS 127  13.790  -8.669  -2.317
  936   2HB   CYS 127          2HB       CYS 127  12.613  -9.736  -3.055
  937    H    ARG 128           H        ARG 128  12.417 -11.476  -3.527
  938    HA   ARG 128           HA       ARG 128  14.563 -12.893  -4.963
  939   1HB   ARG 128          1HB       ARG 128  11.781 -13.801  -4.290
  940   2HB   ARG 128          2HB       ARG 128  12.616 -14.449  -5.696
  941   1HG   ARG 128          1HG       ARG 128  14.277 -15.454  -4.387
  942   2HG   ARG 128          2HG       ARG 128  13.854 -14.498  -2.965
  943   1HD   ARG 128          1HD       ARG 128  12.718 -16.325  -2.332
  944   2HD   ARG 128          2HD       ARG 128  11.504 -15.768  -3.483
  945    HE   ARG 128           HE       ARG 128  12.163 -17.439  -4.962
  946   1HH1  ARG 128          1HH1      ARG 128  14.194 -17.394  -2.131
  947   2HH1  ARG 128          2HH1      ARG 128  14.893 -18.945  -2.450
  948   1HH2  ARG 128          1HH2      ARG 128  13.078 -19.483  -5.390
  949   2HH2  ARG 128          2HH2      ARG 128  14.259 -20.133  -4.303
  950    H    LEU 129           H        LEU 129  14.623 -10.741  -6.057
  951    HA   LEU 129           HA       LEU 129  12.487 -10.465  -8.060
  952   1HB   LEU 129          1HB       LEU 129  14.561  -8.445  -7.207
  953   2HB   LEU 129          2HB       LEU 129  13.264  -8.168  -8.353
  954    HG   LEU 129           HG       LEU 129  12.258  -9.107  -5.794
  955   1HD1  LEU 129          1HD1      LEU 129  14.415  -7.772  -5.235
  956   2HD1  LEU 129          2HD1      LEU 129  13.447  -6.369  -5.682
  957   3HD1  LEU 129          3HD1      LEU 129  12.922  -7.420  -4.367
  958   1HD2  LEU 129          1HD2      LEU 129  11.484  -7.468  -7.950
  959   2HD2  LEU 129          2HD2      LEU 129  10.528  -7.941  -6.545
  960   3HD2  LEU 129          3HD2      LEU 129  11.474  -6.453  -6.507

  No H/Q in entry =         960
  Start of MODEL    2
    1    H1   LYS   1           H1       LYS   1  -7.419  -8.798   1.533
    2    H2   LYS   1           H2       LYS   1  -7.784  -8.903  -0.115
    3    H3   LYS   1           H3       LYS   1  -8.272 -10.133   0.938
    4    HA   LYS   1           HA       LYS   1  -6.115 -10.919   1.250
    5   1HB   LYS   1          1HB       LYS   1  -6.176 -10.079  -1.647
    6   2HB   LYS   1          2HB       LYS   1  -5.488 -11.544  -0.962
    7   1HG   LYS   1          1HG       LYS   1  -7.416 -12.631  -1.134
    8   2HG   LYS   1          2HG       LYS   1  -8.308 -11.317  -0.365
    9   1HD   LYS   1          1HD       LYS   1  -8.708 -10.239  -2.392
   10   2HD   LYS   1          2HD       LYS   1  -7.400 -11.095  -3.212
   11   1HE   LYS   1          1HE       LYS   1  -9.658 -12.691  -2.121
   12   2HE   LYS   1          2HE       LYS   1  -9.941 -11.742  -3.579
   13   1HZ   LYS   1          1HZ       LYS   1  -7.527 -13.374  -3.520
   14   2HZ   LYS   1          2HZ       LYS   1  -8.998 -14.202  -3.640
   15   3HZ   LYS   1          3HZ       LYS   1  -8.581 -13.046  -4.802
   16    H    VAL   2           H        VAL   2  -4.152 -10.350   1.918
   17    HA   VAL   2           HA       VAL   2  -3.037  -7.792   0.971
   18    HB   VAL   2           HB       VAL   2  -2.595  -9.208   3.603
   19   1HG1  VAL   2          1HG1      VAL   2  -0.679  -7.797   2.350
   20   2HG1  VAL   2          2HG1      VAL   2  -1.529  -6.489   3.171
   21   3HG1  VAL   2          3HG1      VAL   2  -0.866  -7.831   4.103
   22   1HG2  VAL   2          1HG2      VAL   2  -4.453  -7.198   2.727
   23   2HG2  VAL   2          2HG2      VAL   2  -4.347  -8.024   4.283
   24   3HG2  VAL   2          3HG2      VAL   2  -3.403  -6.562   3.993
   25    H    PHE   3           H        PHE   3  -1.251  -7.911  -0.264
   26    HA   PHE   3           HA       PHE   3   0.068 -10.381  -0.765
   27   1HB   PHE   3          1HB       PHE   3   0.889  -7.537  -1.404
   28   2HB   PHE   3          2HB       PHE   3   1.712  -8.968  -2.002
   29    HD1  PHE   3           HD1      PHE   3  -1.297 -10.277  -2.211
   30    HD2  PHE   3           HD2      PHE   3   0.774  -6.919  -3.799
   31    HE1  PHE   3           HE1      PHE   3  -2.769 -10.299  -4.180
   32    HE2  PHE   3           HE2      PHE   3  -0.690  -6.935  -5.764
   33    HZ   PHE   3           HZ       PHE   3  -2.464  -8.625  -5.962
   34    H    GLY   4           H        GLY   4   2.617 -10.273  -0.670
   35   1HA   GLY   4          1HA       GLY   4   4.166 -10.851   1.035
   36   2HA   GLY   4          2HA       GLY   4   3.284  -9.810   2.147
   37    H    ARG   5           H        ARG   5   6.155  -9.841   1.541
   38    HA   ARG   5           HA       ARG   5   6.407  -7.003   0.933
   39   1HB   ARG   5          1HB       ARG   5   8.517  -8.954   1.874
   40   2HB   ARG   5          2HB       ARG   5   8.682  -7.206   1.789
   41   1HG   ARG   5          1HG       ARG   5   7.829  -6.980   3.816
   42   2HG   ARG   5          2HG       ARG   5   6.381  -7.875   3.352
   43   1HD   ARG   5          1HD       ARG   5   7.053  -9.453   4.775
   44   2HD   ARG   5          2HD       ARG   5   8.311  -9.836   3.601
   45    HE   ARG   5           HE       ARG   5   9.428  -7.847   5.034
   46   1HH1  ARG   5          1HH1      ARG   5   7.849 -10.816   5.948
   47   2HH1  ARG   5          2HH1      ARG   5   8.778 -11.015   7.396
   48   1HH2  ARG   5          1HH2      ARG   5  10.657  -8.103   6.938
   49   2HH2  ARG   5          2HH2      ARG   5  10.374  -9.472   7.959
   50    H    CYS   6           H        CYS   6   8.075 -10.000  -0.081
   51    HA   CYS   6           HA       CYS   6   9.101  -8.605  -2.393
   52   1HB   CYS   6          1HB       CYS   6   9.359 -11.558  -1.971
   53   2HB   CYS   6          2HB       CYS   6  10.434 -10.444  -2.807
   54    H    GLU   7           H        GLU   7   6.661 -11.073  -1.706
   55    HA   GLU   7           HA       GLU   7   6.089 -12.001  -4.225
   56   1HB   GLU   7          1HB       GLU   7   4.764 -11.971  -1.744
   57   2HB   GLU   7          2HB       GLU   7   3.617 -11.291  -2.890
   58   1HG   GLU   7          1HG       GLU   7   3.077 -13.451  -3.184
   59   2HG   GLU   7          2HG       GLU   7   4.438 -13.407  -4.304
   60    H    LEU   8           H        LEU   8   4.823  -9.074  -2.701
   61    HA   LEU   8           HA       LEU   8   3.489  -8.096  -4.988
   62   1HB   LEU   8          1HB       LEU   8   2.996  -7.373  -2.676
   63   2HB   LEU   8          2HB       LEU   8   4.555  -6.579  -2.604
   64    HG   LEU   8           HG       LEU   8   2.340  -5.235  -3.110
   65   1HD1  LEU   8          1HD1      LEU   8   5.049  -4.837  -4.332
   66   2HD1  LEU   8          2HD1      LEU   8   3.760  -3.644  -4.488
   67   3HD1  LEU   8          3HD1      LEU   8   4.366  -4.085  -2.891
   68   1HD2  LEU   8          1HD2      LEU   8   2.056  -6.786  -5.201
   69   2HD2  LEU   8          2HD2      LEU   8   1.661  -5.070  -5.297
   70   3HD2  LEU   8          3HD2      LEU   8   3.197  -5.659  -5.935
   71    H    ALA   9           H        ALA   9   6.764  -7.584  -3.681
   72    HA   ALA   9           HA       ALA   9   7.516  -5.517  -5.435
   73   1HB   ALA   9          1HB       ALA   9   9.080  -7.538  -3.889
   74   2HB   ALA   9          2HB       ALA   9   8.945  -5.796  -3.642
   75   3HB   ALA   9          3HB       ALA   9   9.880  -6.425  -4.999
   76    H    ALA  10           H        ALA  10   8.072  -9.036  -5.735
   77    HA   ALA  10           HA       ALA  10   9.383  -9.053  -8.159
   78   1HB   ALA  10          1HB       ALA  10   8.661 -11.334  -8.407
   79   2HB   ALA  10          2HB       ALA  10   7.326 -11.081  -7.282
   80   3HB   ALA  10          3HB       ALA  10   8.990 -11.038  -6.700
   81    H    ALA  11           H        ALA  11   5.943  -8.819  -7.430
   82    HA   ALA  11           HA       ALA  11   5.022  -8.998 -10.078
   83   1HB   ALA  11          1HB       ALA  11   3.679  -7.467  -7.876
   84   2HB   ALA  11          2HB       ALA  11   3.613  -9.224  -8.009
   85   3HB   ALA  11          3HB       ALA  11   2.923  -8.216  -9.282
   86    H    MET  12           H        MET  12   6.110  -6.411  -8.119
   87    HA   MET  12           HA       MET  12   5.415  -4.232  -9.766
   88   1HB   MET  12          1HB       MET  12   7.932  -4.298  -8.129
   89   2HB   MET  12          2HB       MET  12   6.925  -2.921  -8.500
   90   1HG   MET  12          1HG       MET  12   6.054  -5.199  -6.762
   91   2HG   MET  12          2HG       MET  12   6.764  -3.706  -6.159
   92   1HE   MET  12          1HE       MET  12   5.897  -1.742  -8.071
   93   2HE   MET  12          2HE       MET  12   4.195  -1.281  -8.051
   94   3HE   MET  12          3HE       MET  12   5.173  -1.102  -6.596
   95    H    LYS  13           H        LYS  13   8.437  -6.076  -9.527
   96    HA   LYS  13           HA       LYS  13   9.937  -4.780 -11.445
   97   1HB   LYS  13          1HB       LYS  13  10.338  -6.951  -9.879
   98   2HB   LYS  13          2HB       LYS  13  10.148  -7.732 -11.443
   99   1HG   LYS  13          1HG       LYS  13  11.908  -5.456 -11.629
  100   2HG   LYS  13          2HG       LYS  13  12.459  -6.597 -10.400
  101   1HD   LYS  13          1HD       LYS  13  13.044  -8.125 -11.931
  102   2HD   LYS  13          2HD       LYS  13  11.562  -7.889 -12.858
  103   1HE   LYS  13          1HE       LYS  13  13.199  -7.185 -14.337
  104   2HE   LYS  13          2HE       LYS  13  12.666  -5.673 -13.605
  105   1HZ   LYS  13          1HZ       LYS  13  14.560  -5.845 -12.064
  106   2HZ   LYS  13          2HZ       LYS  13  15.095  -7.223 -12.889
  107   3HZ   LYS  13          3HZ       LYS  13  15.047  -5.728 -13.680
  108    H    ARG  14           H        ARG  14   7.736  -7.531 -11.886
  109    HA   ARG  14           HA       ARG  14   8.041  -7.738 -14.671
  110   1HB   ARG  14          1HB       ARG  14   6.230  -8.802 -12.626
  111   2HB   ARG  14          2HB       ARG  14   5.461  -8.585 -14.192
  112   1HG   ARG  14          1HG       ARG  14   7.514  -9.840 -15.122
  113   2HG   ARG  14          2HG       ARG  14   7.759 -10.347 -13.449
  114   1HD   ARG  14          1HD       ARG  14   5.104 -10.838 -13.778
  115   2HD   ARG  14          2HD       ARG  14   5.721 -11.168 -15.397
  116    HE   ARG  14           HE       ARG  14   7.426 -12.508 -13.753
  117   1HH1  ARG  14          1HH1      ARG  14   3.968 -12.479 -14.176
  118   2HH1  ARG  14          2HH1      ARG  14   3.767 -14.132 -13.701
  119   1HH2  ARG  14          1HH2      ARG  14   7.172 -14.685 -13.127
  120   2HH2  ARG  14          2HH2      ARG  14   5.588 -15.386 -13.104
  121    H    HIS  15           H        HIS  15   5.878  -5.816 -12.640
  122    HA   HIS  15           HA       HIS  15   4.327  -4.838 -14.811
  123   1HB   HIS  15          1HB       HIS  15   4.536  -4.291 -11.891
  124   2HB   HIS  15          2HB       HIS  15   3.744  -3.087 -12.903
  125    HD1  HIS  15           HD1      HIS  15   2.353  -4.934 -10.705
  126    HD2  HIS  15           HD2      HIS  15   2.248  -5.482 -14.822
  127    HE1  HIS  15           HE1      HIS  15   0.284  -6.291 -11.150
  128    HE2  HIS  15           HE2      HIS  15   0.290  -6.687 -13.637
  129    H    GLY  16           H        GLY  16   7.506  -4.141 -13.995
  130   1HA   GLY  16          1HA       GLY  16   7.503  -1.904 -15.731
  131   2HA   GLY  16          2HA       GLY  16   8.883  -2.595 -14.909
  132    H    LEU  17           H        LEU  17   7.468  -2.107 -12.182
  133    HA   LEU  17           HA       LEU  17   7.511   0.800 -12.222
  134   1HB   LEU  17          1HB       LEU  17   7.127  -0.837  -9.749
  135   2HB   LEU  17          2HB       LEU  17   6.562   0.786 -10.084
  136    HG   LEU  17           HG       LEU  17   5.336  -1.817 -10.714
  137   1HD1  LEU  17          1HD1      LEU  17   4.705   0.518  -9.306
  138   2HD1  LEU  17          2HD1      LEU  17   3.609   0.484 -10.687
  139   3HD1  LEU  17          3HD1      LEU  17   3.669  -0.884  -9.576
  140   1HD2  LEU  17          1HD2      LEU  17   5.485   0.402 -12.702
  141   2HD2  LEU  17          2HD2      LEU  17   5.447  -1.342 -12.961
  142   3HD2  LEU  17          3HD2      LEU  17   3.969  -0.482 -12.528
  143    H    ASP  18           H        ASP  18   9.714  -1.558 -11.952
  144    HA   ASP  18           HA       ASP  18  11.333  -0.522  -9.839
  145   1HB   ASP  18          1HB       ASP  18  11.861  -2.723 -10.179
  146   2HB   ASP  18          2HB       ASP  18  11.661  -2.624 -11.918
  147    H    ASN  19           H        ASN  19  11.761   1.568 -10.100
  148    HA   ASN  19           HA       ASN  19  12.835   3.447 -10.754
  149   1HB   ASN  19          1HB       ASN  19  14.623   1.391 -11.303
  150   2HB   ASN  19          2HB       ASN  19  14.562   2.300 -12.810
  151   2HD2  ASN  19          2HD2      ASN  19  16.448   1.970 -10.356
  152   1HD2  ASN  19          1HD2      ASN  19  16.955   3.595 -10.055
  153    H    TYR  20           H        TYR  20  10.476   2.620 -12.064
  154    HA   TYR  20           HA       TYR  20  10.655   3.161 -14.862
  155   1HB   TYR  20          1HB       TYR  20   8.725   1.969 -13.832
  156   2HB   TYR  20          2HB       TYR  20   8.282   3.447 -12.988
  157    HD1  TYR  20           HD1      TYR  20   8.899   2.207 -16.461
  158    HD2  TYR  20           HD2      TYR  20   6.684   4.818 -13.935
  159    HE1  TYR  20           HE1      TYR  20   7.519   2.884 -18.380
  160    HE2  TYR  20           HE2      TYR  20   5.297   5.501 -15.848
  161    HH   TYR  20           HH       TYR  20   6.101   4.684 -19.086
  162    H    ARG  21           H        ARG  21   9.485   5.197 -15.763
  163    HA   ARG  21           HA       ARG  21  10.760   7.443 -15.563
  164   1HB   ARG  21          1HB       ARG  21   8.119   6.847 -16.283
  165   2HB   ARG  21          2HB       ARG  21   7.995   8.220 -15.192
  166   1HG   ARG  21          1HG       ARG  21   9.344   9.569 -16.579
  167   2HG   ARG  21          2HG       ARG  21   9.866   8.185 -17.541
  168   1HD   ARG  21          1HD       ARG  21   7.227   7.991 -17.913
  169   2HD   ARG  21          2HD       ARG  21   7.341   9.729 -17.635
  170    HE   ARG  21           HE       ARG  21   8.327   8.258 -19.919
  171   1HH1  ARG  21          1HH1      ARG  21   8.479  11.215 -18.083
  172   2HH1  ARG  21          2HH1      ARG  21   9.092  12.155 -19.404
  173   1HH2  ARG  21          1HH2      ARG  21   9.133   9.485 -21.662
  174   2HH2  ARG  21          2HH2      ARG  21   9.463  11.171 -21.438
  175    H    GLY  22           H        GLY  22   8.519   6.369 -13.093
  176   1HA   GLY  22          1HA       GLY  22   8.038   7.188 -10.987
  177   2HA   GLY  22          2HA       GLY  22   8.911   8.657 -11.397
  178    H    TYR  23           H        TYR  23   9.010   5.684  -9.730
  179    HA   TYR  23           HA       TYR  23  11.875   6.068  -9.196
  180   1HB   TYR  23          1HB       TYR  23   9.625   5.853  -7.237
  181   2HB   TYR  23          2HB       TYR  23  11.249   5.358  -6.776
  182    HD1  TYR  23           HD1      TYR  23   9.515   8.243  -8.398
  183    HD2  TYR  23           HD2      TYR  23  12.612   6.945  -5.790
  184    HE1  TYR  23           HE1      TYR  23  10.068  10.585  -7.907
  185    HE2  TYR  23           HE2      TYR  23  13.176   9.285  -5.288
  186    HH   TYR  23           HH       TYR  23  11.777  11.575  -5.367
  187    H    SER  24           H        SER  24  12.626   4.253  -7.590
  188    HA   SER  24           HA       SER  24  12.451   1.826  -9.113
  189   1HB   SER  24          1HB       SER  24  14.302   1.063  -7.790
  190   2HB   SER  24          2HB       SER  24  14.599   2.748  -8.218
  191    HG   SER  24           HG       SER  24  14.258   3.349  -6.178
  192    H    LEU  25           H        LEU  25  12.379  -0.264  -7.981
  193    HA   LEU  25           HA       LEU  25   9.967  -0.913  -6.988
  194   1HB   LEU  25          1HB       LEU  25  12.625  -2.107  -6.983
  195   2HB   LEU  25          2HB       LEU  25  11.618  -2.682  -5.668
  196    HG   LEU  25           HG       LEU  25  10.443  -2.641  -8.390
  197   1HD1  LEU  25          1HD1      LEU  25  12.748  -3.563  -8.645
  198   2HD1  LEU  25          2HD1      LEU  25  12.313  -4.822  -7.489
  199   3HD1  LEU  25          3HD1      LEU  25  11.458  -4.704  -9.027
  200   1HD2  LEU  25          1HD2      LEU  25  10.217  -4.282  -5.893
  201   2HD2  LEU  25          2HD2      LEU  25   8.966  -3.379  -6.747
  202   3HD2  LEU  25          3HD2      LEU  25   9.595  -4.877  -7.432
  203    H    GLY  26           H        GLY  26  12.819  -0.407  -4.882
  204   1HA   GLY  26          1HA       GLY  26  12.948   0.487  -2.762
  205   2HA   GLY  26          2HA       GLY  26  11.762  -0.760  -2.423
  206    H    ASN  27           H        ASN  27  11.287   2.142  -4.392
  207    HA   ASN  27           HA       ASN  27   9.982   3.621  -2.343
  208   1HB   ASN  27          1HB       ASN  27   9.773   3.993  -5.334
  209   2HB   ASN  27          2HB       ASN  27   9.366   5.182  -4.099
  210   2HD2  ASN  27          2HD2      ASN  27  11.939   3.505  -5.730
  211   1HD2  ASN  27          1HD2      ASN  27  13.215   4.548  -5.212
  212    H    TRP  28           H        TRP  28   8.875   1.429  -4.840
  213    HA   TRP  28           HA       TRP  28   6.094   1.974  -4.545
  214   1HB   TRP  28          1HB       TRP  28   7.537  -0.400  -5.717
  215   2HB   TRP  28          2HB       TRP  28   5.799  -0.118  -5.836
  216    HD1  TRP  28           HD1      TRP  28   9.071   0.870  -7.362
  217    HE1  TRP  28           HE1      TRP  28   8.676   2.549  -9.260
  218    HE3  TRP  28           HE3      TRP  28   4.120   1.800  -6.575
  219    HZ2  TRP  28           HZ2      TRP  28   6.524   4.056 -10.320
  220    HZ3  TRP  28           HZ3      TRP  28   2.946   3.358  -8.069
  221    HH2  TRP  28           HH2      TRP  28   4.129   4.468  -9.909
  222    H    VAL  29           H        VAL  29   8.259  -0.539  -3.242
  223    HA   VAL  29           HA       VAL  29   6.238  -1.963  -1.895
  224    HB   VAL  29           HB       VAL  29   9.194  -1.802  -1.294
  225   1HG1  VAL  29          1HG1      VAL  29   7.129  -3.025   0.167
  226   2HG1  VAL  29          2HG1      VAL  29   7.998  -4.320  -0.657
  227   3HG1  VAL  29          3HG1      VAL  29   8.869  -3.203   0.392
  228   1HG2  VAL  29          1HG2      VAL  29   8.126  -2.642  -3.614
  229   2HG2  VAL  29          2HG2      VAL  29   9.604  -3.311  -2.920
  230   3HG2  VAL  29          3HG2      VAL  29   8.065  -4.141  -2.687
  231    H    CYS  30           H        CYS  30   8.587   0.441  -0.789
  232    HA   CYS  30           HA       CYS  30   7.844   0.524   1.886
  233   1HB   CYS  30          1HB       CYS  30   9.834   1.615   0.680
  234   2HB   CYS  30          2HB       CYS  30   8.733   2.945   0.335
  235    H    ALA  31           H        ALA  31   6.687   2.514  -0.829
  236    HA   ALA  31           HA       ALA  31   4.885   4.074   0.669
  237   1HB   ALA  31          1HB       ALA  31   4.762   3.390  -2.264
  238   2HB   ALA  31          2HB       ALA  31   3.941   4.731  -1.466
  239   3HB   ALA  31          3HB       ALA  31   5.703   4.703  -1.556
  240    H    ALA  32           H        ALA  32   4.381   1.111  -1.231
  241    HA   ALA  32           HA       ALA  32   1.583   0.986  -0.795
  242   1HB   ALA  32          1HB       ALA  32   2.556  -0.170  -2.659
  243   2HB   ALA  32          2HB       ALA  32   1.798  -1.354  -1.593
  244   3HB   ALA  32          3HB       ALA  32   3.551  -1.154  -1.586
  245    H    LYS  33           H        LYS  33   4.278  -0.796   0.708
  246    HA   LYS  33           HA       LYS  33   2.959  -2.430   2.428
  247   1HB   LYS  33          1HB       LYS  33   5.270  -2.679   2.421
  248   2HB   LYS  33          2HB       LYS  33   5.560  -0.961   2.645
  249   1HG   LYS  33          1HG       LYS  33   6.182  -2.048   4.654
  250   2HG   LYS  33          2HG       LYS  33   4.666  -1.203   4.973
  251   1HD   LYS  33          1HD       LYS  33   3.434  -3.290   4.692
  252   2HD   LYS  33          2HD       LYS  33   4.936  -4.141   4.330
  253   1HE   LYS  33          1HE       LYS  33   5.701  -3.217   6.638
  254   2HE   LYS  33          2HE       LYS  33   3.974  -3.012   6.927
  255   1HZ   LYS  33          1HZ       LYS  33   4.685  -5.594   5.867
  256   2HZ   LYS  33          2HZ       LYS  33   5.360  -5.276   7.385
  257   3HZ   LYS  33          3HZ       LYS  33   3.684  -5.198   7.172
  258    H    PHE  34           H        PHE  34   4.026   0.878   3.232
  259    HA   PHE  34           HA       PHE  34   2.568   0.837   5.673
  260   1HB   PHE  34          1HB       PHE  34   4.286   2.733   4.298
  261   2HB   PHE  34          2HB       PHE  34   3.139   3.432   5.421
  262    HD1  PHE  34           HD1      PHE  34   3.129   2.476   7.801
  263    HD2  PHE  34           HD2      PHE  34   6.300   1.850   5.032
  264    HE1  PHE  34           HE1      PHE  34   4.640   1.922   9.662
  265    HE2  PHE  34           HE2      PHE  34   7.815   1.293   6.887
  266    HZ   PHE  34           HZ       PHE  34   6.986   1.327   9.206
  267    H    GLU  35           H        GLU  35   1.717   1.588   2.462
  268    HA   GLU  35           HA       GLU  35  -0.287   3.508   2.961
  269   1HB   GLU  35          1HB       GLU  35   0.807   2.066   0.744
  270   2HB   GLU  35          2HB       GLU  35  -0.946   1.970   0.675
  271   1HG   GLU  35          1HG       GLU  35  -1.189   4.273   0.476
  272   2HG   GLU  35          2HG       GLU  35   0.431   4.592   1.096
  273    H    SER  36           H        SER  36  -0.522   0.040   2.237
  274    HA   SER  36           HA       SER  36  -3.107  -0.020   3.661
  275   1HB   SER  36          1HB       SER  36  -3.788  -1.736   1.884
  276   2HB   SER  36          2HB       SER  36  -3.678  -0.062   1.347
  277    HG   SER  36           HG       SER  36  -1.297  -1.292   1.104
  278    H    ASN  37           H        ASN  37  -0.145  -1.000   4.092
  279    HA   ASN  37           HA       ASN  37   0.876  -2.777   5.113
  280   1HB   ASN  37          1HB       ASN  37  -1.356  -2.445   6.526
  281   2HB   ASN  37          2HB       ASN  37  -1.757  -4.009   5.822
  282   2HD2  ASN  37          2HD2      ASN  37  -1.703  -4.956   7.876
  283   1HD2  ASN  37          1HD2      ASN  37  -0.210  -5.307   8.671
  284    H    PHE  38           H        PHE  38  -0.043  -2.823   2.370
  285    HA   PHE  38           HA       PHE  38   0.150  -4.098   0.568
  286   1HB   PHE  38          1HB       PHE  38   0.924  -6.138   2.626
  287   2HB   PHE  38          2HB       PHE  38   0.711  -6.594   0.937
  288    HD1  PHE  38           HD1      PHE  38   1.767  -4.449  -0.585
  289    HD2  PHE  38           HD2      PHE  38   3.178  -6.018   3.110
  290    HE1  PHE  38           HE1      PHE  38   4.019  -3.612  -1.101
  291    HE2  PHE  38           HE2      PHE  38   5.435  -5.179   2.602
  292    HZ   PHE  38           HZ       PHE  38   5.861  -3.984   0.493
  293    H    ASN  39           H        ASN  39  -2.351  -3.692   2.109
  294    HA   ASN  39           HA       ASN  39  -3.910  -6.047   1.411
  295   1HB   ASN  39          1HB       ASN  39  -4.288  -4.733   3.546
  296   2HB   ASN  39          2HB       ASN  39  -4.919  -3.433   2.541
  297   2HD2  ASN  39          2HD2      ASN  39  -6.630  -4.229   4.293
  298   1HD2  ASN  39          1HD2      ASN  39  -7.839  -5.276   3.639
  299    H    THR  40           H        THR  40  -4.374  -6.239  -0.658
  300    HA   THR  40           HA       THR  40  -4.500  -4.034  -2.458
  301    HB   THR  40           HB       THR  40  -4.608  -5.592  -4.138
  302    HG1  THR  40           HG1      THR  40  -5.763  -7.577  -3.921
  303   1HG2  THR  40          1HG2      THR  40  -3.544  -6.987  -1.713
  304   2HG2  THR  40          2HG2      THR  40  -3.580  -7.800  -3.279
  305   3HG2  THR  40          3HG2      THR  40  -2.665  -6.306  -3.081
  306    H    GLN  41           H        GLN  41  -6.660  -5.460  -0.329
  307    HA   GLN  41           HA       GLN  41  -8.998  -4.438  -1.774
  308   1HB   GLN  41          1HB       GLN  41  -8.494  -6.726   0.029
  309   2HB   GLN  41          2HB       GLN  41 -10.045  -5.936   0.190
  310   1HG   GLN  41          1HG       GLN  41  -9.079  -6.723  -2.512
  311   2HG   GLN  41          2HG       GLN  41  -9.741  -7.949  -1.432
  312   2HE2  GLN  41          2HE2      GLN  41 -11.428  -8.256  -2.954
  313   1HE2  GLN  41          1HE2      GLN  41 -12.760  -7.159  -3.030
  314    H    ALA  42           H        ALA  42  -6.920  -3.376   0.480
  315    HA   ALA  42           HA       ALA  42  -8.627  -2.552   2.591
  316   1HB   ALA  42          1HB       ALA  42  -5.829  -2.242   1.877
  317   2HB   ALA  42          2HB       ALA  42  -6.588  -2.368   3.463
  318   3HB   ALA  42          3HB       ALA  42  -6.503  -0.806   2.648
  319    H    THR  43           H        THR  43  -9.648  -0.690   2.982
  320    HA   THR  43           HA       THR  43  -9.681   1.355   0.858
  321    HB   THR  43           HB       THR  43 -11.970   1.563   0.946
  322    HG1  THR  43           HG1      THR  43 -12.910   0.363   3.057
  323   1HG2  THR  43          1HG2      THR  43 -11.051  -1.043   0.783
  324   2HG2  THR  43          2HG2      THR  43 -12.387  -1.142   1.929
  325   3HG2  THR  43          3HG2      THR  43 -12.653  -0.473   0.319
  326    H    ASN  44           H        ASN  44  -9.375   3.457   1.538
  327    HA   ASN  44           HA       ASN  44  -9.404   3.935   4.444
  328   1HB   ASN  44          1HB       ASN  44  -7.213   4.213   2.560
  329   2HB   ASN  44          2HB       ASN  44  -7.554   5.733   3.380
  330   2HD2  ASN  44          2HD2      ASN  44  -8.165   5.171   5.845
  331   1HD2  ASN  44          1HD2      ASN  44  -6.930   4.267   6.646
  332    H    ARG  45           H        ARG  45 -11.233   5.090   4.678
  333    HA   ARG  45           HA       ARG  45 -12.068   7.053   2.752
  334   1HB   ARG  45          1HB       ARG  45 -13.143   6.460   5.515
  335   2HB   ARG  45          2HB       ARG  45 -13.926   7.467   4.305
  336   1HG   ARG  45          1HG       ARG  45 -14.544   5.676   3.011
  337   2HG   ARG  45          2HG       ARG  45 -13.239   4.653   3.616
  338   1HD   ARG  45          1HD       ARG  45 -15.329   3.851   4.494
  339   2HD   ARG  45          2HD       ARG  45 -14.390   4.560   5.808
  340    HE   ARG  45           HE       ARG  45 -16.012   6.577   4.866
  341   1HH1  ARG  45          1HH1      ARG  45 -16.455   3.409   6.248
  342   2HH1  ARG  45          2HH1      ARG  45 -17.978   3.798   6.974
  343   1HH2  ARG  45          1HH2      ARG  45 -18.017   7.098   5.819
  344   2HH2  ARG  45          2HH2      ARG  45 -18.867   5.894   6.729
  345    H    ASN  46           H        ASN  46 -11.559   9.134   2.694
  346    HA   ASN  46           HA       ASN  46 -10.202  10.315   5.022
  347   1HB   ASN  46          1HB       ASN  46 -10.128  11.484   2.256
  348   2HB   ASN  46          2HB       ASN  46  -8.972  11.680   3.571
  349   2HD2  ASN  46          2HD2      ASN  46  -9.044  10.569   0.661
  350   1HD2  ASN  46          1HD2      ASN  46  -8.082   9.139   0.785
  351    H    THR  47           H        THR  47 -10.440  12.848   4.912
  352    HA   THR  47           HA       THR  47 -13.305  13.354   5.109
  353    HB   THR  47           HB       THR  47 -12.609  15.487   6.209
  354    HG1  THR  47           HG1      THR  47 -10.021  14.356   5.835
  355   1HG2  THR  47          1HG2      THR  47 -11.673  12.839   7.281
  356   2HG2  THR  47          2HG2      THR  47 -11.561  14.320   8.233
  357   3HG2  THR  47          3HG2      THR  47 -13.134  13.737   7.689
  358    H    ASP  48           H        ASP  48 -10.666  14.064   3.026
  359    HA   ASP  48           HA       ASP  48 -11.530  16.524   1.958
  360   1HB   ASP  48          1HB       ASP  48 -10.024  16.052   0.099
  361   2HB   ASP  48          2HB       ASP  48  -9.257  15.623   1.624
  362    H    GLY  49           H        GLY  49 -12.791  13.388   1.655
  363   1HA   GLY  49          1HA       GLY  49 -14.583  14.328  -0.489
  364   2HA   GLY  49          2HA       GLY  49 -14.990  13.105   0.705
  365    H    SER  50           H        SER  50 -12.642  11.553   0.508
  366    HA   SER  50           HA       SER  50 -13.284  10.074  -1.884
  367   1HB   SER  50          1HB       SER  50 -10.644  10.007  -2.320
  368   2HB   SER  50          2HB       SER  50 -11.695  11.201  -3.082
  369    HG   SER  50           HG       SER  50  -9.797  12.089  -2.058
  370    H    THR  51           H        THR  51 -11.583   8.164  -2.039
  371    HA   THR  51           HA       THR  51 -10.859   7.210   0.630
  372    HB   THR  51           HB       THR  51 -12.376   5.361  -1.182
  373    HG1  THR  51           HG1      THR  51 -14.249   6.172  -0.542
  374   1HG2  THR  51          1HG2      THR  51 -11.006   4.837   1.050
  375   2HG2  THR  51          2HG2      THR  51 -12.545   5.295   1.779
  376   3HG2  THR  51          3HG2      THR  51 -12.479   3.969   0.618
  377    H    ASP  52           H        ASP  52  -9.590   5.166   0.532
  378    HA   ASP  52           HA       ASP  52  -7.968   5.057  -1.928
  379   1HB   ASP  52          1HB       ASP  52  -7.172   4.562   0.948
  380   2HB   ASP  52          2HB       ASP  52  -6.129   4.242  -0.434
  381    H    TYR  53           H        TYR  53  -9.219   3.481  -2.914
  382    HA   TYR  53           HA       TYR  53  -9.535   0.936  -1.524
  383   1HB   TYR  53          1HB       TYR  53 -10.539   1.743  -4.259
  384   2HB   TYR  53          2HB       TYR  53 -10.973   0.289  -3.369
  385    HD1  TYR  53           HD1      TYR  53 -12.075   0.712  -1.019
  386    HD2  TYR  53           HD2      TYR  53 -11.944   3.571  -4.165
  387    HE1  TYR  53           HE1      TYR  53 -14.004   1.875  -0.033
  388    HE2  TYR  53           HE2      TYR  53 -13.875   4.740  -3.191
  389    HH   TYR  53           HH       TYR  53 -15.708   3.394  -0.568
  390    H    GLY  54           H        GLY  54  -7.130   0.505  -1.621
  391   1HA   GLY  54          1HA       GLY  54  -5.937   0.132  -4.180
  392   2HA   GLY  54          2HA       GLY  54  -6.518  -1.392  -3.529
  393    H    ILE  55           H        ILE  55  -4.232  -1.996  -3.641
  394    HA   ILE  55           HA       ILE  55  -2.973  -1.783  -1.097
  395    HB   ILE  55           HB       ILE  55  -2.655  -3.720  -2.698
  396   1HG1  ILE  55          1HG1      ILE  55  -0.025  -2.442  -1.951
  397   2HG1  ILE  55          2HG1      ILE  55  -1.115  -3.129  -0.751
  398   1HG2  ILE  55          1HG2      ILE  55  -2.380  -2.414  -4.743
  399   2HG2  ILE  55          2HG2      ILE  55  -0.857  -1.767  -4.132
  400   3HG2  ILE  55          3HG2      ILE  55  -1.007  -3.489  -4.484
  401   1HD1  ILE  55          1HD1      ILE  55  -0.386  -4.846  -3.043
  402   2HD1  ILE  55          2HD1      ILE  55   0.869  -4.505  -1.851
  403   3HD1  ILE  55          3HD1      ILE  55  -0.644  -5.258  -1.347
  404    H    LEU  56           H        LEU  56  -2.946  -0.007  -4.028
  405    HA   LEU  56           HA       LEU  56  -0.733   1.689  -3.095
  406   1HB   LEU  56          1HB       LEU  56  -1.335   0.610  -5.664
  407   2HB   LEU  56          2HB       LEU  56  -1.557   2.346  -5.757
  408    HG   LEU  56           HG       LEU  56   0.671   2.028  -6.412
  409   1HD1  LEU  56          1HD1      LEU  56   0.153   3.484  -4.187
  410   2HD1  LEU  56          2HD1      LEU  56   1.423   2.409  -3.600
  411   3HD1  LEU  56          3HD1      LEU  56   1.712   3.431  -5.008
  412   1HD2  LEU  56          1HD2      LEU  56   0.493  -0.281  -4.689
  413   2HD2  LEU  56          2HD2      LEU  56   1.594   0.044  -6.027
  414   3HD2  LEU  56          3HD2      LEU  56   1.987   0.613  -4.404
  415    H    GLN  57           H        GLN  57  -3.886   1.459  -2.753
  416    HA   GLN  57           HA       GLN  57  -5.506   2.888  -2.104
  417   1HB   GLN  57          1HB       GLN  57  -3.451   5.055  -2.559
  418   2HB   GLN  57          2HB       GLN  57  -4.986   5.253  -1.723
  419   1HG   GLN  57          1HG       GLN  57  -4.139   3.426  -0.142
  420   2HG   GLN  57          2HG       GLN  57  -2.555   3.741  -0.848
  421   2HE2  GLN  57          2HE2      GLN  57  -4.158   4.314   1.796
  422   1HE2  GLN  57          1HE2      GLN  57  -3.653   5.920   2.181
  423    H    ILE  58           H        ILE  58  -6.466   2.136  -4.236
  424    HA   ILE  58           HA       ILE  58  -6.304   4.045  -6.393
  425    HB   ILE  58           HB       ILE  58  -8.260   1.767  -6.214
  426   1HG1  ILE  58          1HG1      ILE  58  -6.150   0.742  -5.724
  427   2HG1  ILE  58          2HG1      ILE  58  -6.507   0.413  -7.416
  428   1HG2  ILE  58          1HG2      ILE  58  -7.016   3.344  -8.444
  429   2HG2  ILE  58          2HG2      ILE  58  -7.807   1.792  -8.720
  430   3HG2  ILE  58          3HG2      ILE  58  -8.724   3.144  -8.055
  431   1HD1  ILE  58          1HD1      ILE  58  -4.635   2.537  -6.397
  432   2HD1  ILE  58          2HD1      ILE  58  -4.166   0.982  -7.083
  433   3HD1  ILE  58          3HD1      ILE  58  -4.978   2.181  -8.090
  434    H    ASN  59           H        ASN  59  -7.188   5.956  -5.711
  435    HA   ASN  59           HA       ASN  59  -9.605   6.132  -4.250
  436   1HB   ASN  59          1HB       ASN  59  -7.891   7.924  -4.304
  437   2HB   ASN  59          2HB       ASN  59  -8.271   8.217  -5.999
  438   2HD2  ASN  59          2HD2      ASN  59 -10.923   7.339  -4.042
  439   1HD2  ASN  59          1HD2      ASN  59 -11.597   8.916  -3.846
  440    H    SER  60           H        SER  60 -11.295   5.070  -5.192
  441    HA   SER  60           HA       SER  60 -11.831   5.073  -7.963
  442   1HB   SER  60          1HB       SER  60 -13.762   3.857  -7.441
  443   2HB   SER  60          2HB       SER  60 -12.669   3.464  -6.113
  444    HG   SER  60           HG       SER  60 -14.887   5.209  -6.124
  445    H    ARG  61           H        ARG  61 -12.318   7.488  -5.599
  446    HA   ARG  61           HA       ARG  61 -14.501   8.733  -7.092
  447   1HB   ARG  61          1HB       ARG  61 -14.322   8.546  -4.492
  448   2HB   ARG  61          2HB       ARG  61 -13.235   9.919  -4.647
  449   1HG   ARG  61          1HG       ARG  61 -14.911  11.347  -4.987
  450   2HG   ARG  61          2HG       ARG  61 -15.724  10.263  -6.117
  451   1HD   ARG  61          1HD       ARG  61 -17.047  10.745  -4.072
  452   2HD   ARG  61          2HD       ARG  61 -16.715   9.031  -4.313
  453    HE   ARG  61           HE       ARG  61 -14.733  10.174  -2.661
  454   1HH1  ARG  61          1HH1      ARG  61 -18.080   9.206  -2.624
  455   2HH1  ARG  61          2HH1      ARG  61 -18.103   8.888  -0.922
  456   1HH2  ARG  61          1HH2      ARG  61 -14.755   9.758  -0.419
  457   2HH2  ARG  61          2HH2      ARG  61 -16.214   9.204   0.331
  458    H    TRP  62           H        TRP  62 -11.646   8.494  -7.973
  459    HA   TRP  62           HA       TRP  62 -11.417  11.155  -9.030
  460   1HB   TRP  62          1HB       TRP  62 -10.267  10.945  -6.620
  461   2HB   TRP  62          2HB       TRP  62  -8.926  10.393  -7.618
  462    HD1  TRP  62           HD1      TRP  62 -11.426  13.298  -8.264
  463    HE1  TRP  62           HE1      TRP  62 -10.055  15.437  -8.675
  464    HE3  TRP  62           HE3      TRP  62  -6.732  11.416  -7.505
  465    HZ2  TRP  62           HZ2      TRP  62  -7.344  16.224  -8.678
  466    HZ3  TRP  62           HZ3      TRP  62  -4.804  12.929  -7.733
  467    HH2  TRP  62           HH2      TRP  62  -5.105  15.282  -8.306
  468    H    TRP  63           H        TRP  63 -10.696   7.845  -9.183
  469    HA   TRP  63           HA       TRP  63  -9.043   8.339 -11.562
  470   1HB   TRP  63          1HB       TRP  63  -8.603   6.247  -9.427
  471   2HB   TRP  63          2HB       TRP  63  -7.804   6.221 -10.996
  472    HD1  TRP  63           HD1      TRP  63  -6.828   7.009  -7.711
  473    HE1  TRP  63           HE1      TRP  63  -5.085   8.906  -7.602
  474    HE3  TRP  63           HE3      TRP  63  -7.478   8.949 -12.366
  475    HZ2  TRP  63           HZ2      TRP  63  -4.125  10.974  -9.293
  476    HZ3  TRP  63           HZ3      TRP  63  -6.161  10.881 -13.055
  477    HH2  TRP  63           HH2      TRP  63  -4.495  11.881 -11.553
  478    H    CYS  64           H        CYS  64 -10.394   5.473 -10.009
  479    HA   CYS  64           HA       CYS  64 -11.323   4.563 -12.615
  480   1HB   CYS  64          1HB       CYS  64 -11.420   2.403 -11.734
  481   2HB   CYS  64          2HB       CYS  64 -10.073   3.120 -10.859
  482    H    ASN  65           H        ASN  65 -13.370   3.683 -12.991
  483    HA   ASN  65           HA       ASN  65 -15.494   5.154 -11.598
  484   1HB   ASN  65          1HB       ASN  65 -15.190   5.264 -14.140
  485   2HB   ASN  65          2HB       ASN  65 -15.785   3.608 -14.172
  486   2HD2  ASN  65          2HD2      ASN  65 -17.900   3.298 -14.258
  487   1HD2  ASN  65          1HD2      ASN  65 -19.105   4.504 -13.978
  488    H    ASP  66           H        ASP  66 -16.301   4.046  -9.949
  489    HA   ASP  66           HA       ASP  66 -16.506   1.140 -10.090
  490   1HB   ASP  66          1HB       ASP  66 -17.207   1.355  -7.685
  491   2HB   ASP  66          2HB       ASP  66 -15.590   1.950  -8.044
  492    H    GLY  67           H        GLY  67 -18.443   3.825 -10.715
  493   1HA   GLY  67          1HA       GLY  67 -20.718   2.198 -11.270
  494   2HA   GLY  67          2HA       GLY  67 -20.637   3.947 -11.401
  495    H    ARG  68           H        ARG  68 -19.693   2.882  -8.336
  496    HA   ARG  68           HA       ARG  68 -22.415   3.034  -7.270
  497   1HB   ARG  68          1HB       ARG  68 -21.478   2.159  -5.196
  498   2HB   ARG  68          2HB       ARG  68 -21.031   1.135  -6.552
  499   1HG   ARG  68          1HG       ARG  68 -18.899   2.762  -6.496
  500   2HG   ARG  68          2HG       ARG  68 -19.351   2.792  -4.790
  501   1HD   ARG  68          1HD       ARG  68 -19.541   0.114  -5.556
  502   2HD   ARG  68          2HD       ARG  68 -18.066   0.708  -6.318
  503    HE   ARG  68           HE       ARG  68 -18.401   1.333  -3.502
  504   1HH1  ARG  68          1HH1      ARG  68 -16.999  -0.765  -5.905
  505   2HH1  ARG  68          2HH1      ARG  68 -15.779  -1.381  -4.841
  506   1HH2  ARG  68          1HH2      ARG  68 -16.799   0.527  -2.094
  507   2HH2  ARG  68          2HH2      ARG  68 -15.666  -0.648  -2.675
  508    H    THR  69           H        THR  69 -20.096   5.150  -8.034
  509    HA   THR  69           HA       THR  69 -21.034   7.082  -6.071
  510    HB   THR  69           HB       THR  69 -18.083   7.051  -6.509
  511    HG1  THR  69           HG1      THR  69 -19.500   5.343  -4.723
  512   1HG2  THR  69          1HG2      THR  69 -19.975   7.953  -4.354
  513   2HG2  THR  69          2HG2      THR  69 -18.238   7.830  -4.074
  514   3HG2  THR  69          3HG2      THR  69 -18.857   8.922  -5.313
  515    HA   PRO  70           HA       PRO  70 -20.880   9.155 -10.088
  516   1HB   PRO  70          1HB       PRO  70 -22.528  11.190  -9.421
  517   2HB   PRO  70          2HB       PRO  70 -23.129   9.575  -9.815
  518   1HG   PRO  70          1HG       PRO  70 -22.689  10.830  -7.132
  519   2HG   PRO  70          2HG       PRO  70 -24.056   9.853  -7.699
  520   1HD   PRO  70          1HD       PRO  70 -22.050   8.840  -6.172
  521   2HD   PRO  70          2HD       PRO  70 -22.941   7.870  -7.361
  522    H    GLY  71           H        GLY  71 -19.447   9.875  -7.219
  523   1HA   GLY  71          1HA       GLY  71 -18.323  11.786  -6.408
  524   2HA   GLY  71          2HA       GLY  71 -18.693  12.614  -7.913
  525    H    SER  72           H        SER  72 -17.678   9.730  -8.947
  526    HA   SER  72           HA       SER  72 -14.893   9.760  -8.506
  527   1HB   SER  72          1HB       SER  72 -16.339   8.556 -10.875
  528   2HB   SER  72          2HB       SER  72 -14.770   8.078 -10.229
  529    HG   SER  72           HG       SER  72 -16.946   8.026  -8.490
  530    H    ARG  73           H        ARG  73 -14.478   9.389 -11.574
  531    HA   ARG  73           HA       ARG  73 -14.751  11.911 -12.786
  532   1HB   ARG  73          1HB       ARG  73 -12.635  11.777 -10.921
  533   2HB   ARG  73          2HB       ARG  73 -11.891  11.686 -12.511
  534   1HG   ARG  73          1HG       ARG  73 -13.954  13.770 -12.047
  535   2HG   ARG  73          2HG       ARG  73 -12.359  13.991 -11.327
  536   1HD   ARG  73          1HD       ARG  73 -11.323  13.741 -13.519
  537   2HD   ARG  73          2HD       ARG  73 -12.905  13.474 -14.248
  538    HE   ARG  73           HE       ARG  73 -13.118  15.895 -13.000
  539   1HH1  ARG  73          1HH1      ARG  73 -10.989  14.532 -15.397
  540   2HH1  ARG  73          2HH1      ARG  73 -10.693  16.048 -16.182
  541   1HH2  ARG  73          1HH2      ARG  73 -12.734  17.894 -14.026
  542   2HH2  ARG  73          2HH2      ARG  73 -11.684  17.959 -15.402
  543    H    ASN  74           H        ASN  74 -12.899   8.952 -12.469
  544    HA   ASN  74           HA       ASN  74 -12.287   7.335 -13.956
  545   1HB   ASN  74          1HB       ASN  74 -14.663   8.060 -14.910
  546   2HB   ASN  74          2HB       ASN  74 -13.687   8.694 -16.230
  547   2HD2  ASN  74          2HD2      ASN  74 -13.099   5.832 -14.261
  548   1HD2  ASN  74          1HD2      ASN  74 -13.210   4.696 -15.558
  549    H    LEU  75           H        LEU  75 -10.800   9.793 -13.537
  550    HA   LEU  75           HA       LEU  75  -9.632  10.919 -15.786
  551   1HB   LEU  75          1HB       LEU  75  -8.954  10.395 -12.963
  552   2HB   LEU  75          2HB       LEU  75  -7.610  10.771 -14.010
  553    HG   LEU  75           HG       LEU  75 -10.061  12.479 -13.501
  554   1HD1  LEU  75          1HD1      LEU  75  -8.170  12.220 -11.735
  555   2HD1  LEU  75          2HD1      LEU  75  -7.255  13.261 -12.825
  556   3HD1  LEU  75          3HD1      LEU  75  -8.776  13.826 -12.136
  557   1HD2  LEU  75          1HD2      LEU  75  -8.084  12.549 -15.628
  558   2HD2  LEU  75          2HD2      LEU  75  -9.602  13.431 -15.465
  559   3HD2  LEU  75          3HD2      LEU  75  -8.134  14.058 -14.716
  560    H    CYS  76           H        CYS  76  -8.859   8.186 -13.885
  561    HA   CYS  76           HA       CYS  76  -6.616   7.311 -15.438
  562   1HB   CYS  76          1HB       CYS  76  -7.425   7.108 -12.875
  563   2HB   CYS  76          2HB       CYS  76  -7.910   5.537 -13.492
  564    H    ASN  77           H        ASN  77 -10.005   6.630 -15.125
  565    HA   ASN  77           HA       ASN  77 -11.460   5.258 -16.229
  566   1HB   ASN  77          1HB       ASN  77 -10.202   6.630 -18.124
  567   2HB   ASN  77          2HB       ASN  77  -9.579   5.038 -18.542
  568   2HD2  ASN  77          2HD2      ASN  77 -11.671   3.405 -18.082
  569   1HD2  ASN  77          1HD2      ASN  77 -12.993   3.807 -19.118
  570    H    ILE  78           H        ILE  78 -10.156   3.881 -14.441
  571    HA   ILE  78           HA       ILE  78  -9.249   1.453 -15.810
  572    HB   ILE  78           HB       ILE  78  -7.578   1.143 -14.353
  573   1HG1  ILE  78          1HG1      ILE  78  -9.643   1.833 -12.365
  574   2HG1  ILE  78          2HG1      ILE  78  -8.416   0.575 -12.321
  575   1HG2  ILE  78          1HG2      ILE  78  -7.503   3.537 -15.162
  576   2HG2  ILE  78          2HG2      ILE  78  -8.055   3.993 -13.550
  577   3HG2  ILE  78          3HG2      ILE  78  -6.519   3.152 -13.750
  578   1HD1  ILE  78          1HD1      ILE  78  -6.751   2.302 -11.696
  579   2HD1  ILE  78          2HD1      ILE  78  -8.065   3.476 -11.613
  580   3HD1  ILE  78          3HD1      ILE  78  -8.045   2.095 -10.515
  581    HA   PRO  79           HA       PRO  79 -12.574  -0.686 -13.800
  582   1HB   PRO  79          1HB       PRO  79 -11.696  -3.222 -13.877
  583   2HB   PRO  79          2HB       PRO  79 -12.121  -2.351 -15.355
  584   1HG   PRO  79          1HG       PRO  79  -9.427  -2.916 -14.196
  585   2HG   PRO  79          2HG       PRO  79  -9.947  -2.940 -15.889
  586   1HD   PRO  79          1HD       PRO  79  -8.596  -0.852 -14.685
  587   2HD   PRO  79          2HD       PRO  79  -9.591  -0.702 -16.145
  588    H    CYS  80           H        CYS  80 -12.892  -0.350 -11.661
  589    HA   CYS  80           HA       CYS  80 -10.884  -0.550  -9.708
  590   1HB   CYS  80          1HB       CYS  80 -13.796  -0.763  -9.026
  591   2HB   CYS  80          2HB       CYS  80 -12.512   0.084  -8.169
  592    H    SER  81           H        SER  81 -13.773  -2.638 -10.077
  593    HA   SER  81           HA       SER  81 -13.033  -4.551  -8.216
  594   1HB   SER  81          1HB       SER  81 -14.701  -5.970  -9.190
  595   2HB   SER  81          2HB       SER  81 -15.278  -4.309  -9.328
  596    HG   SER  81           HG       SER  81 -15.260  -5.898 -11.255
  597    H    ALA  82           H        ALA  82 -11.865  -4.135 -11.480
  598    HA   ALA  82           HA       ALA  82 -10.834  -6.793 -11.756
  599   1HB   ALA  82          1HB       ALA  82 -11.425  -5.244 -13.652
  600   2HB   ALA  82          2HB       ALA  82  -9.867  -6.060 -13.788
  601   3HB   ALA  82          3HB       ALA  82  -9.936  -4.369 -13.293
  602    H    LEU  83           H        LEU  83  -9.859  -4.118  -9.994
  603    HA   LEU  83           HA       LEU  83  -7.037  -4.932  -9.974
  604   1HB   LEU  83          1HB       LEU  83  -6.462  -2.819  -9.322
  605   2HB   LEU  83          2HB       LEU  83  -7.922  -2.464 -10.225
  606    HG   LEU  83           HG       LEU  83  -8.940  -2.814  -7.726
  607   1HD1  LEU  83          1HD1      LEU  83  -6.526  -3.033  -6.934
  608   2HD1  LEU  83          2HD1      LEU  83  -6.386  -1.307  -7.266
  609   3HD1  LEU  83          3HD1      LEU  83  -7.558  -1.885  -6.081
  610   1HD2  LEU  83          1HD2      LEU  83  -8.986  -0.883  -9.532
  611   2HD2  LEU  83          2HD2      LEU  83  -9.479  -0.601  -7.861
  612   3HD2  LEU  83          3HD2      LEU  83  -7.866  -0.127  -8.397
  613    H    LEU  84           H        LEU  84  -9.888  -5.386  -8.313
  614    HA   LEU  84           HA       LEU  84  -8.491  -5.964  -5.791
  615   1HB   LEU  84          1HB       LEU  84 -11.460  -5.793  -5.972
  616   2HB   LEU  84          2HB       LEU  84 -10.401  -5.407  -4.628
  617    HG   LEU  84           HG       LEU  84 -10.218  -3.712  -7.060
  618   1HD1  LEU  84          1HD1      LEU  84 -12.629  -3.996  -5.405
  619   2HD1  LEU  84          2HD1      LEU  84 -12.065  -2.343  -5.647
  620   3HD1  LEU  84          3HD1      LEU  84 -12.435  -3.360  -7.039
  621   1HD2  LEU  84          1HD2      LEU  84  -9.998  -3.241  -4.093
  622   2HD2  LEU  84          2HD2      LEU  84  -8.691  -3.267  -5.278
  623   3HD2  LEU  84          3HD2      LEU  84  -9.886  -1.969  -5.310
  624    H    SER  85           H        SER  85  -8.294  -7.765  -7.884
  625    HA   SER  85           HA       SER  85  -9.847 -10.018  -6.823
  626   1HB   SER  85          1HB       SER  85 -10.189  -9.028  -9.370
  627   2HB   SER  85          2HB       SER  85  -9.023 -10.327  -9.625
  628    HG   SER  85           HG       SER  85 -11.048 -11.219  -9.758
  629    H    SER  86           H        SER  86  -7.384  -9.108  -6.027
  630    HA   SER  86           HA       SER  86  -5.403  -9.972  -5.282
  631   1HB   SER  86          1HB       SER  86  -6.576 -12.214  -5.351
  632   2HB   SER  86          2HB       SER  86  -5.967 -12.409  -6.994
  633    HG   SER  86           HG       SER  86  -4.315 -11.938  -4.737
  634    H    ASP  87           H        ASP  87  -6.090  -8.602  -7.829
  635    HA   ASP  87           HA       ASP  87  -3.586  -9.069  -9.295
  636   1HB   ASP  87          1HB       ASP  87  -5.791  -9.726 -10.368
  637   2HB   ASP  87          2HB       ASP  87  -6.176  -8.012 -10.399
  638    H    ILE  88           H        ILE  88  -2.216  -7.390  -9.028
  639    HA   ILE  88           HA       ILE  88  -3.280  -4.783  -8.297
  640    HB   ILE  88           HB       ILE  88  -0.668  -4.282  -8.408
  641   1HG1  ILE  88          1HG1      ILE  88  -0.473  -7.067  -7.397
  642   2HG1  ILE  88          2HG1      ILE  88  -0.542  -6.864  -9.145
  643   1HG2  ILE  88          1HG2      ILE  88  -2.095  -5.722  -6.183
  644   2HG2  ILE  88          2HG2      ILE  88  -0.569  -4.854  -6.008
  645   3HG2  ILE  88          3HG2      ILE  88  -2.035  -3.981  -6.456
  646   1HD1  ILE  88          1HD1      ILE  88   1.349  -5.106  -7.742
  647   2HD1  ILE  88          2HD1      ILE  88   1.728  -6.828  -7.707
  648   3HD1  ILE  88          3HD1      ILE  88   1.528  -6.000  -9.251
  649    H    THR  89           H        THR  89  -2.600  -6.394 -11.128
  650    HA   THR  89           HA       THR  89  -1.211  -4.728 -12.766
  651    HB   THR  89           HB       THR  89  -3.805  -5.983 -13.654
  652    HG1  THR  89           HG1      THR  89  -2.341  -7.413 -12.387
  653   1HG2  THR  89          1HG2      THR  89  -2.510  -4.526 -15.236
  654   2HG2  THR  89          2HG2      THR  89  -1.180  -5.678 -15.110
  655   3HG2  THR  89          3HG2      THR  89  -2.729  -6.189 -15.782
  656    H    ALA  90           H        ALA  90  -4.745  -4.519 -12.269
  657    HA   ALA  90           HA       ALA  90  -5.098  -2.196 -13.729
  658   1HB   ALA  90          1HB       ALA  90  -6.709  -3.708 -11.772
  659   2HB   ALA  90          2HB       ALA  90  -7.198  -2.049 -12.115
  660   3HB   ALA  90          3HB       ALA  90  -7.090  -3.226 -13.425
  661    H    SER  91           H        SER  91  -4.561  -2.661 -10.252
  662    HA   SER  91           HA       SER  91  -4.862   0.037  -9.490
  663   1HB   SER  91          1HB       SER  91  -2.934  -1.254  -7.815
  664   2HB   SER  91          2HB       SER  91  -4.619  -0.877  -7.459
  665    HG   SER  91           HG       SER  91  -3.694  -3.226  -7.601
  666    H    VAL  92           H        VAL  92  -2.152  -1.767 -10.726
  667    HA   VAL  92           HA       VAL  92  -0.272   0.310 -10.174
  668    HB   VAL  92           HB       VAL  92  -0.016  -2.086 -11.986
  669   1HG1  VAL  92          1HG1      VAL  92   1.719   0.286 -11.607
  670   2HG1  VAL  92          2HG1      VAL  92   2.526  -1.281 -11.640
  671   3HG1  VAL  92          3HG1      VAL  92   1.537  -0.770 -13.007
  672   1HG2  VAL  92          1HG2      VAL  92  -0.103  -2.404  -9.477
  673   2HG2  VAL  92          2HG2      VAL  92   1.335  -3.029 -10.281
  674   3HG2  VAL  92          3HG2      VAL  92   1.411  -1.505  -9.400
  675    H    ASN  93           H        ASN  93  -1.812  -0.847 -13.185
  676    HA   ASN  93           HA       ASN  93  -0.741   0.813 -14.973
  677   1HB   ASN  93          1HB       ASN  93  -2.266  -0.180 -16.223
  678   2HB   ASN  93          2HB       ASN  93  -3.076  -0.718 -14.775
  679   2HD2  ASN  93          2HD2      ASN  93  -3.016   1.626 -17.309
  680   1HD2  ASN  93          1HD2      ASN  93  -4.561   2.328 -16.985
  681    H    CYS  94           H        CYS  94  -3.290   1.558 -12.696
  682    HA   CYS  94           HA       CYS  94  -3.767   4.200 -13.549
  683   1HB   CYS  94          1HB       CYS  94  -5.151   2.701 -11.944
  684   2HB   CYS  94          2HB       CYS  94  -4.088   3.337 -10.691
  685    H    ALA  95           H        ALA  95  -1.687   2.893 -10.954
  686    HA   ALA  95           HA       ALA  95  -0.721   5.460 -10.198
  687   1HB   ALA  95          1HB       ALA  95  -0.679   3.556  -8.680
  688   2HB   ALA  95          2HB       ALA  95   0.569   2.807  -9.678
  689   3HB   ALA  95          3HB       ALA  95   0.897   4.329  -8.850
  690    H    LYS  96           H        LYS  96   0.493   2.981 -12.405
  691    HA   LYS  96           HA       LYS  96   3.011   3.938 -12.939
  692   1HB   LYS  96          1HB       LYS  96   1.913   1.888 -13.951
  693   2HB   LYS  96          2HB       LYS  96   1.077   2.969 -15.058
  694   1HG   LYS  96          1HG       LYS  96   3.819   3.621 -15.181
  695   2HG   LYS  96          2HG       LYS  96   3.692   1.863 -15.261
  696   1HD   LYS  96          1HD       LYS  96   1.823   3.474 -16.917
  697   2HD   LYS  96          2HD       LYS  96   3.511   3.378 -17.427
  698   1HE   LYS  96          1HE       LYS  96   2.955   0.774 -16.844
  699   2HE   LYS  96          2HE       LYS  96   1.405   1.339 -17.466
  700   1HZ   LYS  96          1HZ       LYS  96   3.354   2.330 -19.168
  701   2HZ   LYS  96          2HZ       LYS  96   3.760   0.711 -18.890
  702   3HZ   LYS  96          3HZ       LYS  96   2.230   1.109 -19.493
  703    H    LYS  97           H        LYS  97  -0.126   4.949 -13.886
  704    HA   LYS  97           HA       LYS  97   0.731   7.131 -15.591
  705   1HB   LYS  97          1HB       LYS  97  -1.758   5.772 -15.028
  706   2HB   LYS  97          2HB       LYS  97  -1.970   7.514 -14.911
  707   1HG   LYS  97          1HG       LYS  97  -1.883   7.767 -17.117
  708   2HG   LYS  97          2HG       LYS  97  -0.445   6.754 -17.257
  709   1HD   LYS  97          1HD       LYS  97  -2.371   4.907 -16.695
  710   2HD   LYS  97          2HD       LYS  97  -3.271   6.083 -17.655
  711   1HE   LYS  97          1HE       LYS  97  -1.629   5.914 -19.439
  712   2HE   LYS  97          2HE       LYS  97  -0.670   4.794 -18.473
  713   1HZ   LYS  97          1HZ       LYS  97  -2.887   3.450 -18.457
  714   2HZ   LYS  97          2HZ       LYS  97  -3.219   4.344 -19.855
  715   3HZ   LYS  97          3HZ       LYS  97  -1.845   3.360 -19.787
  716    H    ILE  98           H        ILE  98  -0.301   6.629 -12.289
  717    HA   ILE  98           HA       ILE  98  -0.768   9.294 -11.578
  718    HB   ILE  98           HB       ILE  98   0.097   6.963  -9.898
  719   1HG1  ILE  98          1HG1      ILE  98  -2.553   8.423 -10.043
  720   2HG1  ILE  98          2HG1      ILE  98  -2.194   6.962 -10.957
  721   1HG2  ILE  98          1HG2      ILE  98  -0.691   9.734  -9.012
  722   2HG2  ILE  98          2HG2      ILE  98  -0.515   8.341  -7.944
  723   3HG2  ILE  98          3HG2      ILE  98   0.886   8.970  -8.811
  724   1HD1  ILE  98          1HD1      ILE  98  -1.597   6.047  -8.549
  725   2HD1  ILE  98          2HD1      ILE  98  -2.725   7.315  -8.067
  726   3HD1  ILE  98          3HD1      ILE  98  -3.247   6.044  -9.173
  727    H    VAL  99           H        VAL  99   2.119   7.297 -11.233
  728    HA   VAL  99           HA       VAL  99   3.758   9.430 -10.296
  729    HB   VAL  99           HB       VAL  99   4.097   6.918  -9.903
  730   1HG1  VAL  99          1HG1      VAL  99   5.491   7.206 -12.561
  731   2HG1  VAL  99          2HG1      VAL  99   5.651   5.830 -11.469
  732   3HG1  VAL  99          3HG1      VAL  99   4.094   6.189 -12.215
  733   1HG2  VAL  99          1HG2      VAL  99   6.222   8.939 -10.466
  734   2HG2  VAL  99          2HG2      VAL  99   5.672   8.291  -8.922
  735   3HG2  VAL  99          3HG2      VAL  99   6.668   7.302  -9.988
  736    H    SER 100           H        SER 100   2.848   8.288 -13.437
  737    HA   SER 100           HA       SER 100   5.073   9.626 -14.753
  738   1HB   SER 100          1HB       SER 100   2.908   7.782 -15.576
  739   2HB   SER 100          2HB       SER 100   3.402   8.967 -16.785
  740    HG   SER 100           HG       SER 100   5.234   7.952 -17.020
  741    H    ASP 101           H        ASP 101   2.154  10.486 -13.438
  742    HA   ASP 101           HA       ASP 101   1.423  12.506 -15.379
  743   1HB   ASP 101          1HB       ASP 101   0.213  11.303 -13.004
  744   2HB   ASP 101          2HB       ASP 101  -0.039  13.044 -13.100
  745    H    GLY 102           H        GLY 102   3.701  12.288 -12.963
  746   1HA   GLY 102          1HA       GLY 102   3.626  15.202 -12.475
  747   2HA   GLY 102          2HA       GLY 102   5.111  14.390 -12.942
  748    H    ASN 103           H        ASN 103   3.386  12.333 -10.984
  749    HA   ASN 103           HA       ASN 103   4.000  13.409  -8.422
  750   1HB   ASN 103          1HB       ASN 103   3.107  10.718  -9.411
  751   2HB   ASN 103          2HB       ASN 103   3.581  10.940  -7.728
  752   2HD2  ASN 103          2HD2      ASN 103   2.614  13.274  -6.998
  753   1HD2  ASN 103          1HD2      ASN 103   0.898  13.348  -7.178
  754    H    GLY 104           H        GLY 104   5.097  10.766  -7.389
  755   1HA   GLY 104          1HA       GLY 104   7.868  11.504  -7.689
  756   2HA   GLY 104          2HA       GLY 104   7.454   9.955  -8.411
  757    H    MET 105           H        MET 105   5.494   9.190  -6.493
  758    HA   MET 105           HA       MET 105   5.461   7.802  -4.680
  759   1HB   MET 105          1HB       MET 105   8.277   8.697  -4.042
  760   2HB   MET 105          2HB       MET 105   7.433   7.294  -3.398
  761   1HG   MET 105          1HG       MET 105   8.615   7.710  -6.106
  762   2HG   MET 105          2HG       MET 105   8.862   6.387  -4.969
  763   1HE   MET 105          1HE       MET 105   5.781   5.857  -4.146
  764   2HE   MET 105          2HE       MET 105   5.392   4.530  -5.241
  765   3HE   MET 105          3HE       MET 105   6.954   4.569  -4.423
  766    H    ASN 106           H        ASN 106   5.545  10.957  -4.931
  767    HA   ASN 106           HA       ASN 106   5.524  11.642  -2.106
  768   1HB   ASN 106          1HB       ASN 106   5.729  13.091  -4.683
  769   2HB   ASN 106          2HB       ASN 106   4.942  13.938  -3.366
  770   2HD2  ASN 106          2HD2      ASN 106   6.249  15.160  -2.216
  771   1HD2  ASN 106          1HD2      ASN 106   7.932  14.879  -1.944
  772    H    ALA 107           H        ALA 107   3.366  11.164  -4.801
  773    HA   ALA 107           HA       ALA 107   1.097  12.525  -3.947
  774   1HB   ALA 107          1HB       ALA 107   1.670  10.978  -6.081
  775   2HB   ALA 107          2HB       ALA 107   0.038  11.484  -5.647
  776   3HB   ALA 107          3HB       ALA 107   0.620   9.888  -5.176
  777    H    TRP 108           H        TRP 108   2.237   9.285  -3.144
  778    HA   TRP 108           HA       TRP 108  -0.004   8.750  -1.416
  779   1HB   TRP 108          1HB       TRP 108   2.576   7.210  -1.778
  780   2HB   TRP 108          2HB       TRP 108   1.116   6.624  -0.980
  781    HD1  TRP 108           HD1      TRP 108  -0.998   6.051  -2.559
  782    HE1  TRP 108           HE1      TRP 108  -1.149   5.467  -5.060
  783    HE3  TRP 108           HE3      TRP 108   3.617   7.668  -4.053
  784    HZ2  TRP 108           HZ2      TRP 108   0.469   5.667  -7.370
  785    HZ3  TRP 108           HZ3      TRP 108   4.237   7.437  -6.422
  786    HH2  TRP 108           HH2      TRP 108   2.697   6.457  -8.043
  787    H    VAL 109           H        VAL 109  -0.175   9.274   0.635
  788    HA   VAL 109           HA       VAL 109   1.819  10.790   1.969
  789    HB   VAL 109           HB       VAL 109  -0.285   9.722   3.615
  790   1HG1  VAL 109          1HG1      VAL 109   1.340  12.003   3.472
  791   2HG1  VAL 109          2HG1      VAL 109  -0.327  12.555   3.306
  792   3HG1  VAL 109          3HG1      VAL 109   0.150  11.599   4.710
  793   1HG2  VAL 109          1HG2      VAL 109  -1.414   9.796   1.405
  794   2HG2  VAL 109          2HG2      VAL 109  -2.115  10.897   2.591
  795   3HG2  VAL 109          3HG2      VAL 109  -1.051  11.520   1.330
  796    H    ALA 110           H        ALA 110   1.041   7.410   2.011
  797    HA   ALA 110           HA       ALA 110   2.137   6.833   4.567
  798   1HB   ALA 110          1HB       ALA 110   1.782   5.026   2.176
  799   2HB   ALA 110          2HB       ALA 110   2.137   4.497   3.821
  800   3HB   ALA 110          3HB       ALA 110   0.605   5.294   3.462
  801    H    TRP 111           H        TRP 111   3.503   7.464   1.491
  802    HA   TRP 111           HA       TRP 111   6.059   6.267   2.168
  803   1HB   TRP 111          1HB       TRP 111   5.323   6.146  -0.157
  804   2HB   TRP 111          2HB       TRP 111   5.238   7.897  -0.245
  805    HD1  TRP 111           HD1      TRP 111   7.635   5.015  -0.564
  806    HE1  TRP 111           HE1      TRP 111   9.962   5.894  -1.225
  807    HE3  TRP 111           HE3      TRP 111   6.844  10.023   0.118
  808    HZ2  TRP 111           HZ2      TRP 111  11.286   8.375  -1.432
  809    HZ3  TRP 111           HZ3      TRP 111   8.694  11.580  -0.334
  810    HH2  TRP 111           HH2      TRP 111  10.869  10.771  -1.091
  811    H    ARG 112           H        ARG 112   4.567   9.480   1.991
  812    HA   ARG 112           HA       ARG 112   7.079  10.739   2.767
  813   1HB   ARG 112          1HB       ARG 112   4.604  11.569   1.496
  814   2HB   ARG 112          2HB       ARG 112   5.086  12.656   2.790
  815   1HG   ARG 112          1HG       ARG 112   7.386  12.067   1.235
  816   2HG   ARG 112          2HG       ARG 112   6.075  12.512   0.139
  817   1HD   ARG 112          1HD       ARG 112   5.680  14.532   1.542
  818   2HD   ARG 112          2HD       ARG 112   7.112  14.107   2.478
  819    HE   ARG 112           HE       ARG 112   7.936  14.184  -0.145
  820   1HH1  ARG 112          1HH1      ARG 112   6.486  16.410   2.110
  821   2HH1  ARG 112          2HH1      ARG 112   7.218  17.809   1.397
  822   1HH2  ARG 112          1HH2      ARG 112   8.904  16.020  -1.089
  823   2HH2  ARG 112          2HH2      ARG 112   8.592  17.588  -0.421
  824    H    ASN 113           H        ASN 113   6.175   9.010   4.677
  825    HA   ASN 113           HA       ASN 113   5.714  10.822   6.889
  826   1HB   ASN 113          1HB       ASN 113   3.438  10.010   5.950
  827   2HB   ASN 113          2HB       ASN 113   3.856   8.468   6.690
  828   2HD2  ASN 113          2HD2      ASN 113   1.627   9.761   7.497
  829   1HD2  ASN 113          1HD2      ASN 113   1.841  10.391   9.092
  830    H    ARG 114           H        ARG 114   5.488   7.333   6.267
  831    HA   ARG 114           HA       ARG 114   7.309   6.874   8.518
  832   1HB   ARG 114          1HB       ARG 114   5.129   5.327   7.232
  833   2HB   ARG 114          2HB       ARG 114   6.472   4.414   7.895
  834   1HG   ARG 114          1HG       ARG 114   4.941   4.491   9.639
  835   2HG   ARG 114          2HG       ARG 114   6.085   5.775  10.036
  836   1HD   ARG 114          1HD       ARG 114   3.880   6.673   8.351
  837   2HD   ARG 114          2HD       ARG 114   3.349   6.032   9.906
  838    HE   ARG 114           HE       ARG 114   4.985   8.402   9.456
  839   1HH1  ARG 114          1HH1      ARG 114   3.536   6.174  11.707
  840   2HH1  ARG 114          2HH1      ARG 114   3.688   7.242  13.062
  841   1HH2  ARG 114          1HH2      ARG 114   5.191   9.815  11.233
  842   2HH2  ARG 114          2HH2      ARG 114   4.629   9.312  12.792
  843    H    CYS 115           H        CYS 115   7.555   7.277   5.290
  844    HA   CYS 115           HA       CYS 115   9.680   5.254   5.041
  845   1HB   CYS 115          1HB       CYS 115   7.715   5.078   3.468
  846   2HB   CYS 115          2HB       CYS 115   8.249   6.597   2.755
  847    H    LYS 116           H        LYS 116   8.827   8.580   4.070
  848    HA   LYS 116           HA       LYS 116  11.242   9.302   2.935
  849   1HB   LYS 116          1HB       LYS 116   9.114  10.642   2.949
  850   2HB   LYS 116          2HB       LYS 116   9.495  11.123   4.596
  851   1HG   LYS 116          1HG       LYS 116  11.055  12.600   3.943
  852   2HG   LYS 116          2HG       LYS 116  11.640  11.567   2.638
  853   1HD   LYS 116          1HD       LYS 116   9.172  12.223   1.719
  854   2HD   LYS 116          2HD       LYS 116   9.600  13.685   2.610
  855   1HE   LYS 116          1HE       LYS 116  11.871  12.861   1.116
  856   2HE   LYS 116          2HE       LYS 116  10.477  12.851   0.038
  857   1HZ   LYS 116          1HZ       LYS 116  10.387  15.176   1.604
  858   2HZ   LYS 116          2HZ       LYS 116  11.938  15.050   0.939
  859   3HZ   LYS 116          3HZ       LYS 116  10.582  15.045  -0.071
  860    H    GLY 117           H        GLY 117  13.069   8.617   3.983
  861   1HA   GLY 117          1HA       GLY 117  13.505   9.713   6.691
  862   2HA   GLY 117          2HA       GLY 117  14.731   9.821   5.438
  863    H    THR 118           H        THR 118  13.453   6.923   4.803
  864    HA   THR 118           HA       THR 118  15.186   5.536   6.739
  865    HB   THR 118           HB       THR 118  13.765   3.555   6.454
  866    HG1  THR 118           HG1      THR 118  11.599   4.253   5.387
  867   1HG2  THR 118          1HG2      THR 118  13.234   5.672   8.015
  868   2HG2  THR 118          2HG2      THR 118  11.749   5.634   7.065
  869   3HG2  THR 118          3HG2      THR 118  12.235   4.219   7.998
  870    H    ASP 119           H        ASP 119  14.785   3.017   5.206
  871    HA   ASP 119           HA       ASP 119  16.320   3.611   2.791
  872   1HB   ASP 119          1HB       ASP 119  17.636   2.806   4.887
  873   2HB   ASP 119          2HB       ASP 119  17.054   1.248   4.342
  874    H    VAL 120           H        VAL 120  14.917   3.041   1.251
  875    HA   VAL 120           HA       VAL 120  13.142   0.818   1.488
  876    HB   VAL 120           HB       VAL 120  12.519   1.309  -0.832
  877   1HG1  VAL 120          1HG1      VAL 120  12.235   3.014   1.386
  878   2HG1  VAL 120          2HG1      VAL 120  12.507   4.050  -0.015
  879   3HG1  VAL 120          3HG1      VAL 120  11.184   2.885  -0.022
  880   1HG2  VAL 120          1HG2      VAL 120  15.113   2.429  -0.951
  881   2HG2  VAL 120          2HG2      VAL 120  13.931   2.269  -2.251
  882   3HG2  VAL 120          3HG2      VAL 120  13.962   3.728  -1.261
  883    H    GLN 121           H        GLN 121  16.288   1.401   0.088
  884    HA   GLN 121           HA       GLN 121  16.468  -0.821  -1.610
  885   1HB   GLN 121          1HB       GLN 121  18.433   0.922  -0.193
  886   2HB   GLN 121          2HB       GLN 121  19.016  -0.595  -0.864
  887   1HG   GLN 121          1HG       GLN 121  18.267   0.049  -3.067
  888   2HG   GLN 121          2HG       GLN 121  17.565   1.531  -2.422
  889   2HE2  GLN 121          2HE2      GLN 121  18.745   3.131  -3.212
  890   1HE2  GLN 121          1HE2      GLN 121  20.468   3.242  -3.147
  891    H    ALA 122           H        ALA 122  16.507  -0.495   1.802
  892    HA   ALA 122           HA       ALA 122  17.596  -3.153   2.261
  893   1HB   ALA 122          1HB       ALA 122  18.138  -1.164   3.724
  894   2HB   ALA 122          2HB       ALA 122  17.598  -2.614   4.568
  895   3HB   ALA 122          3HB       ALA 122  16.485  -1.267   4.328
  896    H    TRP 123           H        TRP 123  14.561  -1.551   1.913
  897    HA   TRP 123           HA       TRP 123  12.922  -3.287   3.422
  898   1HB   TRP 123          1HB       TRP 123  12.483  -1.340   1.216
  899   2HB   TRP 123          2HB       TRP 123  11.212  -2.521   1.511
  900    HD1  TRP 123           HD1      TRP 123  11.528   0.826   2.202
  901    HE1  TRP 123           HE1      TRP 123  10.615   1.542   4.501
  902    HE3  TRP 123           HE3      TRP 123  11.407  -3.713   4.519
  903    HZ2  TRP 123           HZ2      TRP 123   9.947   0.309   6.939
  904    HZ3  TRP 123           HZ3      TRP 123  10.622  -3.867   6.825
  905    HH2  TRP 123           HH2      TRP 123   9.899  -1.874   8.023
  906    H    ILE 124           H        ILE 124  14.622  -3.758   0.508
  907    HA   ILE 124           HA       ILE 124  13.169  -6.281   0.054
  908    HB   ILE 124           HB       ILE 124  13.841  -6.049  -2.369
  909   1HG1  ILE 124          1HG1      ILE 124  13.849  -3.164  -2.358
  910   2HG1  ILE 124          2HG1      ILE 124  15.176  -3.776  -1.374
  911   1HG2  ILE 124          1HG2      ILE 124  11.589  -5.304  -1.072
  912   2HG2  ILE 124          2HG2      ILE 124  12.010  -3.800  -1.892
  913   3HG2  ILE 124          3HG2      ILE 124  11.778  -5.280  -2.825
  914   1HD1  ILE 124          1HD1      ILE 124  14.852  -5.104  -3.965
  915   2HD1  ILE 124          2HD1      ILE 124  15.288  -3.396  -4.044
  916   3HD1  ILE 124          3HD1      ILE 124  16.307  -4.526  -3.152
  917    H    ARG 125           H        ARG 125  15.800  -5.233   1.371
  918    HA   ARG 125           HA       ARG 125  17.944  -6.426  -0.030
  919   1HB   ARG 125          1HB       ARG 125  18.025  -4.703   1.877
  920   2HB   ARG 125          2HB       ARG 125  17.859  -6.079   2.959
  921   1HG   ARG 125          1HG       ARG 125  19.926  -6.642   1.084
  922   2HG   ARG 125          2HG       ARG 125  20.205  -5.045   1.784
  923   1HD   ARG 125          1HD       ARG 125  19.849  -7.656   3.246
  924   2HD   ARG 125          2HD       ARG 125  21.307  -6.668   3.155
  925    HE   ARG 125           HE       ARG 125  19.069  -6.293   4.911
  926   1HH1  ARG 125          1HH1      ARG 125  21.714  -4.707   3.290
  927   2HH1  ARG 125          2HH1      ARG 125  21.805  -3.408   4.432
  928   1HH2  ARG 125          1HH2      ARG 125  19.181  -4.587   6.419
  929   2HH2  ARG 125          2HH2      ARG 125  20.365  -3.340   6.211
  930    H    GLY 126           H        GLY 126  17.396  -8.512  -0.651
  931   1HA   GLY 126          1HA       GLY 126  17.162 -10.454   1.565
  932   2HA   GLY 126          2HA       GLY 126  18.128 -10.755   0.129
  933    H    CYS 127           H        CYS 127  15.409  -9.111  -0.811
  934    HA   CYS 127           HA       CYS 127  13.430 -11.085  -0.798
  935   1HB   CYS 127          1HB       CYS 127  13.865  -8.553  -2.166
  936   2HB   CYS 127          2HB       CYS 127  12.691  -9.625  -2.901
  937    H    ARG 128           H        ARG 128  12.454 -11.515  -3.235
  938    HA   ARG 128           HA       ARG 128  14.616 -12.710  -4.823
  939   1HB   ARG 128          1HB       ARG 128  12.896 -14.640  -5.202
  940   2HB   ARG 128          2HB       ARG 128  13.904 -14.637  -3.762
  941   1HG   ARG 128          1HG       ARG 128  11.406 -13.207  -3.375
  942   2HG   ARG 128          2HG       ARG 128  11.167 -14.894  -3.836
  943   1HD   ARG 128          1HD       ARG 128  12.812 -13.860  -1.530
  944   2HD   ARG 128          2HD       ARG 128  11.275 -14.717  -1.430
  945    HE   ARG 128           HE       ARG 128  12.838 -16.470  -2.746
  946   1HH1  ARG 128          1HH1      ARG 128  13.290 -14.661   0.197
  947   2HH1  ARG 128          2HH1      ARG 128  14.306 -15.858   0.929
  948   1HH2  ARG 128          1HH2      ARG 128  14.175 -18.051  -1.791
  949   2HH2  ARG 128          2HH2      ARG 128  14.809 -17.784  -0.201
  950    H    LEU 129           H        LEU 129  14.268 -10.861  -6.189
  951    HA   LEU 129           HA       LEU 129  11.974 -11.242  -7.985
  952   1HB   LEU 129          1HB       LEU 129  12.005  -8.708  -8.274
  953   2HB   LEU 129          2HB       LEU 129  11.298  -9.346  -6.802
  954    HG   LEU 129           HG       LEU 129  13.903  -8.938  -6.047
  955   1HD1  LEU 129          1HD1      LEU 129  13.691  -7.565  -8.435
  956   2HD1  LEU 129          2HD1      LEU 129  13.434  -6.323  -7.209
  957   3HD1  LEU 129          3HD1      LEU 129  14.901  -7.301  -7.179
  958   1HD2  LEU 129          1HD2      LEU 129  11.509  -7.120  -5.841
  959   2HD2  LEU 129          2HD2      LEU 129  12.016  -8.360  -4.695
  960   3HD2  LEU 129          3HD2      LEU 129  12.995  -6.909  -4.915

  No H/Q in entry =         960
  Start of MODEL    3
    1    H1   LYS   1           H1       LYS   1  -7.227  -9.225   1.826
    2    H2   LYS   1           H2       LYS   1  -7.531  -8.997   0.177
    3    H3   LYS   1           H3       LYS   1  -8.070 -10.402   0.950
    4    HA   LYS   1           HA       LYS   1  -5.842 -11.156   1.303
    5   1HB   LYS   1          1HB       LYS   1  -7.158 -11.334  -0.961
    6   2HB   LYS   1          2HB       LYS   1  -5.902 -10.255  -1.556
    7   1HG   LYS   1          1HG       LYS   1  -4.688 -12.396  -0.109
    8   2HG   LYS   1          2HG       LYS   1  -5.814 -13.054  -1.297
    9   1HD   LYS   1          1HD       LYS   1  -4.739 -11.700  -3.044
   10   2HD   LYS   1          2HD       LYS   1  -3.596 -11.084  -1.848
   11   1HE   LYS   1          1HE       LYS   1  -2.410 -12.801  -2.863
   12   2HE   LYS   1          2HE       LYS   1  -3.060 -13.572  -1.416
   13   1HZ   LYS   1          1HZ       LYS   1  -4.506 -13.700  -3.988
   14   2HZ   LYS   1          2HZ       LYS   1  -3.266 -14.796  -3.632
   15   3HZ   LYS   1          3HZ       LYS   1  -4.639 -14.722  -2.646
   16    H    VAL   2           H        VAL   2  -3.930 -10.488   2.003
   17    HA   VAL   2           HA       VAL   2  -2.878  -7.921   1.012
   18    HB   VAL   2           HB       VAL   2  -2.366  -9.318   3.641
   19   1HG1  VAL   2          1HG1      VAL   2  -0.505  -7.854   2.336
   20   2HG1  VAL   2          2HG1      VAL   2  -1.351  -6.586   3.221
   21   3HG1  VAL   2          3HG1      VAL   2  -0.633  -7.940   4.093
   22   1HG2  VAL   2          1HG2      VAL   2  -4.324  -7.436   2.811
   23   2HG2  VAL   2          2HG2      VAL   2  -4.055  -8.109   4.419
   24   3HG2  VAL   2          3HG2      VAL   2  -3.222  -6.634   3.930
   25    H    PHE   3           H        PHE   3  -1.057  -7.964  -0.184
   26    HA   PHE   3           HA       PHE   3   0.289 -10.413  -0.745
   27   1HB   PHE   3          1HB       PHE   3   1.048  -7.544  -1.346
   28   2HB   PHE   3          2HB       PHE   3   1.904  -8.948  -1.964
   29    HD1  PHE   3           HD1      PHE   3  -0.981 -10.398  -2.258
   30    HD2  PHE   3           HD2      PHE   3   0.826  -6.817  -3.666
   31    HE1  PHE   3           HE1      PHE   3  -2.453 -10.431  -4.229
   32    HE2  PHE   3           HE2      PHE   3  -0.637  -6.841  -5.632
   33    HZ   PHE   3           HZ       PHE   3  -2.280  -8.648  -5.921
   34    H    GLY   4           H        GLY   4   2.827 -10.294  -0.638
   35   1HA   GLY   4          1HA       GLY   4   4.394 -10.842   1.055
   36   2HA   GLY   4          2HA       GLY   4   3.492  -9.830   2.178
   37    H    ARG   5           H        ARG   5   6.360  -9.784   1.580
   38    HA   ARG   5           HA       ARG   5   6.542  -6.940   0.974
   39   1HB   ARG   5          1HB       ARG   5   9.008  -7.368   1.639
   40   2HB   ARG   5          2HB       ARG   5   7.777  -7.413   2.894
   41   1HG   ARG   5          1HG       ARG   5   7.753  -9.977   2.333
   42   2HG   ARG   5          2HG       ARG   5   9.370  -9.630   1.716
   43   1HD   ARG   5          1HD       ARG   5   8.355  -9.065   4.500
   44   2HD   ARG   5          2HD       ARG   5   9.471 -10.348   4.037
   45    HE   ARG   5           HE       ARG   5  10.087  -7.567   4.426
   46   1HH1  ARG   5          1HH1      ARG   5  11.058 -10.525   2.862
   47   2HH1  ARG   5          2HH1      ARG   5  12.718 -10.056   2.719
   48   1HH2  ARG   5          1HH2      ARG   5  12.272  -6.941   4.241
   49   2HH2  ARG   5          2HH2      ARG   5  13.409  -8.018   3.503
   50    H    CYS   6           H        CYS   6   8.263  -9.903  -0.040
   51    HA   CYS   6           HA       CYS   6   9.249  -8.486  -2.361
   52   1HB   CYS   6          1HB       CYS   6   9.600 -11.425  -1.870
   53   2HB   CYS   6          2HB       CYS   6  10.613 -10.318  -2.790
   54    H    GLU   7           H        GLU   7   6.880 -10.999  -1.625
   55    HA   GLU   7           HA       GLU   7   6.310 -11.976  -4.130
   56   1HB   GLU   7          1HB       GLU   7   4.429 -11.257  -1.877
   57   2HB   GLU   7          2HB       GLU   7   3.890 -12.079  -3.334
   58   1HG   GLU   7          1HG       GLU   7   6.159 -13.448  -2.293
   59   2HG   GLU   7          2HG       GLU   7   4.990 -13.199  -0.997
   60    H    LEU   8           H        LEU   8   4.996  -9.062  -2.623
   61    HA   LEU   8           HA       LEU   8   3.605  -8.146  -4.903
   62   1HB   LEU   8          1HB       LEU   8   3.098  -7.375  -2.630
   63   2HB   LEU   8          2HB       LEU   8   4.670  -6.611  -2.529
   64    HG   LEU   8           HG       LEU   8   2.504  -5.213  -3.058
   65   1HD1  LEU   8          1HD1      LEU   8   4.785  -4.339  -2.867
   66   2HD1  LEU   8          2HD1      LEU   8   5.083  -4.776  -4.549
   67   3HD1  LEU   8          3HD1      LEU   8   3.874  -3.553  -4.157
   68   1HD2  LEU   8          1HD2      LEU   8   2.200  -6.775  -5.152
   69   2HD2  LEU   8          2HD2      LEU   8   1.810  -5.056  -5.235
   70   3HD2  LEU   8          3HD2      LEU   8   3.340  -5.646  -5.883
   71    H    ALA   9           H        ALA   9   6.886  -7.534  -3.645
   72    HA   ALA   9           HA       ALA   9   7.581  -5.493  -5.440
   73   1HB   ALA   9          1HB       ALA   9   9.134  -7.432  -3.813
   74   2HB   ALA   9          2HB       ALA   9   9.106  -5.670  -3.758
   75   3HB   ALA   9          3HB       ALA   9   9.970  -6.498  -5.053
   76    H    ALA  10           H        ALA  10   8.150  -9.011  -5.716
   77    HA   ALA  10           HA       ALA  10   9.420  -9.051  -8.161
   78   1HB   ALA  10          1HB       ALA  10   8.907 -11.324  -8.278
   79   2HB   ALA  10          2HB       ALA  10   7.360 -11.116  -7.456
   80   3HB   ALA  10          3HB       ALA  10   8.866 -10.991  -6.547
   81    H    ALA  11           H        ALA  11   5.988  -8.836  -7.379
   82    HA   ALA  11           HA       ALA  11   5.027  -9.031 -10.010
   83   1HB   ALA  11          1HB       ALA  11   3.766  -7.580  -7.700
   84   2HB   ALA  11          2HB       ALA  11   3.587  -9.303  -8.033
   85   3HB   ALA  11          3HB       ALA  11   2.947  -8.114  -9.169
   86    H    MET  12           H        MET  12   6.129  -6.426  -8.083
   87    HA   MET  12           HA       MET  12   5.403  -4.269  -9.753
   88   1HB   MET  12          1HB       MET  12   7.912  -4.274  -8.106
   89   2HB   MET  12          2HB       MET  12   6.867  -2.926  -8.479
   90   1HG   MET  12          1HG       MET  12   5.976  -5.222  -6.784
   91   2HG   MET  12          2HG       MET  12   6.772  -3.797  -6.123
   92   1HE   MET  12          1HE       MET  12   6.039  -1.438  -7.011
   93   2HE   MET  12          2HE       MET  12   5.173  -1.693  -8.524
   94   3HE   MET  12          3HE       MET  12   4.349  -0.953  -7.153
   95    H    LYS  13           H        LYS  13   8.432  -6.094  -9.483
   96    HA   LYS  13           HA       LYS  13   9.951  -4.796 -11.383
   97   1HB   LYS  13          1HB       LYS  13  10.574  -6.760  -9.825
   98   2HB   LYS  13          2HB       LYS  13   9.986  -7.794 -11.119
   99   1HG   LYS  13          1HG       LYS  13  11.645  -6.193 -12.510
  100   2HG   LYS  13          2HG       LYS  13  12.449  -6.197 -10.940
  101   1HD   LYS  13          1HD       LYS  13  12.159  -8.752 -11.034
  102   2HD   LYS  13          2HD       LYS  13  11.845  -8.509 -12.754
  103   1HE   LYS  13          1HE       LYS  13  14.066  -7.087 -12.591
  104   2HE   LYS  13          2HE       LYS  13  14.356  -8.133 -11.201
  105   1HZ   LYS  13          1HZ       LYS  13  13.479  -9.496 -13.600
  106   2HZ   LYS  13          2HZ       LYS  13  15.000  -8.764 -13.718
  107   3HZ   LYS  13          3HZ       LYS  13  14.704  -9.906 -12.505
  108    H    ARG  14           H        ARG  14   7.761  -7.548 -11.854
  109    HA   ARG  14           HA       ARG  14   8.077  -7.727 -14.640
  110   1HB   ARG  14          1HB       ARG  14   6.273  -8.830 -12.611
  111   2HB   ARG  14          2HB       ARG  14   5.505  -8.605 -14.177
  112   1HG   ARG  14          1HG       ARG  14   7.212  -9.958 -15.240
  113   2HG   ARG  14          2HG       ARG  14   8.050 -10.140 -13.699
  114   1HD   ARG  14          1HD       ARG  14   6.460 -11.568 -12.848
  115   2HD   ARG  14          2HD       ARG  14   5.185 -10.934 -13.887
  116    HE   ARG  14           HE       ARG  14   5.952 -12.303 -15.631
  117   1HH1  ARG  14          1HH1      ARG  14   7.837 -12.683 -12.726
  118   2HH1  ARG  14          2HH1      ARG  14   8.560 -14.172 -13.236
  119   1HH2  ARG  14          1HH2      ARG  14   6.899 -14.263 -16.311
  120   2HH2  ARG  14          2HH2      ARG  14   8.028 -15.069 -15.274
  121    H    HIS  15           H        HIS  15   5.931  -5.813 -12.592
  122    HA   HIS  15           HA       HIS  15   4.347  -4.847 -14.746
  123   1HB   HIS  15          1HB       HIS  15   4.587  -4.297 -11.829
  124   2HB   HIS  15          2HB       HIS  15   3.790  -3.088 -12.831
  125    HD1  HIS  15           HD1      HIS  15   2.409  -4.925 -10.624
  126    HD2  HIS  15           HD2      HIS  15   2.271  -5.483 -14.738
  127    HE1  HIS  15           HE1      HIS  15   0.331  -6.274 -11.049
  128    HE2  HIS  15           HE2      HIS  15   0.223  -6.527 -13.553
  129    H    GLY  16           H        GLY  16   7.537  -4.133 -13.974
  130   1HA   GLY  16          1HA       GLY  16   7.494  -1.900 -15.718
  131   2HA   GLY  16          2HA       GLY  16   8.890  -2.583 -14.915
  132    H    LEU  17           H        LEU  17   7.508  -2.087 -12.168
  133    HA   LEU  17           HA       LEU  17   7.551   0.819 -12.221
  134   1HB   LEU  17          1HB       LEU  17   7.187  -0.811  -9.740
  135   2HB   LEU  17          2HB       LEU  17   6.626   0.814 -10.072
  136    HG   LEU  17           HG       LEU  17   5.386  -1.785 -10.700
  137   1HD1  LEU  17          1HD1      LEU  17   4.769   0.343  -9.129
  138   2HD1  LEU  17          2HD1      LEU  17   3.812   0.691 -10.569
  139   3HD1  LEU  17          3HD1      LEU  17   3.599  -0.839  -9.716
  140   1HD2  LEU  17          1HD2      LEU  17   5.579   0.412 -12.688
  141   2HD2  LEU  17          2HD2      LEU  17   5.399  -1.324 -12.934
  142   3HD2  LEU  17          3HD2      LEU  17   4.005  -0.350 -12.472
  143    H    ASP  18           H        ASP  18   9.758  -1.531 -11.973
  144    HA   ASP  18           HA       ASP  18  11.396  -0.501  -9.873
  145   1HB   ASP  18          1HB       ASP  18  11.919  -2.703 -10.228
  146   2HB   ASP  18          2HB       ASP  18  11.708  -2.592 -11.965
  147    H    ASN  19           H        ASN  19  11.826   1.593 -10.132
  148    HA   ASN  19           HA       ASN  19  12.898   3.471 -10.794
  149   1HB   ASN  19          1HB       ASN  19  14.655   1.380 -11.436
  150   2HB   ASN  19          2HB       ASN  19  14.612   2.400 -12.871
  151   2HD2  ASN  19          2HD2      ASN  19  14.556   4.859 -12.147
  152   1HD2  ASN  19          1HD2      ASN  19  15.833   5.287 -11.065
  153    H    TYR  20           H        TYR  20  10.523   2.639 -12.079
  154    HA   TYR  20           HA       TYR  20  10.669   3.189 -14.878
  155   1HB   TYR  20          1HB       TYR  20   8.760   1.981 -13.817
  156   2HB   TYR  20          2HB       TYR  20   8.309   3.466 -12.988
  157    HD1  TYR  20           HD1      TYR  20   8.950   2.225 -16.458
  158    HD2  TYR  20           HD2      TYR  20   6.664   4.775 -13.934
  159    HE1  TYR  20           HE1      TYR  20   7.555   2.867 -18.379
  160    HE2  TYR  20           HE2      TYR  20   5.262   5.423 -15.847
  161    HH   TYR  20           HH       TYR  20   5.515   5.501 -18.373
  162    H    ARG  21           H        ARG  21   9.467   5.214 -15.759
  163    HA   ARG  21           HA       ARG  21  10.729   7.469 -15.578
  164   1HB   ARG  21          1HB       ARG  21   7.716   7.337 -15.379
  165   2HB   ARG  21          2HB       ARG  21   8.622   8.774 -15.829
  166   1HG   ARG  21          1HG       ARG  21   9.537   6.759 -17.533
  167   2HG   ARG  21          2HG       ARG  21   7.785   6.559 -17.452
  168   1HD   ARG  21          1HD       ARG  21   7.647   8.194 -18.959
  169   2HD   ARG  21          2HD       ARG  21   8.133   9.295 -17.670
  170    HE   ARG  21           HE       ARG  21  10.217   9.462 -18.628
  171   1HH1  ARG  21          1HH1      ARG  21   8.450   6.853 -20.114
  172   2HH1  ARG  21          2HH1      ARG  21   9.599   6.631 -21.392
  173   1HH2  ARG  21          1HH2      ARG  21  11.733   9.178 -20.306
  174   2HH2  ARG  21          2HH2      ARG  21  11.465   7.953 -21.500
  175    H    GLY  22           H        GLY  22   8.541   6.371 -13.072
  176   1HA   GLY  22          1HA       GLY  22   8.074   7.201 -10.965
  177   2HA   GLY  22          2HA       GLY  22   8.935   8.673 -11.390
  178    H    TYR  23           H        TYR  23   9.077   5.693  -9.729
  179    HA   TYR  23           HA       TYR  23  11.946   6.092  -9.233
  180   1HB   TYR  23          1HB       TYR  23   9.725   5.884  -7.242
  181   2HB   TYR  23          2HB       TYR  23  11.355   5.386  -6.802
  182    HD1  TYR  23           HD1      TYR  23   9.580   8.272  -8.379
  183    HD2  TYR  23           HD2      TYR  23  12.755   6.974  -5.864
  184    HE1  TYR  23           HE1      TYR  23  10.145  10.613  -7.899
  185    HE2  TYR  23           HE2      TYR  23  13.329   9.314  -5.376
  186    HH   TYR  23           HH       TYR  23  12.429  11.836  -7.130
  187    H    SER  24           H        SER  24  12.718   4.281  -7.627
  188    HA   SER  24           HA       SER  24  12.538   1.852  -9.146
  189   1HB   SER  24          1HB       SER  24  14.360   1.072  -7.738
  190   2HB   SER  24          2HB       SER  24  14.698   2.707  -8.303
  191    HG   SER  24           HG       SER  24  13.374   2.406  -5.863
  192    H    LEU  25           H        LEU  25  12.449  -0.237  -8.027
  193    HA   LEU  25           HA       LEU  25  10.035  -0.875  -7.028
  194   1HB   LEU  25          1HB       LEU  25  12.685  -2.092  -7.034
  195   2HB   LEU  25          2HB       LEU  25  11.670  -2.667  -5.725
  196    HG   LEU  25           HG       LEU  25  10.509  -2.596  -8.456
  197   1HD1  LEU  25          1HD1      LEU  25  12.821  -3.560  -8.656
  198   2HD1  LEU  25          2HD1      LEU  25  12.305  -4.835  -7.552
  199   3HD1  LEU  25          3HD1      LEU  25  11.508  -4.645  -9.114
  200   1HD2  LEU  25          1HD2      LEU  25   9.193  -3.246  -6.475
  201   2HD2  LEU  25          2HD2      LEU  25   9.341  -4.557  -7.647
  202   3HD2  LEU  25          3HD2      LEU  25  10.323  -4.568  -6.182
  203    H    GLY  26           H        GLY  26  12.899  -0.376  -4.938
  204   1HA   GLY  26          1HA       GLY  26  13.039   0.506  -2.813
  205   2HA   GLY  26          2HA       GLY  26  11.859  -0.747  -2.474
  206    H    ASN  27           H        ASN  27  11.366   2.167  -4.423
  207    HA   ASN  27           HA       ASN  27  10.071   3.634  -2.361
  208   1HB   ASN  27          1HB       ASN  27   9.866   4.003  -5.353
  209   2HB   ASN  27          2HB       ASN  27   9.414   5.185  -4.128
  210   2HD2  ASN  27          2HD2      ASN  27  12.044   3.568  -5.725
  211   1HD2  ASN  27          1HD2      ASN  27  13.291   4.639  -5.191
  212    H    TRP  28           H        TRP  28   8.952   1.445  -4.853
  213    HA   TRP  28           HA       TRP  28   6.171   1.984  -4.530
  214   1HB   TRP  28          1HB       TRP  28   7.605  -0.381  -5.734
  215   2HB   TRP  28          2HB       TRP  28   5.868  -0.091  -5.843
  216    HD1  TRP  28           HD1      TRP  28   9.143   0.915  -7.364
  217    HE1  TRP  28           HE1      TRP  28   8.739   2.594  -9.260
  218    HE3  TRP  28           HE3      TRP  28   4.185   1.811  -6.580
  219    HZ2  TRP  28           HZ2      TRP  28   6.579   4.091 -10.317
  220    HZ3  TRP  28           HZ3      TRP  28   3.003   3.365  -8.071
  221    HH2  TRP  28           HH2      TRP  28   4.180   4.488  -9.908
  222    H    VAL  29           H        VAL  29   8.354  -0.535  -3.275
  223    HA   VAL  29           HA       VAL  29   6.353  -1.988  -1.935
  224    HB   VAL  29           HB       VAL  29   9.314  -1.815  -1.361
  225   1HG1  VAL  29          1HG1      VAL  29   7.229  -3.114   0.071
  226   2HG1  VAL  29          2HG1      VAL  29   8.237  -4.344  -0.692
  227   3HG1  VAL  29          3HG1      VAL  29   8.966  -3.145   0.376
  228   1HG2  VAL  29          1HG2      VAL  29   8.688  -2.518  -3.673
  229   2HG2  VAL  29          2HG2      VAL  29   9.573  -3.738  -2.758
  230   3HG2  VAL  29          3HG2      VAL  29   7.828  -3.887  -2.968
  231    H    CYS  30           H        CYS  30   8.686   0.420  -0.805
  232    HA   CYS  30           HA       CYS  30   7.935   0.450   1.873
  233   1HB   CYS  30          1HB       CYS  30   9.949   1.535   0.765
  234   2HB   CYS  30          2HB       CYS  30   8.877   2.858   0.323
  235    H    ALA  31           H        ALA  31   6.788   2.485  -0.816
  236    HA   ALA  31           HA       ALA  31   4.997   4.036   0.702
  237   1HB   ALA  31          1HB       ALA  31   5.247   3.435  -2.219
  238   2HB   ALA  31          2HB       ALA  31   3.904   4.396  -1.602
  239   3HB   ALA  31          3HB       ALA  31   5.563   4.941  -1.359
  240    H    ALA  32           H        ALA  32   4.472   1.098  -1.230
  241    HA   ALA  32           HA       ALA  32   1.676   0.979  -0.772
  242   1HB   ALA  32          1HB       ALA  32   2.277  -0.233  -2.621
  243   2HB   ALA  32          2HB       ALA  32   2.126  -1.519  -1.425
  244   3HB   ALA  32          3HB       ALA  32   3.720  -0.896  -1.854
  245    H    LYS  33           H        LYS  33   4.406  -0.754   0.717
  246    HA   LYS  33           HA       LYS  33   3.115  -2.453   2.402
  247   1HB   LYS  33          1HB       LYS  33   5.537  -2.406   2.177
  248   2HB   LYS  33          2HB       LYS  33   5.603  -0.841   2.974
  249   1HG   LYS  33          1HG       LYS  33   5.022  -1.753   5.058
  250   2HG   LYS  33          2HG       LYS  33   4.487  -3.271   4.334
  251   1HD   LYS  33          1HD       LYS  33   6.871  -3.616   3.584
  252   2HD   LYS  33          2HD       LYS  33   7.305  -2.239   4.600
  253   1HE   LYS  33          1HE       LYS  33   7.417  -3.591   6.357
  254   2HE   LYS  33          2HE       LYS  33   5.704  -3.961   6.165
  255   1HZ   LYS  33          1HZ       LYS  33   6.337  -5.720   4.593
  256   2HZ   LYS  33          2HZ       LYS  33   7.969  -5.401   4.895
  257   3HZ   LYS  33          3HZ       LYS  33   6.977  -5.979   6.137
  258    H    PHE  34           H        PHE  34   4.120   0.859   3.270
  259    HA   PHE  34           HA       PHE  34   2.652   0.743   5.703
  260   1HB   PHE  34          1HB       PHE  34   4.357   2.689   4.383
  261   2HB   PHE  34          2HB       PHE  34   3.193   3.348   5.514
  262    HD1  PHE  34           HD1      PHE  34   3.298   2.711   7.887
  263    HD2  PHE  34           HD2      PHE  34   6.252   1.441   5.098
  264    HE1  PHE  34           HE1      PHE  34   4.800   2.133   9.748
  265    HE2  PHE  34           HE2      PHE  34   7.759   0.860   6.955
  266    HZ   PHE  34           HZ       PHE  34   7.033   1.205   9.283
  267    H    GLU  35           H        GLU  35   1.821   1.566   2.503
  268    HA   GLU  35           HA       GLU  35  -0.202   3.454   3.009
  269   1HB   GLU  35          1HB       GLU  35   0.884   1.987   0.788
  270   2HB   GLU  35          2HB       GLU  35  -0.871   1.953   0.716
  271   1HG   GLU  35          1HG       GLU  35  -1.028   4.276   0.558
  272   2HG   GLU  35          2HG       GLU  35   0.623   4.515   1.131
  273    H    SER  36           H        SER  36  -0.429  -0.011   2.258
  274    HA   SER  36           HA       SER  36  -3.014  -0.085   3.684
  275   1HB   SER  36          1HB       SER  36  -3.664  -1.819   1.900
  276   2HB   SER  36          2HB       SER  36  -3.596  -0.137   1.379
  277    HG   SER  36           HG       SER  36  -2.141  -2.259   0.541
  278    H    ASN  37           H        ASN  37  -0.041  -1.054   4.090
  279    HA   ASN  37           HA       ASN  37   0.993  -2.818   5.125
  280   1HB   ASN  37          1HB       ASN  37  -1.835  -3.030   6.013
  281   2HB   ASN  37          2HB       ASN  37  -0.844  -4.469   6.226
  282   2HD2  ASN  37          2HD2      ASN  37  -1.884  -1.750   7.696
  283   1HD2  ASN  37          1HD2      ASN  37  -0.623  -1.537   8.858
  284    H    PHE  38           H        PHE  38   0.070  -2.884   2.384
  285    HA   PHE  38           HA       PHE  38   0.261  -4.167   0.588
  286   1HB   PHE  38          1HB       PHE  38   1.061  -6.193   2.653
  287   2HB   PHE  38          2HB       PHE  38   0.861  -6.649   0.963
  288    HD1  PHE  38           HD1      PHE  38   1.912  -4.531  -0.573
  289    HD2  PHE  38           HD2      PHE  38   3.299  -6.003   3.170
  290    HE1  PHE  38           HE1      PHE  38   4.157  -3.670  -1.076
  291    HE2  PHE  38           HE2      PHE  38   5.548  -5.140   2.676
  292    HZ   PHE  38           HZ       PHE  38   5.983  -3.979   0.548
  293    H    ASN  39           H        ASN  39  -2.239  -3.794   2.159
  294    HA   ASN  39           HA       ASN  39  -3.761  -6.178   1.485
  295   1HB   ASN  39          1HB       ASN  39  -4.162  -4.865   3.606
  296   2HB   ASN  39          2HB       ASN  39  -4.797  -3.569   2.601
  297   2HD2  ASN  39          2HD2      ASN  39  -5.324  -6.795   1.550
  298   1HD2  ASN  39          1HD2      ASN  39  -6.991  -6.898   1.989
  299    H    THR  40           H        THR  40  -4.248  -6.410  -0.573
  300    HA   THR  40           HA       THR  40  -4.397  -4.251  -2.420
  301    HB   THR  40           HB       THR  40  -4.548  -5.849  -4.059
  302    HG1  THR  40           HG1      THR  40  -6.186  -7.187  -4.024
  303   1HG2  THR  40          1HG2      THR  40  -3.510  -7.268  -1.626
  304   2HG2  THR  40          2HG2      THR  40  -3.504  -8.024  -3.219
  305   3HG2  THR  40          3HG2      THR  40  -2.600  -6.535  -2.947
  306    H    GLN  41           H        GLN  41  -6.519  -5.601  -0.219
  307    HA   GLN  41           HA       GLN  41  -8.889  -4.599  -1.630
  308   1HB   GLN  41          1HB       GLN  41  -8.353  -6.831   0.238
  309   2HB   GLN  41          2HB       GLN  41  -9.891  -6.021   0.415
  310   1HG   GLN  41          1HG       GLN  41  -9.500  -6.498  -2.342
  311   2HG   GLN  41          2HG       GLN  41  -9.112  -7.985  -1.477
  312   2HE2  GLN  41          2HE2      GLN  41 -10.788  -9.291  -1.509
  313   1HE2  GLN  41          1HE2      GLN  41 -12.437  -8.841  -1.263
  314    H    ALA  42           H        ALA  42  -6.730  -3.491   0.516
  315    HA   ALA  42           HA       ALA  42  -8.301  -2.594   2.684
  316   1HB   ALA  42          1HB       ALA  42  -5.575  -2.315   1.790
  317   2HB   ALA  42          2HB       ALA  42  -6.239  -2.257   3.424
  318   3HB   ALA  42          3HB       ALA  42  -6.197  -0.797   2.435
  319    H    THR  43           H        THR  43  -9.470  -0.829   3.014
  320    HA   THR  43           HA       THR  43  -9.615   1.198   0.879
  321    HB   THR  43           HB       THR  43 -11.910   1.289   0.979
  322    HG1  THR  43           HG1      THR  43 -12.849   0.106   3.053
  323   1HG2  THR  43          1HG2      THR  43 -11.192  -1.538   1.732
  324   2HG2  THR  43          2HG2      THR  43 -12.828  -1.056   1.287
  325   3HG2  THR  43          3HG2      THR  43 -11.513  -0.887   0.126
  326    H    ASN  44           H        ASN  44  -9.419   3.314   1.549
  327    HA   ASN  44           HA       ASN  44  -9.476   3.811   4.449
  328   1HB   ASN  44          1HB       ASN  44  -7.308   4.252   2.526
  329   2HB   ASN  44          2HB       ASN  44  -7.686   5.669   3.501
  330   2HD2  ASN  44          2HD2      ASN  44  -6.818   2.268   3.648
  331   1HD2  ASN  44          1HD2      ASN  44  -6.080   2.335   5.209
  332    H    ARG  45           H        ARG  45 -11.463   4.777   4.504
  333    HA   ARG  45           HA       ARG  45 -12.258   6.769   2.605
  334   1HB   ARG  45          1HB       ARG  45 -13.459   5.352   4.854
  335   2HB   ARG  45          2HB       ARG  45 -13.939   7.043   4.788
  336   1HG   ARG  45          1HG       ARG  45 -14.387   6.515   2.270
  337   2HG   ARG  45          2HG       ARG  45 -14.456   4.847   2.843
  338   1HD   ARG  45          1HD       ARG  45 -15.964   6.610   4.562
  339   2HD   ARG  45          2HD       ARG  45 -16.508   6.734   2.891
  340    HE   ARG  45           HE       ARG  45 -16.490   4.117   3.154
  341   1HH1  ARG  45          1HH1      ARG  45 -17.574   6.526   5.426
  342   2HH1  ARG  45          2HH1      ARG  45 -18.763   5.496   6.148
  343   1HH2  ARG  45          1HH2      ARG  45 -18.054   2.753   4.098
  344   2HH2  ARG  45          2HH2      ARG  45 -19.036   3.352   5.394
  345    H    ASN  46           H        ASN  46 -12.026   8.913   2.690
  346    HA   ASN  46           HA       ASN  46 -10.790  10.062   5.105
  347   1HB   ASN  46          1HB       ASN  46 -10.715  11.395   2.419
  348   2HB   ASN  46          2HB       ASN  46  -9.604  11.567   3.773
  349   2HD2  ASN  46          2HD2      ASN  46  -7.975  10.076   4.061
  350   1HD2  ASN  46          1HD2      ASN  46  -7.542   8.922   2.852
  351    H    THR  47           H        THR  47 -11.209  12.557   5.150
  352    HA   THR  47           HA       THR  47 -14.070  12.861   5.415
  353    HB   THR  47           HB       THR  47 -13.574  15.018   6.442
  354    HG1  THR  47           HG1      THR  47 -11.233  14.711   5.087
  355   1HG2  THR  47          1HG2      THR  47 -12.835  12.529   7.430
  356   2HG2  THR  47          2HG2      THR  47 -11.449  13.562   7.775
  357   3HG2  THR  47          3HG2      THR  47 -13.049  14.009   8.366
  358    H    ASP  48           H        ASP  48 -11.711  13.590   3.059
  359    HA   ASP  48           HA       ASP  48 -12.956  15.888   1.915
  360   1HB   ASP  48          1HB       ASP  48 -11.487  15.314  -0.069
  361   2HB   ASP  48          2HB       ASP  48 -10.648  15.595   1.452
  362    H    GLY  49           H        GLY  49 -13.756  12.612   1.926
  363   1HA   GLY  49          1HA       GLY  49 -15.609  13.054  -0.327
  364   2HA   GLY  49          2HA       GLY  49 -15.919  11.984   1.032
  365    H    SER  50           H        SER  50 -12.809  12.059  -0.542
  366    HA   SER  50           HA       SER  50 -13.382   9.869  -2.311
  367   1HB   SER  50          1HB       SER  50 -10.708   9.922  -2.349
  368   2HB   SER  50          2HB       SER  50 -11.685  11.087  -3.241
  369    HG   SER  50           HG       SER  50 -11.321  12.593  -1.676
  370    H    THR  51           H        THR  51 -11.269   8.182  -2.134
  371    HA   THR  51           HA       THR  51 -10.899   7.199   0.542
  372    HB   THR  51           HB       THR  51 -12.360   5.341  -1.323
  373    HG1  THR  51           HG1      THR  51 -13.541   6.919   0.735
  374   1HG2  THR  51          1HG2      THR  51 -11.004   4.864   0.991
  375   2HG2  THR  51          2HG2      THR  51 -12.648   5.097   1.585
  376   3HG2  THR  51          3HG2      THR  51 -12.315   3.862   0.370
  377    H    ASP  52           H        ASP  52  -9.625   5.103   0.500
  378    HA   ASP  52           HA       ASP  52  -7.913   5.010  -1.899
  379   1HB   ASP  52          1HB       ASP  52  -7.194   4.533   1.001
  380   2HB   ASP  52          2HB       ASP  52  -6.109   4.239  -0.354
  381    H    TYR  53           H        TYR  53  -9.135   3.416  -2.903
  382    HA   TYR  53           HA       TYR  53  -9.432   0.872  -1.500
  383   1HB   TYR  53          1HB       TYR  53 -10.467   1.708  -4.215
  384   2HB   TYR  53          2HB       TYR  53 -10.836   0.202  -3.387
  385    HD1  TYR  53           HD1      TYR  53 -11.925   0.493  -1.000
  386    HD2  TYR  53           HD2      TYR  53 -11.961   3.455  -4.050
  387    HE1  TYR  53           HE1      TYR  53 -13.892   1.534   0.044
  388    HE2  TYR  53           HE2      TYR  53 -13.930   4.503  -3.019
  389    HH   TYR  53           HH       TYR  53 -15.637   2.999  -0.371
  390    H    GLY  54           H        GLY  54  -7.022   0.465  -1.602
  391   1HA   GLY  54          1HA       GLY  54  -5.826   0.105  -4.159
  392   2HA   GLY  54          2HA       GLY  54  -6.401  -1.426  -3.519
  393    H    ILE  55           H        ILE  55  -4.117  -2.028  -3.624
  394    HA   ILE  55           HA       ILE  55  -2.860  -1.818  -1.079
  395    HB   ILE  55           HB       ILE  55  -2.524  -3.745  -2.689
  396   1HG1  ILE  55          1HG1      ILE  55   0.104  -2.462  -1.948
  397   2HG1  ILE  55          2HG1      ILE  55  -0.987  -3.125  -0.735
  398   1HG2  ILE  55          1HG2      ILE  55  -0.817  -1.716  -4.124
  399   2HG2  ILE  55          2HG2      ILE  55  -0.793  -3.451  -4.436
  400   3HG2  ILE  55          3HG2      ILE  55  -2.259  -2.519  -4.744
  401   1HD1  ILE  55          1HD1      ILE  55  -0.868  -5.257  -2.248
  402   2HD1  ILE  55          2HD1      ILE  55   0.640  -4.521  -2.791
  403   3HD1  ILE  55          3HD1      ILE  55   0.407  -4.897  -1.084
  404    H    LEU  56           H        LEU  56  -2.856  -0.024  -3.992
  405    HA   LEU  56           HA       LEU  56  -0.657   1.688  -3.055
  406   1HB   LEU  56          1HB       LEU  56  -1.271   0.623  -5.638
  407   2HB   LEU  56          2HB       LEU  56  -1.463   2.364  -5.708
  408    HG   LEU  56           HG       LEU  56   0.759   2.036  -6.362
  409   1HD1  LEU  56          1HD1      LEU  56   0.302   3.493  -4.178
  410   2HD1  LEU  56          2HD1      LEU  56   1.417   2.315  -3.489
  411   3HD1  LEU  56          3HD1      LEU  56   1.911   3.292  -4.872
  412   1HD2  LEU  56          1HD2      LEU  56   0.875  -0.056  -4.201
  413   2HD2  LEU  56          2HD2      LEU  56   1.046  -0.274  -5.943
  414   3HD2  LEU  56          3HD2      LEU  56   2.308   0.554  -5.029
  415    H    GLN  57           H        GLN  57  -3.799   1.434  -2.686
  416    HA   GLN  57           HA       GLN  57  -5.442   2.838  -2.060
  417   1HB   GLN  57          1HB       GLN  57  -3.563   5.145  -2.536
  418   2HB   GLN  57          2HB       GLN  57  -4.963   5.095  -1.475
  419   1HG   GLN  57          1HG       GLN  57  -2.484   3.438  -1.077
  420   2HG   GLN  57          2HG       GLN  57  -2.773   4.997  -0.306
  421   2HE2  GLN  57          2HE2      GLN  57  -3.858   5.039   1.547
  422   1HE2  GLN  57          1HE2      GLN  57  -4.698   3.700   2.246
  423    H    ILE  58           H        ILE  58  -6.381   2.099  -4.202
  424    HA   ILE  58           HA       ILE  58  -6.213   4.050  -6.329
  425    HB   ILE  58           HB       ILE  58  -8.085   1.696  -6.243
  426   1HG1  ILE  58          1HG1      ILE  58  -5.951   0.739  -5.740
  427   2HG1  ILE  58          2HG1      ILE  58  -6.249   0.452  -7.450
  428   1HG2  ILE  58          1HG2      ILE  58  -7.121   3.601  -8.273
  429   2HG2  ILE  58          2HG2      ILE  58  -7.246   1.919  -8.788
  430   3HG2  ILE  58          3HG2      ILE  58  -8.662   2.752  -8.150
  431   1HD1  ILE  58          1HD1      ILE  58  -4.895   2.777  -7.579
  432   2HD1  ILE  58          2HD1      ILE  58  -4.180   2.064  -6.133
  433   3HD1  ILE  58          3HD1      ILE  58  -4.142   1.185  -7.661
  434    H    ASN  59           H        ASN  59  -7.182   5.911  -5.668
  435    HA   ASN  59           HA       ASN  59  -9.585   6.050  -4.214
  436   1HB   ASN  59          1HB       ASN  59  -7.951   7.907  -4.400
  437   2HB   ASN  59          2HB       ASN  59  -8.387   8.103  -6.094
  438   2HD2  ASN  59          2HD2      ASN  59  -8.677  10.309  -4.915
  439   1HD2  ASN  59          1HD2      ASN  59 -10.297  10.657  -4.428
  440    H    SER  60           H        SER  60 -11.278   4.902  -5.048
  441    HA   SER  60           HA       SER  60 -11.875   4.707  -7.793
  442   1HB   SER  60          1HB       SER  60 -13.705   3.443  -7.151
  443   2HB   SER  60          2HB       SER  60 -12.665   3.275  -5.737
  444    HG   SER  60           HG       SER  60 -13.867   5.092  -4.850
  445    H    ARG  61           H        ARG  61 -12.307   7.301  -5.645
  446    HA   ARG  61           HA       ARG  61 -14.510   8.408  -7.241
  447   1HB   ARG  61          1HB       ARG  61 -14.373   8.323  -4.593
  448   2HB   ARG  61          2HB       ARG  61 -13.434   9.792  -4.824
  449   1HG   ARG  61          1HG       ARG  61 -15.712  10.074  -6.432
  450   2HG   ARG  61          2HG       ARG  61 -16.272   9.419  -4.891
  451   1HD   ARG  61          1HD       ARG  61 -15.897  11.345  -3.829
  452   2HD   ARG  61          2HD       ARG  61 -14.294  11.514  -4.544
  453    HE   ARG  61           HE       ARG  61 -16.508  12.141  -6.299
  454   1HH1  ARG  61          1HH1      ARG  61 -14.152  13.342  -4.031
  455   2HH1  ARG  61          2HH1      ARG  61 -14.237  14.973  -4.608
  456   1HH2  ARG  61          1HH2      ARG  61 -16.626  14.285  -7.066
  457   2HH2  ARG  61          2HH2      ARG  61 -15.644  15.510  -6.333
  458    H    TRP  62           H        TRP  62 -11.663   8.197  -8.046
  459    HA   TRP  62           HA       TRP  62 -11.418  10.855  -9.109
  460   1HB   TRP  62          1HB       TRP  62 -10.282  10.595  -6.673
  461   2HB   TRP  62          2HB       TRP  62  -8.930  10.125  -7.699
  462    HD1  TRP  62           HD1      TRP  62  -7.976  12.004  -9.401
  463    HE1  TRP  62           HE1      TRP  62  -8.069  14.575  -9.295
  464    HE3  TRP  62           HE3      TRP  62 -11.703  12.542  -5.943
  465    HZ2  TRP  62           HZ2      TRP  62  -9.529  16.565  -7.928
  466    HZ3  TRP  62           HZ3      TRP  62 -12.389  14.813  -5.291
  467    HH2  TRP  62           HH2      TRP  62 -11.323  16.782  -6.263
  468    H    TRP  63           H        TRP  63 -10.625   7.531  -9.201
  469    HA   TRP  63           HA       TRP  63  -9.035   8.038 -11.618
  470   1HB   TRP  63          1HB       TRP  63  -8.409   5.994  -9.483
  471   2HB   TRP  63          2HB       TRP  63  -7.602   6.092 -11.041
  472    HD1  TRP  63           HD1      TRP  63  -6.828   6.894  -7.683
  473    HE1  TRP  63           HE1      TRP  63  -5.195   8.876  -7.486
  474    HE3  TRP  63           HE3      TRP  63  -7.352   8.831 -12.369
  475    HZ2  TRP  63           HZ2      TRP  63  -4.256  10.991  -9.116
  476    HZ3  TRP  63           HZ3      TRP  63  -6.083  10.833 -12.976
  477    HH2  TRP  63           HH2      TRP  63  -4.554  11.896 -11.385
  478    H    CYS  64           H        CYS  64 -11.618   6.297 -10.178
  479    HA   CYS  64           HA       CYS  64 -11.928   4.855 -12.692
  480   1HB   CYS  64          1HB       CYS  64 -11.961   2.713 -11.825
  481   2HB   CYS  64          2HB       CYS  64 -10.690   3.457 -10.864
  482    H    ASN  65           H        ASN  65 -13.995   3.890 -13.024
  483    HA   ASN  65           HA       ASN  65 -16.103   5.425 -11.684
  484   1HB   ASN  65          1HB       ASN  65 -15.949   5.464 -14.177
  485   2HB   ASN  65          2HB       ASN  65 -16.278   3.733 -14.188
  486   2HD2  ASN  65          2HD2      ASN  65 -18.331   3.006 -13.841
  487   1HD2  ASN  65          1HD2      ASN  65 -19.705   4.048 -13.745
  488    H    ASP  66           H        ASP  66 -16.830   4.425  -9.920
  489    HA   ASP  66           HA       ASP  66 -17.238   1.515 -10.012
  490   1HB   ASP  66          1HB       ASP  66 -17.202   1.540  -7.595
  491   2HB   ASP  66          2HB       ASP  66 -15.788   2.398  -8.198
  492    H    GLY  67           H        GLY  67 -18.917   4.380 -10.302
  493   1HA   GLY  67          1HA       GLY  67 -21.442   3.041 -10.265
  494   2HA   GLY  67          2HA       GLY  67 -21.176   4.752 -10.560
  495    H    ARG  68           H        ARG  68 -19.754   3.697  -7.663
  496    HA   ARG  68           HA       ARG  68 -22.093   4.017  -6.014
  497   1HB   ARG  68          1HB       ARG  68 -19.201   3.439  -5.529
  498   2HB   ARG  68          2HB       ARG  68 -20.184   4.018  -4.192
  499   1HG   ARG  68          1HG       ARG  68 -21.631   1.955  -5.474
  500   2HG   ARG  68          2HG       ARG  68 -19.976   1.390  -5.245
  501   1HD   ARG  68          1HD       ARG  68 -20.092   1.577  -2.942
  502   2HD   ARG  68          2HD       ARG  68 -21.407   2.750  -3.003
  503    HE   ARG  68           HE       ARG  68 -22.930   0.986  -3.351
  504   1HH1  ARG  68          1HH1      ARG  68 -19.655  -0.121  -2.918
  505   2HH1  ARG  68          2HH1      ARG  68 -20.117  -1.754  -2.573
  506   1HH2  ARG  68          1HH2      ARG  68 -23.547  -1.162  -2.898
  507   2HH2  ARG  68          2HH2      ARG  68 -22.329  -2.346  -2.562
  508    H    THR  69           H        THR  69 -20.237   6.165  -7.637
  509    HA   THR  69           HA       THR  69 -21.057   8.344  -5.890
  510    HB   THR  69           HB       THR  69 -18.253   8.506  -6.897
  511    HG1  THR  69           HG1      THR  69 -18.058   6.611  -5.802
  512   1HG2  THR  69          1HG2      THR  69 -19.997   9.933  -5.081
  513   2HG2  THR  69          2HG2      THR  69 -18.477   9.495  -4.302
  514   3HG2  THR  69          3HG2      THR  69 -18.464  10.435  -5.793
  515    HA   PRO  70           HA       PRO  70 -21.911   9.884  -9.997
  516   1HB   PRO  70          1HB       PRO  70 -23.102  12.187  -9.272
  517   2HB   PRO  70          2HB       PRO  70 -23.900  10.621  -9.084
  518   1HG   PRO  70          1HG       PRO  70 -22.478  12.280  -7.038
  519   2HG   PRO  70          2HG       PRO  70 -24.010  11.400  -6.895
  520   1HD   PRO  70          1HD       PRO  70 -21.637  10.444  -5.949
  521   2HD   PRO  70          2HD       PRO  70 -22.963   9.397  -6.490
  522    H    GLY  71           H        GLY  71 -19.529  10.839  -7.964
  523   1HA   GLY  71          1HA       GLY  71 -18.190  12.842  -7.943
  524   2HA   GLY  71          2HA       GLY  71 -18.828  13.232  -9.533
  525    H    SER  72           H        SER  72 -18.260  10.030  -9.675
  526    HA   SER  72           HA       SER  72 -15.515   9.680  -9.778
  527   1HB   SER  72          1HB       SER  72 -17.837   8.338 -11.086
  528   2HB   SER  72          2HB       SER  72 -16.219   7.953 -11.671
  529    HG   SER  72           HG       SER  72 -17.408   7.402  -9.215
  530    H    ARG  73           H        ARG  73 -14.142  10.970 -10.819
  531    HA   ARG  73           HA       ARG  73 -14.797  12.402 -13.187
  532   1HB   ARG  73          1HB       ARG  73 -12.123  11.882 -11.876
  533   2HB   ARG  73          2HB       ARG  73 -12.386  13.012 -13.197
  534   1HG   ARG  73          1HG       ARG  73 -14.167  13.440 -10.925
  535   2HG   ARG  73          2HG       ARG  73 -12.456  13.629 -10.539
  536   1HD   ARG  73          1HD       ARG  73 -13.013  14.894 -13.042
  537   2HD   ARG  73          2HD       ARG  73 -14.162  15.462 -11.832
  538    HE   ARG  73           HE       ARG  73 -11.674  15.565 -10.640
  539   1HH1  ARG  73          1HH1      ARG  73 -13.235  17.000 -13.405
  540   2HH1  ARG  73          2HH1      ARG  73 -12.297  18.454 -13.341
  541   1HH2  ARG  73          1HH2      ARG  73 -10.435  17.476 -10.548
  542   2HH2  ARG  73          2HH2      ARG  73 -10.705  18.725 -11.716
  543    H    ASN  74           H        ASN  74 -12.943   9.470 -12.531
  544    HA   ASN  74           HA       ASN  74 -12.319   7.728 -13.866
  545   1HB   ASN  74          1HB       ASN  74 -14.670   8.202 -14.871
  546   2HB   ASN  74          2HB       ASN  74 -13.786   8.958 -16.193
  547   2HD2  ASN  74          2HD2      ASN  74 -13.345   6.027 -14.236
  548   1HD2  ASN  74          1HD2      ASN  74 -13.183   4.953 -15.577
  549    H    LEU  75           H        LEU  75 -10.633   9.846 -13.510
  550    HA   LEU  75           HA       LEU  75  -9.505  10.988 -15.823
  551   1HB   LEU  75          1HB       LEU  75  -8.802  10.529 -12.997
  552   2HB   LEU  75          2HB       LEU  75  -7.455  10.811 -14.074
  553    HG   LEU  75           HG       LEU  75  -9.831  12.650 -13.655
  554   1HD1  LEU  75          1HD1      LEU  75  -7.983  12.321 -11.824
  555   2HD1  LEU  75          2HD1      LEU  75  -7.035  13.351 -12.896
  556   3HD1  LEU  75          3HD1      LEU  75  -8.564  13.934 -12.239
  557   1HD2  LEU  75          1HD2      LEU  75  -8.087  12.494 -15.834
  558   2HD2  LEU  75          2HD2      LEU  75  -9.186  13.815 -15.436
  559   3HD2  LEU  75          3HD2      LEU  75  -7.515  13.859 -14.875
  560    H    CYS  76           H        CYS  76  -8.756   8.254 -13.887
  561    HA   CYS  76           HA       CYS  76  -6.555   7.341 -15.483
  562   1HB   CYS  76          1HB       CYS  76  -7.189   7.197 -12.914
  563   2HB   CYS  76          2HB       CYS  76  -7.879   5.671 -13.439
  564    H    ASN  77           H        ASN  77  -9.949   6.644 -15.081
  565    HA   ASN  77           HA       ASN  77 -11.411   5.274 -16.166
  566   1HB   ASN  77          1HB       ASN  77 -10.402   6.624 -18.095
  567   2HB   ASN  77          2HB       ASN  77  -9.419   5.201 -18.432
  568   2HD2  ASN  77          2HD2      ASN  77 -10.690   5.603 -20.500
  569   1HD2  ASN  77          1HD2      ASN  77 -12.175   4.734 -20.657
  570    H    ILE  78           H        ILE  78 -10.082   3.930 -14.365
  571    HA   ILE  78           HA       ILE  78  -9.169   1.481 -15.668
  572    HB   ILE  78           HB       ILE  78  -7.393   1.596 -14.347
  573   1HG1  ILE  78          1HG1      ILE  78  -9.286   0.460 -12.749
  574   2HG1  ILE  78          2HG1      ILE  78  -7.589   0.612 -12.321
  575   1HG2  ILE  78          1HG2      ILE  78  -8.810   3.894 -13.026
  576   2HG2  ILE  78          2HG2      ILE  78  -7.135   3.446 -12.707
  577   3HG2  ILE  78          3HG2      ILE  78  -7.617   3.971 -14.321
  578   1HD1  ILE  78          1HD1      ILE  78  -9.470   2.816 -11.644
  579   2HD1  ILE  78          2HD1      ILE  78  -9.441   1.355 -10.657
  580   3HD1  ILE  78          3HD1      ILE  78  -7.979   2.323 -10.843
  581    HA   PRO  79           HA       PRO  79 -12.779  -0.432 -13.884
  582   1HB   PRO  79          1HB       PRO  79 -11.389  -3.004 -13.941
  583   2HB   PRO  79          2HB       PRO  79 -12.771  -2.473 -14.901
  584   1HG   PRO  79          1HG       PRO  79 -10.308  -2.874 -15.967
  585   2HG   PRO  79          2HG       PRO  79 -11.451  -1.677 -16.603
  586   1HD   PRO  79          1HD       PRO  79  -9.066  -1.273 -14.838
  587   2HD   PRO  79          2HD       PRO  79  -9.650  -0.279 -16.192
  588    H    CYS  80           H        CYS  80 -13.155  -0.187 -11.748
  589    HA   CYS  80           HA       CYS  80 -11.160  -0.345  -9.788
  590   1HB   CYS  80          1HB       CYS  80 -14.029  -0.663  -9.037
  591   2HB   CYS  80          2HB       CYS  80 -12.780   0.338  -8.302
  592    H    SER  81           H        SER  81 -13.995  -2.509 -10.134
  593    HA   SER  81           HA       SER  81 -13.167  -4.394  -8.270
  594   1HB   SER  81          1HB       SER  81 -14.850  -5.832  -9.160
  595   2HB   SER  81          2HB       SER  81 -15.448  -4.184  -9.340
  596    HG   SER  81           HG       SER  81 -15.169  -4.292 -11.475
  597    H    ALA  82           H        ALA  82 -12.065  -3.961 -11.551
  598    HA   ALA  82           HA       ALA  82 -11.021  -6.615 -11.850
  599   1HB   ALA  82          1HB       ALA  82 -11.639  -4.821 -13.661
  600   2HB   ALA  82          2HB       ALA  82 -10.342  -5.982 -13.943
  601   3HB   ALA  82          3HB       ALA  82  -9.958  -4.336 -13.442
  602    H    LEU  83           H        LEU  83 -10.040  -3.920 -10.122
  603    HA   LEU  83           HA       LEU  83  -7.207  -4.690 -10.158
  604   1HB   LEU  83          1HB       LEU  83  -6.661  -2.569  -9.519
  605   2HB   LEU  83          2HB       LEU  83  -8.160  -2.238 -10.363
  606    HG   LEU  83           HG       LEU  83  -9.077  -2.635  -7.831
  607   1HD1  LEU  83          1HD1      LEU  83  -6.717  -2.843  -7.040
  608   2HD1  LEU  83          2HD1      LEU  83  -6.469  -1.165  -7.521
  609   3HD1  LEU  83          3HD1      LEU  83  -7.641  -1.557  -6.263
  610   1HD2  LEU  83          1HD2      LEU  83  -8.595  -0.418  -9.617
  611   2HD2  LEU  83          2HD2      LEU  83  -9.940  -0.702  -8.512
  612   3HD2  LEU  83          3HD2      LEU  83  -8.469   0.077  -7.929
  613    H    LEU  84           H        LEU  84 -10.006  -5.235  -8.447
  614    HA   LEU  84           HA       LEU  84  -8.537  -5.815  -5.964
  615   1HB   LEU  84          1HB       LEU  84 -11.514  -5.591  -6.106
  616   2HB   LEU  84          2HB       LEU  84 -10.444  -5.307  -4.744
  617    HG   LEU  84           HG       LEU  84 -10.217  -3.509  -7.099
  618   1HD1  LEU  84          1HD1      LEU  84 -12.567  -3.682  -5.296
  619   2HD1  LEU  84          2HD1      LEU  84 -11.971  -2.083  -5.740
  620   3HD1  LEU  84          3HD1      LEU  84 -12.472  -3.217  -6.995
  621   1HD2  LEU  84          1HD2      LEU  84  -9.991  -3.107  -4.119
  622   2HD2  LEU  84          2HD2      LEU  84  -8.657  -3.279  -5.259
  623   3HD2  LEU  84          3HD2      LEU  84  -9.711  -1.868  -5.343
  624    H    SER  85           H        SER  85  -8.409  -7.596  -8.080
  625    HA   SER  85           HA       SER  85  -9.993  -9.839  -7.033
  626   1HB   SER  85          1HB       SER  85  -9.426  -9.075  -9.876
  627   2HB   SER  85          2HB       SER  85  -9.642 -10.777  -9.467
  628    HG   SER  85           HG       SER  85 -11.482  -8.654  -9.111
  629    H    SER  86           H        SER  86  -7.551  -9.018  -6.123
  630    HA   SER  86           HA       SER  86  -5.603  -9.925  -5.343
  631   1HB   SER  86          1HB       SER  86  -6.128 -12.348  -7.079
  632   2HB   SER  86          2HB       SER  86  -5.126 -12.251  -5.631
  633    HG   SER  86           HG       SER  86  -7.105 -13.189  -5.119
  634    H    ASP  87           H        ASP  87  -6.141  -8.487  -7.846
  635    HA   ASP  87           HA       ASP  87  -3.620  -9.029  -9.259
  636   1HB   ASP  87          1HB       ASP  87  -5.798  -9.654 -10.403
  637   2HB   ASP  87          2HB       ASP  87  -6.157  -7.934 -10.449
  638    H    ILE  88           H        ILE  88  -2.227  -7.354  -9.039
  639    HA   ILE  88           HA       ILE  88  -3.280  -4.742  -8.297
  640    HB   ILE  88           HB       ILE  88  -0.662  -4.267  -8.358
  641   1HG1  ILE  88          1HG1      ILE  88  -0.499  -7.056  -7.357
  642   2HG1  ILE  88          2HG1      ILE  88  -0.553  -6.852  -9.106
  643   1HG2  ILE  88          1HG2      ILE  88  -2.201  -5.672  -6.191
  644   2HG2  ILE  88          2HG2      ILE  88  -0.617  -4.935  -5.951
  645   3HG2  ILE  88          3HG2      ILE  88  -1.992  -3.936  -6.417
  646   1HD1  ILE  88          1HD1      ILE  88   1.340  -5.096  -7.711
  647   2HD1  ILE  88          2HD1      ILE  88   1.705  -6.819  -7.626
  648   3HD1  ILE  88          3HD1      ILE  88   1.531  -6.030  -9.194
  649    H    THR  89           H        THR  89  -2.540  -6.361 -11.119
  650    HA   THR  89           HA       THR  89  -1.116  -4.690 -12.723
  651    HB   THR  89           HB       THR  89  -3.679  -5.907 -13.724
  652    HG1  THR  89           HG1      THR  89  -1.473  -7.527 -13.844
  653   1HG2  THR  89          1HG2      THR  89  -1.752  -4.529 -15.034
  654   2HG2  THR  89          2HG2      THR  89  -1.131  -6.172 -15.183
  655   3HG2  THR  89          3HG2      THR  89  -2.745  -5.782 -15.779
  656    H    ALA  90           H        ALA  90  -4.650  -4.470 -12.244
  657    HA   ALA  90           HA       ALA  90  -4.981  -2.160 -13.742
  658   1HB   ALA  90          1HB       ALA  90  -6.624  -3.728 -11.887
  659   2HB   ALA  90          2HB       ALA  90  -7.096  -2.041 -12.089
  660   3HB   ALA  90          3HB       ALA  90  -7.001  -3.104 -13.493
  661    H    SER  91           H        SER  91  -4.494  -2.616 -10.258
  662    HA   SER  91           HA       SER  91  -4.816   0.087  -9.512
  663   1HB   SER  91          1HB       SER  91  -2.906  -1.262  -7.827
  664   2HB   SER  91          2HB       SER  91  -4.558  -0.770  -7.455
  665    HG   SER  91           HG       SER  91  -3.914  -3.117  -8.908
  666    H    VAL  92           H        VAL  92  -2.077  -1.738 -10.655
  667    HA   VAL  92           HA       VAL  92  -0.207   0.342 -10.101
  668    HB   VAL  92           HB       VAL  92   0.067  -2.085 -11.867
  669   1HG1  VAL  92          1HG1      VAL  92   1.951   0.201 -11.356
  670   2HG1  VAL  92          2HG1      VAL  92   2.559  -1.402 -11.767
  671   3HG1  VAL  92          3HG1      VAL  92   1.505  -0.543 -12.890
  672   1HG2  VAL  92          1HG2      VAL  92   0.641  -1.450  -9.053
  673   2HG2  VAL  92          2HG2      VAL  92   0.322  -3.004  -9.823
  674   3HG2  VAL  92          3HG2      VAL  92   1.933  -2.293  -9.907
  675    H    ASN  93           H        ASN  93  -1.670  -0.858 -13.129
  676    HA   ASN  93           HA       ASN  93  -0.574   0.781 -14.920
  677   1HB   ASN  93          1HB       ASN  93  -2.075  -0.233 -16.183
  678   2HB   ASN  93          2HB       ASN  93  -2.913  -0.749 -14.743
  679   2HD2  ASN  93          2HD2      ASN  93  -2.733   1.682 -17.224
  680   1HD2  ASN  93          1HD2      ASN  93  -4.310   2.341 -16.974
  681    H    CYS  94           H        CYS  94  -3.142   1.548 -12.683
  682    HA   CYS  94           HA       CYS  94  -3.625   4.178 -13.574
  683   1HB   CYS  94          1HB       CYS  94  -5.003   2.675 -11.955
  684   2HB   CYS  94          2HB       CYS  94  -3.968   3.367 -10.708
  685    H    ALA  95           H        ALA  95  -1.567   2.910 -10.943
  686    HA   ALA  95           HA       ALA  95  -0.606   5.486 -10.203
  687   1HB   ALA  95          1HB       ALA  95   0.040   4.351  -8.449
  688   2HB   ALA  95          2HB       ALA  95   1.312   3.617  -9.423
  689   3HB   ALA  95          3HB       ALA  95  -0.256   2.822  -9.278
  690    H    LYS  96           H        LYS  96   0.658   2.959 -12.345
  691    HA   LYS  96           HA       LYS  96   3.163   3.938 -12.881
  692   1HB   LYS  96          1HB       LYS  96   1.599   1.975 -13.970
  693   2HB   LYS  96          2HB       LYS  96   1.634   3.145 -15.281
  694   1HG   LYS  96          1HG       LYS  96   3.934   2.962 -15.551
  695   2HG   LYS  96          2HG       LYS  96   4.162   2.260 -13.949
  696   1HD   LYS  96          1HD       LYS  96   4.321   0.341 -15.141
  697   2HD   LYS  96          2HD       LYS  96   2.560   0.398 -15.025
  698   1HE   LYS  96          1HE       LYS  96   2.667   0.169 -17.265
  699   2HE   LYS  96          2HE       LYS  96   2.945   1.910 -17.223
  700   1HZ   LYS  96          1HZ       LYS  96   5.385   0.536 -16.863
  701   2HZ   LYS  96          2HZ       LYS  96   4.618  -0.041 -18.256
  702   3HZ   LYS  96          3HZ       LYS  96   4.944   1.612 -18.093
  703    H    LYS  97           H        LYS  97   0.025   4.896 -13.847
  704    HA   LYS  97           HA       LYS  97   0.850   7.061 -15.591
  705   1HB   LYS  97          1HB       LYS  97  -1.370   5.609 -15.638
  706   2HB   LYS  97          2HB       LYS  97  -1.939   6.858 -14.539
  707   1HG   LYS  97          1HG       LYS  97  -0.795   8.313 -16.561
  708   2HG   LYS  97          2HG       LYS  97  -1.513   6.947 -17.416
  709   1HD   LYS  97          1HD       LYS  97  -3.420   7.752 -15.527
  710   2HD   LYS  97          2HD       LYS  97  -2.791   9.240 -16.238
  711   1HE   LYS  97          1HE       LYS  97  -3.105   7.858 -18.478
  712   2HE   LYS  97          2HE       LYS  97  -4.306   7.017 -17.498
  713   1HZ   LYS  97          1HZ       LYS  97  -4.499   9.856 -17.241
  714   2HZ   LYS  97          2HZ       LYS  97  -4.679   9.360 -18.847
  715   3HZ   LYS  97          3HZ       LYS  97  -5.693   8.728 -17.651
  716    H    ILE  98           H        ILE  98  -0.220   6.611 -12.283
  717    HA   ILE  98           HA       ILE  98  -0.704   9.283 -11.628
  718    HB   ILE  98           HB       ILE  98   0.207   7.024  -9.868
  719   1HG1  ILE  98          1HG1      ILE  98  -2.505   8.344 -10.152
  720   2HG1  ILE  98          2HG1      ILE  98  -2.048   6.850 -10.961
  721   1HG2  ILE  98          1HG2      ILE  98  -0.672   9.814  -9.146
  722   2HG2  ILE  98          2HG2      ILE  98  -0.602   8.479  -7.997
  723   3HG2  ILE  98          3HG2      ILE  98   0.872   9.045  -8.781
  724   1HD1  ILE  98          1HD1      ILE  98  -1.490   6.566  -8.193
  725   2HD1  ILE  98          2HD1      ILE  98  -3.126   7.198  -8.376
  726   3HD1  ILE  98          3HD1      ILE  98  -2.666   5.698  -9.182
  727    H    VAL  99           H        VAL  99   2.192   7.318 -11.216
  728    HA   VAL  99           HA       VAL  99   3.818   9.468 -10.310
  729    HB   VAL  99           HB       VAL  99   4.168   6.951  -9.917
  730   1HG1  VAL  99          1HG1      VAL  99   4.330   6.745 -12.575
  731   2HG1  VAL  99          2HG1      VAL  99   6.038   6.990 -12.208
  732   3HG1  VAL  99          3HG1      VAL  99   5.164   5.644 -11.479
  733   1HG2  VAL  99          1HG2      VAL  99   6.334   8.939 -10.507
  734   2HG2  VAL  99          2HG2      VAL  99   5.694   8.428  -8.945
  735   3HG2  VAL  99          3HG2      VAL  99   6.702   7.329  -9.887
  736    H    SER 100           H        SER 100   2.927   8.282 -13.445
  737    HA   SER 100           HA       SER 100   5.130   9.657 -14.765
  738   1HB   SER 100          1HB       SER 100   3.015   7.749 -15.581
  739   2HB   SER 100          2HB       SER 100   3.493   8.931 -16.799
  740    HG   SER 100           HG       SER 100   5.643   8.230 -16.538
  741    H    ASP 101           H        ASP 101   2.214  10.488 -13.450
  742    HA   ASP 101           HA       ASP 101   1.447  12.464 -15.434
  743   1HB   ASP 101          1HB       ASP 101  -0.174  11.103 -13.984
  744   2HB   ASP 101          2HB       ASP 101   0.278  12.185 -12.670
  745    H    GLY 102           H        GLY 102   3.657  12.309 -12.934
  746   1HA   GLY 102          1HA       GLY 102   3.486  15.212 -12.433
  747   2HA   GLY 102          2HA       GLY 102   4.998  14.485 -12.949
  748    H    ASN 103           H        ASN 103   3.256  12.412 -10.935
  749    HA   ASN 103           HA       ASN 103   4.012  13.458  -8.403
  750   1HB   ASN 103          1HB       ASN 103   2.953  10.830  -9.374
  751   2HB   ASN 103          2HB       ASN 103   3.572  10.962  -7.728
  752   2HD2  ASN 103          2HD2      ASN 103   0.853  11.083  -9.497
  753   1HD2  ASN 103          1HD2      ASN 103  -0.117  12.107  -8.500
  754    H    GLY 104           H        GLY 104   5.082  10.806  -7.382
  755   1HA   GLY 104          1HA       GLY 104   7.852  11.459  -7.814
  756   2HA   GLY 104          2HA       GLY 104   7.366   9.916  -8.500
  757    H    MET 105           H        MET 105   5.501   9.153  -6.537
  758    HA   MET 105           HA       MET 105   5.526   7.769  -4.720
  759   1HB   MET 105          1HB       MET 105   8.336   8.729  -4.146
  760   2HB   MET 105          2HB       MET 105   7.531   7.330  -3.450
  761   1HG   MET 105          1HG       MET 105   8.648   7.695  -6.193
  762   2HG   MET 105          2HG       MET 105   8.937   6.404  -5.030
  763   1HE   MET 105          1HE       MET 105   6.977   5.175  -4.046
  764   2HE   MET 105          2HE       MET 105   5.348   5.655  -4.521
  765   3HE   MET 105          3HE       MET 105   6.039   4.153  -5.136
  766    H    ASN 106           H        ASN 106   5.524  10.920  -4.991
  767    HA   ASN 106           HA       ASN 106   5.528  11.621  -2.168
  768   1HB   ASN 106          1HB       ASN 106   5.677  13.063  -4.753
  769   2HB   ASN 106          2HB       ASN 106   4.888  13.900  -3.430
  770   2HD2  ASN 106          2HD2      ASN 106   6.320  15.362  -2.772
  771   1HD2  ASN 106          1HD2      ASN 106   7.959  15.033  -2.335
  772    H    ALA 107           H        ALA 107   3.347  11.083  -4.832
  773    HA   ALA 107           HA       ALA 107   1.063  12.409  -3.965
  774   1HB   ALA 107          1HB       ALA 107   1.706  10.542  -5.972
  775   2HB   ALA 107          2HB       ALA 107   0.231  11.495  -5.811
  776   3HB   ALA 107          3HB       ALA 107   0.323   9.886  -5.095
  777    H    TRP 108           H        TRP 108   2.250   9.186  -3.151
  778    HA   TRP 108           HA       TRP 108   0.041   8.642  -1.389
  779   1HB   TRP 108          1HB       TRP 108   2.635   7.126  -1.749
  780   2HB   TRP 108          2HB       TRP 108   1.171   6.529  -0.969
  781    HD1  TRP 108           HD1      TRP 108  -0.917   5.928  -2.565
  782    HE1  TRP 108           HE1      TRP 108  -1.044   5.359  -5.071
  783    HE3  TRP 108           HE3      TRP 108   3.683   7.622  -4.019
  784    HZ2  TRP 108           HZ2      TRP 108   0.585   5.599  -7.369
  785    HZ3  TRP 108           HZ3      TRP 108   4.321   7.416  -6.387
  786    HH2  TRP 108           HH2      TRP 108   2.805   6.425  -8.023
  787    H    VAL 109           H        VAL 109  -0.113   9.184   0.658
  788    HA   VAL 109           HA       VAL 109   1.877  10.730   1.960
  789    HB   VAL 109           HB       VAL 109  -0.197   9.649   3.637
  790   1HG1  VAL 109          1HG1      VAL 109   1.383  11.632   4.021
  791   2HG1  VAL 109          2HG1      VAL 109   0.276  12.522   2.977
  792   3HG1  VAL 109          3HG1      VAL 109  -0.309  11.814   4.482
  793   1HG2  VAL 109          1HG2      VAL 109  -1.436   9.651   1.547
  794   2HG2  VAL 109          2HG2      VAL 109  -2.019  10.933   2.609
  795   3HG2  VAL 109          3HG2      VAL 109  -0.957  11.322   1.256
  796    H    ALA 110           H        ALA 110   1.131   7.340   2.044
  797    HA   ALA 110           HA       ALA 110   2.264   6.796   4.588
  798   1HB   ALA 110          1HB       ALA 110   2.402   4.674   2.547
  799   2HB   ALA 110          2HB       ALA 110   1.736   4.639   4.180
  800   3HB   ALA 110          3HB       ALA 110   0.798   5.337   2.859
  801    H    TRP 111           H        TRP 111   3.588   7.422   1.496
  802    HA   TRP 111           HA       TRP 111   6.167   6.263   2.154
  803   1HB   TRP 111          1HB       TRP 111   5.397   6.120  -0.164
  804   2HB   TRP 111          2HB       TRP 111   5.318   7.870  -0.265
  805    HD1  TRP 111           HD1      TRP 111   7.707   4.976  -0.565
  806    HE1  TRP 111           HE1      TRP 111  10.031   5.844  -1.251
  807    HE3  TRP 111           HE3      TRP 111   6.927   9.994   0.053
  808    HZ2  TRP 111           HZ2      TRP 111  11.358   8.320  -1.501
  809    HZ3  TRP 111           HZ3      TRP 111   8.776  11.542  -0.431
  810    HH2  TRP 111           HH2      TRP 111  10.946  10.721  -1.191
  811    H    ARG 112           H        ARG 112   4.636   9.458   1.972
  812    HA   ARG 112           HA       ARG 112   7.144  10.749   2.706
  813   1HB   ARG 112          1HB       ARG 112   4.594  11.562   1.527
  814   2HB   ARG 112          2HB       ARG 112   5.211  12.683   2.732
  815   1HG   ARG 112          1HG       ARG 112   7.437  12.183   1.231
  816   2HG   ARG 112          2HG       ARG 112   6.151  12.133   0.024
  817   1HD   ARG 112          1HD       ARG 112   5.517  14.331   0.424
  818   2HD   ARG 112          2HD       ARG 112   6.270  14.361   2.017
  819    HE   ARG 112           HE       ARG 112   8.328  14.006   0.224
  820   1HH1  ARG 112          1HH1      ARG 112   5.855  16.395   0.788
  821   2HH1  ARG 112          2HH1      ARG 112   6.804  17.709   0.180
  822   1HH2  ARG 112          1HH2      ARG 112   9.586  15.731  -0.577
  823   2HH2  ARG 112          2HH2      ARG 112   8.925  17.332  -0.596
  824    H    ASN 113           H        ASN 113   6.274   9.025   4.642
  825    HA   ASN 113           HA       ASN 113   5.828  10.853   6.843
  826   1HB   ASN 113          1HB       ASN 113   3.545  10.021   5.932
  827   2HB   ASN 113          2HB       ASN 113   3.977   8.491   6.690
  828   2HD2  ASN 113          2HD2      ASN 113   3.360   8.229   8.705
  829   1HD2  ASN 113          1HD2      ASN 113   2.966   9.486   9.822
  830    H    ARG 114           H        ARG 114   5.602   7.358   6.257
  831    HA   ARG 114           HA       ARG 114   7.449   6.923   8.491
  832   1HB   ARG 114          1HB       ARG 114   5.265   5.357   7.236
  833   2HB   ARG 114          2HB       ARG 114   6.617   4.455   7.894
  834   1HG   ARG 114          1HG       ARG 114   5.254   6.543   9.540
  835   2HG   ARG 114          2HG       ARG 114   4.562   4.928   9.383
  836   1HD   ARG 114          1HD       ARG 114   7.231   4.452   9.926
  837   2HD   ARG 114          2HD       ARG 114   6.837   5.838  10.944
  838    HE   ARG 114           HE       ARG 114   4.958   3.639  11.057
  839   1HH1  ARG 114          1HH1      ARG 114   7.784   5.138  12.439
  840   2HH1  ARG 114          2HH1      ARG 114   7.605   4.359  13.976
  841   1HH2  ARG 114          1HH2      ARG 114   4.713   2.610  13.077
  842   2HH2  ARG 114          2HH2      ARG 114   5.859   2.922  14.338
  843    H    CYS 115           H        CYS 115   7.640   7.289   5.250
  844    HA   CYS 115           HA       CYS 115   9.782   5.284   4.992
  845   1HB   CYS 115          1HB       CYS 115   7.781   5.104   3.448
  846   2HB   CYS 115          2HB       CYS 115   8.333   6.601   2.704
  847    H    LYS 116           H        LYS 116   8.889   8.599   4.023
  848    HA   LYS 116           HA       LYS 116  11.291   9.326   2.852
  849   1HB   LYS 116          1HB       LYS 116   9.036  10.599   3.030
  850   2HB   LYS 116          2HB       LYS 116   9.710  11.265   4.511
  851   1HG   LYS 116          1HG       LYS 116  11.667  12.050   3.174
  852   2HG   LYS 116          2HG       LYS 116  10.803  11.541   1.723
  853   1HD   LYS 116          1HD       LYS 116   9.045  13.102   2.132
  854   2HD   LYS 116          2HD       LYS 116   9.676  13.479   3.737
  855   1HE   LYS 116          1HE       LYS 116  11.253  13.967   1.224
  856   2HE   LYS 116          2HE       LYS 116  10.144  15.165   1.890
  857   1HZ   LYS 116          1HZ       LYS 116  11.436  14.982   4.003
  858   2HZ   LYS 116          2HZ       LYS 116  12.576  14.051   3.170
  859   3HZ   LYS 116          3HZ       LYS 116  12.293  15.654   2.711
  860    H    GLY 117           H        GLY 117  13.118   8.648   3.919
  861   1HA   GLY 117          1HA       GLY 117  13.548   9.785   6.609
  862   2HA   GLY 117          2HA       GLY 117  14.768   9.915   5.352
  863    H    THR 118           H        THR 118  13.523   6.980   4.757
  864    HA   THR 118           HA       THR 118  15.312   5.646   6.678
  865    HB   THR 118           HB       THR 118  13.927   3.649   6.472
  866    HG1  THR 118           HG1      THR 118  13.145   3.974   4.347
  867   1HG2  THR 118          1HG2      THR 118  12.781   6.226   7.369
  868   2HG2  THR 118          2HG2      THR 118  11.659   4.873   7.222
  869   3HG2  THR 118          3HG2      THR 118  13.071   4.739   8.272
  870    H    ASP 119           H        ASP 119  14.892   3.110   5.134
  871    HA   ASP 119           HA       ASP 119  16.416   3.715   2.716
  872   1HB   ASP 119          1HB       ASP 119  17.751   2.922   4.802
  873   2HB   ASP 119          2HB       ASP 119  17.178   1.360   4.263
  874    H    VAL 120           H        VAL 120  15.021   3.126   1.175
  875    HA   VAL 120           HA       VAL 120  13.267   0.884   1.428
  876    HB   VAL 120           HB       VAL 120  12.635   1.372  -0.902
  877   1HG1  VAL 120          1HG1      VAL 120  11.633   2.607   1.006
  878   2HG1  VAL 120          2HG1      VAL 120  12.810   3.894   0.740
  879   3HG1  VAL 120          3HG1      VAL 120  11.623   3.513  -0.507
  880   1HG2  VAL 120          1HG2      VAL 120  15.192   2.568  -0.999
  881   2HG2  VAL 120          2HG2      VAL 120  14.012   2.414  -2.300
  882   3HG2  VAL 120          3HG2      VAL 120  14.010   3.847  -1.272
  883    H    GLN 121           H        GLN 121  16.396   1.512   0.015
  884    HA   GLN 121           HA       GLN 121  16.589  -0.698  -1.702
  885   1HB   GLN 121          1HB       GLN 121  18.348   1.311  -0.646
  886   2HB   GLN 121          2HB       GLN 121  19.135  -0.257  -0.528
  887   1HG   GLN 121          1HG       GLN 121  18.559  -0.595  -2.959
  888   2HG   GLN 121          2HG       GLN 121  18.092   1.105  -2.992
  889   2HE2  GLN 121          2HE2      GLN 121  19.648   2.667  -2.985
  890   1HE2  GLN 121          1HE2      GLN 121  21.337   2.333  -3.125
  891    H    ALA 122           H        ALA 122  16.647  -0.391   1.711
  892    HA   ALA 122           HA       ALA 122  17.766  -3.041   2.147
  893   1HB   ALA 122          1HB       ALA 122  17.073  -0.725   3.884
  894   2HB   ALA 122          2HB       ALA 122  17.107  -2.336   4.602
  895   3HB   ALA 122          3HB       ALA 122  18.549  -1.688   3.820
  896    H    TRP 123           H        TRP 123  14.717  -1.478   1.804
  897    HA   TRP 123           HA       TRP 123  13.100  -3.230   3.324
  898   1HB   TRP 123          1HB       TRP 123  12.632  -1.286   1.122
  899   2HB   TRP 123          2HB       TRP 123  11.377  -2.483   1.421
  900    HD1  TRP 123           HD1      TRP 123  11.633   0.864   2.109
  901    HE1  TRP 123           HE1      TRP 123  10.727   1.566   4.414
  902    HE3  TRP 123           HE3      TRP 123  11.624  -3.672   4.436
  903    HZ2  TRP 123           HZ2      TRP 123  10.106   0.325   6.861
  904    HZ3  TRP 123           HZ3      TRP 123  10.862  -3.837   6.749
  905    HH2  TRP 123           HH2      TRP 123  10.110  -1.855   7.950
  906    H    ILE 124           H        ILE 124  14.785  -3.672   0.391
  907    HA   ILE 124           HA       ILE 124  13.361  -6.213  -0.055
  908    HB   ILE 124           HB       ILE 124  14.023  -5.967  -2.482
  909   1HG1  ILE 124          1HG1      ILE 124  14.053  -3.025  -2.177
  910   2HG1  ILE 124          2HG1      ILE 124  15.508  -3.860  -1.639
  911   1HG2  ILE 124          1HG2      ILE 124  11.840  -4.829  -1.024
  912   2HG2  ILE 124          2HG2      ILE 124  12.188  -3.842  -2.443
  913   3HG2  ILE 124          3HG2      ILE 124  11.848  -5.562  -2.628
  914   1HD1  ILE 124          1HD1      ILE 124  14.680  -4.871  -4.188
  915   2HD1  ILE 124          2HD1      ILE 124  14.826  -3.114  -4.240
  916   3HD1  ILE 124          3HD1      ILE 124  16.196  -4.099  -3.724
  917    H    ARG 125           H        ARG 125  16.000  -5.121   1.232
  918    HA   ARG 125           HA       ARG 125  18.140  -6.308  -0.181
  919   1HB   ARG 125          1HB       ARG 125  17.804  -4.823   2.207
  920   2HB   ARG 125          2HB       ARG 125  18.655  -6.299   2.639
  921   1HG   ARG 125          1HG       ARG 125  19.851  -5.326   0.278
  922   2HG   ARG 125          2HG       ARG 125  19.658  -3.954   1.372
  923   1HD   ARG 125          1HD       ARG 125  20.553  -6.026   2.994
  924   2HD   ARG 125          2HD       ARG 125  21.492  -6.188   1.511
  925    HE   ARG 125           HE       ARG 125  21.568  -3.512   2.175
  926   1HH1  ARG 125          1HH1      ARG 125  22.534  -6.523   3.639
  927   2HH1  ARG 125          2HH1      ARG 125  23.850  -5.822   4.519
  928   1HH2  ARG 125          1HH2      ARG 125  23.299  -2.581   3.331
  929   2HH2  ARG 125          2HH2      ARG 125  24.285  -3.580   4.344
  930    H    GLY 126           H        GLY 126  17.657  -8.404  -0.781
  931   1HA   GLY 126          1HA       GLY 126  17.469 -10.334   1.451
  932   2HA   GLY 126          2HA       GLY 126  18.393 -10.636  -0.013
  933    H    CYS 127           H        CYS 127  15.638  -9.023  -0.885
  934    HA   CYS 127           HA       CYS 127  13.635 -10.936  -0.779
  935   1HB   CYS 127          1HB       CYS 127  14.144  -8.533  -2.338
  936   2HB   CYS 127          2HB       CYS 127  12.938  -9.622  -2.989
  937    H    ARG 128           H        ARG 128  13.393 -12.842  -1.740
  938    HA   ARG 128           HA       ARG 128  15.231 -13.646  -3.824
  939   1HB   ARG 128          1HB       ARG 128  13.970 -14.978  -1.765
  940   2HB   ARG 128          2HB       ARG 128  13.064 -15.505  -3.177
  941   1HG   ARG 128          1HG       ARG 128  14.649 -17.032  -3.460
  942   2HG   ARG 128          2HG       ARG 128  15.690 -15.709  -3.991
  943   1HD   ARG 128          1HD       ARG 128  16.753 -17.077  -2.252
  944   2HD   ARG 128          2HD       ARG 128  16.511 -15.411  -1.729
  945    HE   ARG 128           HE       ARG 128  14.760 -17.638  -0.908
  946   1HH1  ARG 128          1HH1      ARG 128  16.490 -14.688  -0.238
  947   2HH1  ARG 128          2HH1      ARG 128  15.958 -14.598   1.408
  948   1HH2  ARG 128          1HH2      ARG 128  14.053 -17.527   1.258
  949   2HH2  ARG 128          2HH2      ARG 128  14.573 -16.211   2.258
  950    H    LEU 129           H        LEU 129  14.687 -12.565  -5.681
  951    HA   LEU 129           HA       LEU 129  12.429 -13.595  -7.132
  952   1HB   LEU 129          1HB       LEU 129  11.340 -11.494  -7.577
  953   2HB   LEU 129          2HB       LEU 129  11.402 -11.759  -5.844
  954    HG   LEU 129           HG       LEU 129  13.689 -10.286  -6.332
  955   1HD1  LEU 129          1HD1      LEU 129  12.630  -9.956  -8.658
  956   2HD1  LEU 129          2HD1      LEU 129  11.500  -8.892  -7.822
  957   3HD1  LEU 129          3HD1      LEU 129  13.228  -8.542  -7.792
  958   1HD2  LEU 129          1HD2      LEU 129  10.939  -9.404  -5.467
  959   2HD2  LEU 129          2HD2      LEU 129  12.244  -9.986  -4.433
  960   3HD2  LEU 129          3HD2      LEU 129  12.407  -8.445  -5.275

  No H/Q in entry =         960
  Start of MODEL    4
    1    H1   LYS   1           H1       LYS   1  -7.247  -9.226   2.105
    2    H2   LYS   1           H2       LYS   1  -8.055 -10.710   2.027
    3    H3   LYS   1           H3       LYS   1  -7.004 -10.387   3.311
    4    HA   LYS   1           HA       LYS   1  -5.612 -11.638   2.075
    5   1HB   LYS   1          1HB       LYS   1  -7.660 -11.321   0.216
    6   2HB   LYS   1          2HB       LYS   1  -6.237 -10.703  -0.612
    7   1HG   LYS   1          1HG       LYS   1  -5.184 -12.949   0.325
    8   2HG   LYS   1          2HG       LYS   1  -6.874 -13.455   0.278
    9   1HD   LYS   1          1HD       LYS   1  -5.780 -12.065  -2.107
   10   2HD   LYS   1          2HD       LYS   1  -5.257 -13.725  -1.814
   11   1HE   LYS   1          1HE       LYS   1  -8.120 -12.794  -2.002
   12   2HE   LYS   1          2HE       LYS   1  -7.226 -13.615  -3.281
   13   1HZ   LYS   1          1HZ       LYS   1  -6.899 -15.292  -1.213
   14   2HZ   LYS   1          2HZ       LYS   1  -8.450 -14.696  -0.897
   15   3HZ   LYS   1          3HZ       LYS   1  -8.116 -15.444  -2.378
   16    H    VAL   2           H        VAL   2  -3.875 -10.481   2.791
   17    HA   VAL   2           HA       VAL   2  -3.129  -8.042   1.335
   18    HB   VAL   2           HB       VAL   2  -2.241  -9.134   4.005
   19   1HG1  VAL   2          1HG1      VAL   2  -0.547  -7.817   2.358
   20   2HG1  VAL   2          2HG1      VAL   2  -1.308  -6.465   3.194
   21   3HG1  VAL   2          3HG1      VAL   2  -0.485  -7.720   4.118
   22   1HG2  VAL   2          1HG2      VAL   2  -4.369  -7.497   3.281
   23   2HG2  VAL   2          2HG2      VAL   2  -3.727  -7.747   4.905
   24   3HG2  VAL   2          3HG2      VAL   2  -3.151  -6.397   3.927
   25    H    PHE   3           H        PHE   3  -1.100  -7.830   0.355
   26    HA   PHE   3           HA       PHE   3   0.128 -10.248  -0.561
   27   1HB   PHE   3          1HB       PHE   3   0.819  -7.325  -0.923
   28   2HB   PHE   3          2HB       PHE   3   1.755  -8.629  -1.637
   29    HD1  PHE   3           HD1      PHE   3  -0.310 -10.453  -2.590
   30    HD2  PHE   3           HD2      PHE   3  -0.169  -6.203  -2.651
   31    HE1  PHE   3           HE1      PHE   3  -1.780 -10.437  -4.558
   32    HE2  PHE   3           HE2      PHE   3  -1.636  -6.176  -4.616
   33    HZ   PHE   3           HZ       PHE   3  -2.447  -8.296  -5.579
   34    H    GLY   4           H        GLY   4   2.537 -10.485  -0.439
   35   1HA   GLY   4          1HA       GLY   4   4.168 -11.150   1.116
   36   2HA   GLY   4          2HA       GLY   4   3.381 -10.153   2.334
   37    H    ARG   5           H        ARG   5   6.213 -10.240   1.667
   38    HA   ARG   5           HA       ARG   5   6.564  -7.390   1.179
   39   1HB   ARG   5          1HB       ARG   5   8.609  -9.459   2.004
   40   2HB   ARG   5          2HB       ARG   5   8.845  -7.717   1.984
   41   1HG   ARG   5          1HG       ARG   5   6.542  -8.404   3.564
   42   2HG   ARG   5          2HG       ARG   5   7.968  -9.287   4.114
   43   1HD   ARG   5          1HD       ARG   5   8.827  -6.666   3.610
   44   2HD   ARG   5          2HD       ARG   5   7.290  -6.514   4.460
   45    HE   ARG   5           HE       ARG   5   9.649  -7.953   5.484
   46   1HH1  ARG   5          1HH1      ARG   5   6.652  -6.245   5.982
   47   2HH1  ARG   5          2HH1      ARG   5   6.797  -6.232   7.707
   48   1HH2  ARG   5          1HH2      ARG   5   9.848  -7.940   7.755
   49   2HH2  ARG   5          2HH2      ARG   5   8.614  -7.196   8.716
   50    H    CYS   6           H        CYS   6   8.128 -10.392   0.032
   51    HA   CYS   6           HA       CYS   6   9.144  -8.954  -2.256
   52   1HB   CYS   6          1HB       CYS   6   9.319 -11.924  -1.839
   53   2HB   CYS   6          2HB       CYS   6  10.354 -10.879  -2.805
   54    H    GLU   7           H        GLU   7   6.646 -11.362  -1.584
   55    HA   GLU   7           HA       GLU   7   5.977 -12.192  -4.113
   56   1HB   GLU   7          1HB       GLU   7   4.519 -11.822  -1.591
   57   2HB   GLU   7          2HB       GLU   7   3.492 -11.715  -3.014
   58   1HG   GLU   7          1HG       GLU   7   3.816 -13.901  -3.587
   59   2HG   GLU   7          2HG       GLU   7   5.398 -13.984  -2.815
   60    H    LEU   8           H        LEU   8   4.863  -9.278  -2.461
   61    HA   LEU   8           HA       LEU   8   3.483  -8.167  -4.654
   62   1HB   LEU   8          1HB       LEU   8   3.099  -7.499  -2.318
   63   2HB   LEU   8          2HB       LEU   8   4.708  -6.812  -2.247
   64    HG   LEU   8           HG       LEU   8   2.613  -5.282  -2.606
   65   1HD1  LEU   8          1HD1      LEU   8   5.267  -5.069  -3.981
   66   2HD1  LEU   8          2HD1      LEU   8   4.072  -3.775  -4.058
   67   3HD1  LEU   8          3HD1      LEU   8   4.720  -4.286  -2.498
   68   1HD2  LEU   8          1HD2      LEU   8   2.024  -6.721  -4.686
   69   2HD2  LEU   8          2HD2      LEU   8   1.837  -4.969  -4.757
   70   3HD2  LEU   8          3HD2      LEU   8   3.244  -5.735  -5.491
   71    H    ALA   9           H        ALA   9   6.824  -7.812  -3.465
   72    HA   ALA   9           HA       ALA   9   7.571  -5.728  -5.207
   73   1HB   ALA   9          1HB       ALA   9   8.825  -6.580  -3.174
   74   2HB   ALA   9          2HB       ALA   9   9.482  -7.821  -4.241
   75   3HB   ALA   9          3HB       ALA   9   9.784  -6.117  -4.580
   76    H    ALA  10           H        ALA  10   8.076  -9.251  -5.554
   77    HA   ALA  10           HA       ALA  10   9.338  -9.271  -7.996
   78   1HB   ALA  10          1HB       ALA  10   8.770 -11.528  -8.164
   79   2HB   ALA  10          2HB       ALA  10   7.226 -11.300  -7.340
   80   3HB   ALA  10          3HB       ALA  10   8.733 -11.231  -6.426
   81    H    ALA  11           H        ALA  11   5.920  -8.932  -7.217
   82    HA   ALA  11           HA       ALA  11   4.970  -9.073  -9.863
   83   1HB   ALA  11          1HB       ALA  11   3.792  -7.817  -7.407
   84   2HB   ALA  11          2HB       ALA  11   3.403  -9.393  -8.096
   85   3HB   ALA  11          3HB       ALA  11   2.942  -7.920  -8.949
   86    H    MET  12           H        MET  12   6.171  -6.549  -7.896
   87    HA   MET  12           HA       MET  12   5.480  -4.331  -9.505
   88   1HB   MET  12          1HB       MET  12   8.031  -4.425  -7.932
   89   2HB   MET  12          2HB       MET  12   6.989  -3.058  -8.230
   90   1HG   MET  12          1HG       MET  12   6.198  -5.392  -6.531
   91   2HG   MET  12          2HG       MET  12   6.934  -3.920  -5.903
   92   1HE   MET  12          1HE       MET  12   6.032  -1.911  -7.710
   93   2HE   MET  12          2HE       MET  12   4.317  -1.508  -7.779
   94   3HE   MET  12          3HE       MET  12   5.222  -1.254  -6.288
   95    H    LYS  13           H        LYS  13   8.471  -6.240  -9.336
   96    HA   LYS  13           HA       LYS  13   9.965  -4.945 -11.260
   97   1HB   LYS  13          1HB       LYS  13  10.576  -6.950  -9.737
   98   2HB   LYS  13          2HB       LYS  13   9.958  -7.945 -11.048
   99   1HG   LYS  13          1HG       LYS  13  11.592  -6.496 -12.499
  100   2HG   LYS  13          2HG       LYS  13  12.389  -6.237 -10.945
  101   1HD   LYS  13          1HD       LYS  13  13.079  -8.394 -10.788
  102   2HD   LYS  13          2HD       LYS  13  11.649  -9.024 -11.608
  103   1HE   LYS  13          1HE       LYS  13  12.522  -8.575 -13.727
  104   2HE   LYS  13          2HE       LYS  13  13.721  -7.448 -13.094
  105   1HZ   LYS  13          1HZ       LYS  13  14.186  -9.926 -11.909
  106   2HZ   LYS  13          2HZ       LYS  13  13.989 -10.204 -13.566
  107   3HZ   LYS  13          3HZ       LYS  13  15.160  -9.110 -13.025
  108    H    ARG  14           H        ARG  14   7.687  -7.632 -11.703
  109    HA   ARG  14           HA       ARG  14   7.943  -7.801 -14.498
  110   1HB   ARG  14          1HB       ARG  14   6.317  -8.991 -12.444
  111   2HB   ARG  14          2HB       ARG  14   5.304  -8.540 -13.808
  112   1HG   ARG  14          1HG       ARG  14   6.850  -9.785 -15.298
  113   2HG   ARG  14          2HG       ARG  14   7.727 -10.325 -13.865
  114   1HD   ARG  14          1HD       ARG  14   4.946 -10.812 -13.479
  115   2HD   ARG  14          2HD       ARG  14   5.420 -11.459 -15.048
  116    HE   ARG  14           HE       ARG  14   6.224 -12.420 -12.453
  117   1HH1  ARG  14          1HH1      ARG  14   6.976 -12.329 -15.854
  118   2HH1  ARG  14          2HH1      ARG  14   7.925 -13.777 -15.814
  119   1HH2  ARG  14          1HH2      ARG  14   7.472 -14.327 -12.390
  120   2HH2  ARG  14          2HH2      ARG  14   8.206 -14.913 -13.846
  121    H    HIS  15           H        HIS  15   5.889  -5.850 -12.391
  122    HA   HIS  15           HA       HIS  15   4.289  -4.828 -14.510
  123   1HB   HIS  15          1HB       HIS  15   4.594  -4.297 -11.595
  124   2HB   HIS  15          2HB       HIS  15   3.802  -3.072 -12.579
  125    HD1  HIS  15           HD1      HIS  15   2.400  -4.843 -10.353
  126    HD2  HIS  15           HD2      HIS  15   2.227  -5.476 -14.456
  127    HE1  HIS  15           HE1      HIS  15   0.297  -6.162 -10.741
  128    HE2  HIS  15           HE2      HIS  15   0.259  -6.611 -13.220
  129    H    GLY  16           H        GLY  16   7.506  -4.215 -13.804
  130   1HA   GLY  16          1HA       GLY  16   7.522  -1.990 -15.542
  131   2HA   GLY  16          2HA       GLY  16   8.898  -2.687 -14.716
  132    H    LEU  17           H        LEU  17   7.528  -2.144 -11.985
  133    HA   LEU  17           HA       LEU  17   7.536   0.759 -12.057
  134   1HB   LEU  17          1HB       LEU  17   7.335  -0.858  -9.548
  135   2HB   LEU  17          2HB       LEU  17   6.702   0.742  -9.871
  136    HG   LEU  17           HG       LEU  17   5.524  -1.905 -10.397
  137   1HD1  LEU  17          1HD1      LEU  17   4.877   0.118  -8.797
  138   2HD1  LEU  17          2HD1      LEU  17   3.973   0.617 -10.227
  139   3HD1  LEU  17          3HD1      LEU  17   3.664  -0.956  -9.492
  140   1HD2  LEU  17          1HD2      LEU  17   5.262   0.374 -12.353
  141   2HD2  LEU  17          2HD2      LEU  17   5.715  -1.298 -12.687
  142   3HD2  LEU  17          3HD2      LEU  17   4.064  -0.912 -12.206
  143    H    ASP  18           H        ASP  18   9.806  -1.487 -12.007
  144    HA   ASP  18           HA       ASP  18  11.553  -0.516  -9.970
  145   1HB   ASP  18          1HB       ASP  18  12.118  -2.674 -10.462
  146   2HB   ASP  18          2HB       ASP  18  11.746  -2.504 -12.167
  147    H    ASN  19           H        ASN  19  11.785   1.641 -10.212
  148    HA   ASN  19           HA       ASN  19  12.734   3.588 -10.862
  149   1HB   ASN  19          1HB       ASN  19  14.682   1.772 -11.272
  150   2HB   ASN  19          2HB       ASN  19  14.464   2.335 -12.926
  151   2HD2  ASN  19          2HD2      ASN  19  16.435   2.709 -10.512
  152   1HD2  ASN  19          1HD2      ASN  19  16.805   4.394 -10.606
  153    H    TYR  20           H        TYR  20  10.387   2.713 -12.120
  154    HA   TYR  20           HA       TYR  20  10.481   3.201 -14.925
  155   1HB   TYR  20          1HB       TYR  20   8.584   2.055 -13.719
  156   2HB   TYR  20          2HB       TYR  20   8.136   3.618 -13.048
  157    HD1  TYR  20           HD1      TYR  20   8.744   1.970 -16.345
  158    HD2  TYR  20           HD2      TYR  20   6.558   4.893 -14.160
  159    HE1  TYR  20           HE1      TYR  20   7.370   2.421 -18.334
  160    HE2  TYR  20           HE2      TYR  20   5.177   5.352 -16.141
  161    HH   TYR  20           HH       TYR  20   4.898   3.392 -18.682
  162    H    ARG  21           H        ARG  21   9.246   5.219 -15.824
  163    HA   ARG  21           HA       ARG  21  10.548   7.463 -15.735
  164   1HB   ARG  21          1HB       ARG  21   7.788   6.872 -16.180
  165   2HB   ARG  21          2HB       ARG  21   7.895   8.399 -15.315
  166   1HG   ARG  21          1HG       ARG  21   9.595   7.908 -17.723
  167   2HG   ARG  21          2HG       ARG  21   7.909   8.398 -17.897
  168   1HD   ARG  21          1HD       ARG  21  10.092   9.884 -16.441
  169   2HD   ARG  21          2HD       ARG  21   9.321  10.351 -17.956
  170    HE   ARG  21           HE       ARG  21   7.763  10.160 -15.470
  171   1HH1  ARG  21          1HH1      ARG  21   8.923  11.982 -18.203
  172   2HH1  ARG  21          2HH1      ARG  21   7.895  13.342 -17.897
  173   1HH2  ARG  21          1HH2      ARG  21   6.405  11.945 -15.059
  174   2HH2  ARG  21          2HH2      ARG  21   6.464  13.322 -16.109
  175    H    GLY  22           H        GLY  22   8.386   6.465 -13.161
  176   1HA   GLY  22          1HA       GLY  22   7.984   7.340 -11.063
  177   2HA   GLY  22          2HA       GLY  22   8.882   8.777 -11.525
  178    H    TYR  23           H        TYR  23   8.948   5.837  -9.790
  179    HA   TYR  23           HA       TYR  23  11.834   6.181  -9.322
  180   1HB   TYR  23          1HB       TYR  23   9.610   6.038  -7.333
  181   2HB   TYR  23          2HB       TYR  23  11.219   5.488  -6.884
  182    HD1  TYR  23           HD1      TYR  23   9.552   8.426  -8.481
  183    HD2  TYR  23           HD2      TYR  23  12.670   7.029  -5.948
  184    HE1  TYR  23           HE1      TYR  23  10.198  10.749  -8.010
  185    HE2  TYR  23           HE2      TYR  23  13.326   9.349  -5.469
  186    HH   TYR  23           HH       TYR  23  11.383  12.013  -6.263
  187    H    SER  24           H        SER  24  12.586   4.368  -7.706
  188    HA   SER  24           HA       SER  24  12.420   1.943  -9.211
  189   1HB   SER  24          1HB       SER  24  14.207   1.158  -7.828
  190   2HB   SER  24          2HB       SER  24  14.531   2.852  -8.197
  191    HG   SER  24           HG       SER  24  14.826   2.730  -6.051
  192    H    LEU  25           H        LEU  25  12.138  -0.142  -8.224
  193    HA   LEU  25           HA       LEU  25   9.674  -0.652  -7.241
  194   1HB   LEU  25          1HB       LEU  25  12.251  -2.148  -6.857
  195   2HB   LEU  25          2HB       LEU  25  10.733  -2.774  -6.246
  196    HG   LEU  25           HG       LEU  25  11.642  -2.456  -9.073
  197   1HD1  LEU  25          1HD1      LEU  25  11.326  -4.586  -7.287
  198   2HD1  LEU  25          2HD1      LEU  25  10.019  -4.740  -8.461
  199   3HD1  LEU  25          3HD1      LEU  25  11.694  -4.669  -9.010
  200   1HD2  LEU  25          1HD2      LEU  25   8.810  -2.419  -8.087
  201   2HD2  LEU  25          2HD2      LEU  25   9.584  -1.366  -9.270
  202   3HD2  LEU  25          3HD2      LEU  25   9.228  -3.043  -9.682
  203    H    GLY  26           H        GLY  26  12.591  -0.409  -5.177
  204   1HA   GLY  26          1HA       GLY  26  12.802   0.352  -3.015
  205   2HA   GLY  26          2HA       GLY  26  11.560  -0.849  -2.714
  206    H    ASN  27           H        ASN  27  11.175   2.146  -4.551
  207    HA   ASN  27           HA       ASN  27   9.997   3.618  -2.423
  208   1HB   ASN  27          1HB       ASN  27   9.601   4.110  -5.375
  209   2HB   ASN  27          2HB       ASN  27   9.477   5.281  -4.066
  210   2HD2  ASN  27          2HD2      ASN  27  11.413   5.865  -2.940
  211   1HD2  ASN  27          1HD2      ASN  27  12.940   5.778  -3.744
  212    H    TRP  28           H        TRP  28   8.749   1.542  -4.941
  213    HA   TRP  28           HA       TRP  28   5.993   2.147  -4.564
  214   1HB   TRP  28          1HB       TRP  28   7.339  -0.244  -5.810
  215   2HB   TRP  28          2HB       TRP  28   5.614   0.109  -5.902
  216    HD1  TRP  28           HD1      TRP  28   8.931   1.070  -7.395
  217    HE1  TRP  28           HE1      TRP  28   8.559   2.733  -9.313
  218    HE3  TRP  28           HE3      TRP  28   3.971   1.994  -6.677
  219    HZ2  TRP  28           HZ2      TRP  28   6.426   4.239 -10.401
  220    HZ3  TRP  28           HZ3      TRP  28   2.814   3.546  -8.188
  221    HH2  TRP  28           HH2      TRP  28   4.021   4.653 -10.021
  222    H    VAL  29           H        VAL  29   8.125  -0.442  -3.383
  223    HA   VAL  29           HA       VAL  29   6.113  -1.859  -2.015
  224    HB   VAL  29           HB       VAL  29   9.094  -1.780  -1.534
  225   1HG1  VAL  29          1HG1      VAL  29   6.942  -3.576  -0.467
  226   2HG1  VAL  29          2HG1      VAL  29   8.620  -4.106  -0.580
  227   3HG1  VAL  29          3HG1      VAL  29   8.201  -2.710   0.413
  228   1HG2  VAL  29          1HG2      VAL  29   7.723  -2.686  -3.752
  229   2HG2  VAL  29          2HG2      VAL  29   9.363  -3.134  -3.282
  230   3HG2  VAL  29          3HG2      VAL  29   8.001  -4.149  -2.808
  231    H    CYS  30           H        CYS  30   8.545   0.462  -0.913
  232    HA   CYS  30           HA       CYS  30   7.868   0.477   1.785
  233   1HB   CYS  30          1HB       CYS  30   9.887   1.515   0.640
  234   2HB   CYS  30          2HB       CYS  30   8.846   2.877   0.245
  235    H    ALA  31           H        ALA  31   6.710   2.574  -0.849
  236    HA   ALA  31           HA       ALA  31   5.018   4.173   0.726
  237   1HB   ALA  31          1HB       ALA  31   5.841   4.567  -1.663
  238   2HB   ALA  31          2HB       ALA  31   4.189   5.050  -1.275
  239   3HB   ALA  31          3HB       ALA  31   4.486   3.553  -2.159
  240    H    ALA  32           H        ALA  32   4.348   1.243  -1.165
  241    HA   ALA  32           HA       ALA  32   1.569   1.193  -0.608
  242   1HB   ALA  32          1HB       ALA  32   2.052  -0.058  -2.457
  243   2HB   ALA  32          2HB       ALA  32   1.965  -1.332  -1.241
  244   3HB   ALA  32          3HB       ALA  32   3.533  -0.717  -1.763
  245    H    LYS  33           H        LYS  33   4.314  -0.583   0.809
  246    HA   LYS  33           HA       LYS  33   3.062  -2.248   2.545
  247   1HB   LYS  33          1HB       LYS  33   5.487  -2.183   2.233
  248   2HB   LYS  33          2HB       LYS  33   5.564  -0.641   3.072
  249   1HG   LYS  33          1HG       LYS  33   4.230  -2.532   4.738
  250   2HG   LYS  33          2HG       LYS  33   5.745  -3.231   4.161
  251   1HD   LYS  33          1HD       LYS  33   6.759  -0.934   4.821
  252   2HD   LYS  33          2HD       LYS  33   5.300  -0.764   5.798
  253   1HE   LYS  33          1HE       LYS  33   6.614  -3.357   6.087
  254   2HE   LYS  33          2HE       LYS  33   7.619  -1.997   6.588
  255   1HZ   LYS  33          1HZ       LYS  33   4.829  -2.234   7.517
  256   2HZ   LYS  33          2HZ       LYS  33   6.073  -3.069   8.302
  257   3HZ   LYS  33          3HZ       LYS  33   6.110  -1.379   8.215
  258    H    PHE  34           H        PHE  34   4.133   1.050   3.370
  259    HA   PHE  34           HA       PHE  34   2.732   0.965   5.840
  260   1HB   PHE  34          1HB       PHE  34   4.405   2.894   4.457
  261   2HB   PHE  34          2HB       PHE  34   3.282   3.567   5.620
  262    HD1  PHE  34           HD1      PHE  34   3.294   2.393   7.960
  263    HD2  PHE  34           HD2      PHE  34   6.481   2.188   5.147
  264    HE1  PHE  34           HE1      PHE  34   4.851   1.812   9.774
  265    HE2  PHE  34           HE2      PHE  34   8.045   1.606   6.956
  266    HZ   PHE  34           HZ       PHE  34   7.231   1.417   9.272
  267    H    GLU  35           H        GLU  35   1.823   1.819   2.660
  268    HA   GLU  35           HA       GLU  35  -0.191   3.691   3.250
  269   1HB   GLU  35          1HB       GLU  35   0.916   2.422   0.983
  270   2HB   GLU  35          2HB       GLU  35  -0.813   2.115   0.936
  271   1HG   GLU  35          1HG       GLU  35  -1.289   4.467   1.014
  272   2HG   GLU  35          2HG       GLU  35   0.418   4.842   1.245
  273    H    SER  36           H        SER  36  -0.427   0.239   2.440
  274    HA   SER  36           HA       SER  36  -2.969   0.130   3.936
  275   1HB   SER  36          1HB       SER  36  -3.689  -1.535   2.107
  276   2HB   SER  36          2HB       SER  36  -3.653   0.171   1.668
  277    HG   SER  36           HG       SER  36  -1.364  -1.390   1.266
  278    H    ASN  37           H        ASN  37   0.019  -0.898   4.155
  279    HA   ASN  37           HA       ASN  37   1.069  -2.710   5.074
  280   1HB   ASN  37          1HB       ASN  37  -1.374  -2.466   6.425
  281   2HB   ASN  37          2HB       ASN  37  -1.257  -4.174   6.012
  282   2HD2  ASN  37          2HD2      ASN  37   0.079  -5.448   7.139
  283   1HD2  ASN  37          1HD2      ASN  37   1.136  -4.902   8.393
  284    H    PHE  38           H        PHE  38   0.033  -2.736   2.376
  285    HA   PHE  38           HA       PHE  38   0.071  -4.030   0.569
  286   1HB   PHE  38          1HB       PHE  38   0.890  -6.137   2.564
  287   2HB   PHE  38          2HB       PHE  38   0.756  -6.452   0.837
  288    HD1  PHE  38           HD1      PHE  38   1.867  -4.216  -0.477
  289    HD2  PHE  38           HD2      PHE  38   3.102  -5.995   3.182
  290    HE1  PHE  38           HE1      PHE  38   4.130  -3.330  -0.824
  291    HE2  PHE  38           HE2      PHE  38   5.372  -5.108   2.846
  292    HZ   PHE  38           HZ       PHE  38   5.893  -3.782   0.838
  293    H    ASN  39           H        ASN  39  -2.344  -3.649   2.283
  294    HA   ASN  39           HA       ASN  39  -3.893  -6.050   1.887
  295   1HB   ASN  39          1HB       ASN  39  -4.258  -4.419   3.781
  296   2HB   ASN  39          2HB       ASN  39  -4.920  -3.297   2.597
  297   2HD2  ASN  39          2HD2      ASN  39  -5.375  -6.732   2.314
  298   1HD2  ASN  39          1HD2      ASN  39  -7.059  -6.743   2.700
  299    H    THR  40           H        THR  40  -4.413  -6.607  -0.108
  300    HA   THR  40           HA       THR  40  -4.590  -4.797  -2.285
  301    HB   THR  40           HB       THR  40  -4.862  -6.647  -3.615
  302    HG1  THR  40           HG1      THR  40  -6.096  -8.503  -2.898
  303   1HG2  THR  40          1HG2      THR  40  -3.943  -7.889  -1.024
  304   2HG2  THR  40          2HG2      THR  40  -3.772  -8.621  -2.619
  305   3HG2  THR  40          3HG2      THR  40  -2.920  -7.124  -2.240
  306    H    GLN  41           H        GLN  41  -6.798  -6.214  -0.058
  307    HA   GLN  41           HA       GLN  41  -9.157  -5.239  -1.432
  308   1HB   GLN  41          1HB       GLN  41  -8.544  -7.064   0.817
  309   2HB   GLN  41          2HB       GLN  41 -10.072  -6.222   0.888
  310   1HG   GLN  41          1HG       GLN  41  -9.614  -7.351  -1.727
  311   2HG   GLN  41          2HG       GLN  41  -9.520  -8.574  -0.461
  312   2HE2  GLN  41          2HE2      GLN  41 -11.464  -9.086  -2.015
  313   1HE2  GLN  41          1HE2      GLN  41 -13.001  -8.572  -1.417
  314    H    ALA  42           H        ALA  42  -6.913  -3.702   0.217
  315    HA   ALA  42           HA       ALA  42  -8.192  -2.427   2.358
  316   1HB   ALA  42          1HB       ALA  42  -5.924  -2.145   2.419
  317   2HB   ALA  42          2HB       ALA  42  -6.427  -0.581   1.780
  318   3HB   ALA  42          3HB       ALA  42  -5.805  -1.820   0.690
  319    H    THR  43           H        THR  43  -9.894  -1.165   2.345
  320    HA   THR  43           HA       THR  43 -10.189   0.875   0.251
  321    HB   THR  43           HB       THR  43 -12.540   0.477   0.019
  322    HG1  THR  43           HG1      THR  43 -13.674  -0.669   1.427
  323   1HG2  THR  43          1HG2      THR  43 -10.830  -1.112  -1.121
  324   2HG2  THR  43          2HG2      THR  43 -11.476  -2.323  -0.013
  325   3HG2  THR  43          3HG2      THR  43 -12.545  -1.522  -1.165
  326    H    ASN  44           H        ASN  44 -10.297   2.837   1.269
  327    HA   ASN  44           HA       ASN  44 -11.657   2.972   3.864
  328   1HB   ASN  44          1HB       ASN  44  -9.047   2.815   3.969
  329   2HB   ASN  44          2HB       ASN  44  -9.113   4.506   3.479
  330   2HD2  ASN  44          2HD2      ASN  44  -8.556   2.808   6.044
  331   1HD2  ASN  44          1HD2      ASN  44  -9.348   3.730   7.272
  332    H    ARG  45           H        ARG  45 -13.193   4.434   3.760
  333    HA   ARG  45           HA       ARG  45 -13.222   6.447   1.698
  334   1HB   ARG  45          1HB       ARG  45 -15.237   5.146   2.631
  335   2HB   ARG  45          2HB       ARG  45 -15.168   6.262   3.987
  336   1HG   ARG  45          1HG       ARG  45 -15.429   8.143   2.418
  337   2HG   ARG  45          2HG       ARG  45 -15.583   6.985   1.095
  338   1HD   ARG  45          1HD       ARG  45 -17.377   6.274   3.210
  339   2HD   ARG  45          2HD       ARG  45 -17.609   7.970   2.787
  340    HE   ARG  45           HE       ARG  45 -18.133   5.658   1.109
  341   1HH1  ARG  45          1HH1      ARG  45 -17.814   9.120   1.336
  342   2HH1  ARG  45          2HH1      ARG  45 -18.701   9.427  -0.120
  343   1HH2  ARG  45          1HH2      ARG  45 -19.302   6.051  -0.808
  344   2HH2  ARG  45          2HH2      ARG  45 -19.547   7.682  -1.339
  345    H    ASN  46           H        ASN  46 -13.269   8.688   2.002
  346    HA   ASN  46           HA       ASN  46 -12.016   9.591   4.511
  347   1HB   ASN  46          1HB       ASN  46 -11.914  11.109   1.916
  348   2HB   ASN  46          2HB       ASN  46 -10.853  11.251   3.314
  349   2HD2  ASN  46          2HD2      ASN  46  -9.842   8.978   3.861
  350   1HD2  ASN  46          1HD2      ASN  46  -9.084   8.208   2.513
  351    H    THR  47           H        THR  47 -12.380  12.099   4.729
  352    HA   THR  47           HA       THR  47 -15.240  12.424   5.037
  353    HB   THR  47           HB       THR  47 -14.642  14.550   6.186
  354    HG1  THR  47           HG1      THR  47 -11.939  13.804   6.159
  355   1HG2  THR  47          1HG2      THR  47 -13.325  11.987   7.057
  356   2HG2  THR  47          2HG2      THR  47 -13.340  13.432   8.067
  357   3HG2  THR  47          3HG2      THR  47 -14.859  12.668   7.599
  358    H    ASP  48           H        ASP  48 -12.702  13.602   2.965
  359    HA   ASP  48           HA       ASP  48 -14.088  15.878   1.968
  360   1HB   ASP  48          1HB       ASP  48 -12.398  15.725   0.094
  361   2HB   ASP  48          2HB       ASP  48 -11.723  15.852   1.715
  362    H    GLY  49           H        GLY  49 -14.495  12.556   1.485
  363   1HA   GLY  49          1HA       GLY  49 -16.141  13.104  -0.907
  364   2HA   GLY  49          2HA       GLY  49 -16.555  11.918   0.320
  365    H    SER  50           H        SER  50 -13.259  12.197  -0.751
  366    HA   SER  50           HA       SER  50 -13.482  10.202  -2.800
  367   1HB   SER  50          1HB       SER  50 -10.841  10.260  -2.379
  368   2HB   SER  50          2HB       SER  50 -11.675  11.516  -3.292
  369    HG   SER  50           HG       SER  50 -10.846  11.580  -0.587
  370    H    THR  51           H        THR  51 -11.574   8.422  -2.551
  371    HA   THR  51           HA       THR  51 -11.485   7.182   0.045
  372    HB   THR  51           HB       THR  51 -12.984   5.755  -2.159
  373    HG1  THR  51           HG1      THR  51 -13.933   6.918   0.267
  374   1HG2  THR  51          1HG2      THR  51 -11.631   4.352  -0.568
  375   2HG2  THR  51          2HG2      THR  51 -12.659   4.959   0.729
  376   3HG2  THR  51          3HG2      THR  51 -13.361   4.010  -0.580
  377    H    ASP  52           H        ASP  52 -10.044   5.339   0.101
  378    HA   ASP  52           HA       ASP  52  -8.259   5.216  -2.235
  379   1HB   ASP  52          1HB       ASP  52  -7.441   4.161   0.431
  380   2HB   ASP  52          2HB       ASP  52  -6.467   4.936  -0.815
  381    H    TYR  53           H        TYR  53  -9.097   3.620  -3.448
  382    HA   TYR  53           HA       TYR  53  -9.747   1.100  -2.124
  383   1HB   TYR  53          1HB       TYR  53 -10.354   2.074  -4.915
  384   2HB   TYR  53          2HB       TYR  53 -10.744   0.467  -4.312
  385    HD1  TYR  53           HD1      TYR  53 -12.215   0.381  -2.162
  386    HD2  TYR  53           HD2      TYR  53 -11.925   3.769  -4.716
  387    HE1  TYR  53           HE1      TYR  53 -14.369   1.201  -1.307
  388    HE2  TYR  53           HE2      TYR  53 -14.078   4.602  -3.866
  389    HH   TYR  53           HH       TYR  53 -15.954   2.749  -1.489
  390    H    GLY  54           H        GLY  54  -7.516   0.605  -1.777
  391   1HA   GLY  54          1HA       GLY  54  -5.923   0.007  -4.150
  392   2HA   GLY  54          2HA       GLY  54  -6.521  -1.405  -3.309
  393    H    ILE  55           H        ILE  55  -4.163  -1.729  -3.465
  394    HA   ILE  55           HA       ILE  55  -2.972  -1.379  -0.880
  395    HB   ILE  55           HB       ILE  55  -2.602  -3.407  -2.338
  396   1HG1  ILE  55          1HG1      ILE  55  -0.123  -1.857  -1.541
  397   2HG1  ILE  55          2HG1      ILE  55  -1.071  -2.906  -0.491
  398   1HG2  ILE  55          1HG2      ILE  55  -1.977  -1.464  -4.255
  399   2HG2  ILE  55          2HG2      ILE  55  -0.463  -2.297  -3.909
  400   3HG2  ILE  55          3HG2      ILE  55  -1.875  -3.216  -4.430
  401   1HD1  ILE  55          1HD1      ILE  55  -0.414  -4.505  -2.658
  402   2HD1  ILE  55          2HD1      ILE  55   1.042  -3.565  -2.333
  403   3HD1  ILE  55          3HD1      ILE  55   0.315  -4.537  -1.053
  404    H    LEU  56           H        LEU  56  -3.058   0.303  -3.841
  405    HA   LEU  56           HA       LEU  56  -0.822   2.028  -3.031
  406   1HB   LEU  56          1HB       LEU  56  -1.397   0.814  -5.543
  407   2HB   LEU  56          2HB       LEU  56  -1.640   2.540  -5.728
  408    HG   LEU  56           HG       LEU  56   0.589   2.310  -6.337
  409   1HD1  LEU  56          1HD1      LEU  56   0.105   3.721  -4.109
  410   2HD1  LEU  56          2HD1      LEU  56   1.294   2.580  -3.480
  411   3HD1  LEU  56          3HD1      LEU  56   1.697   3.605  -4.858
  412   1HD2  LEU  56          1HD2      LEU  56   0.680   0.150  -4.254
  413   2HD2  LEU  56          2HD2      LEU  56   1.026   0.049  -5.981
  414   3HD2  LEU  56          3HD2      LEU  56   2.158   0.863  -4.901
  415    H    GLN  57           H        GLN  57  -4.001   1.771  -2.753
  416    HA   GLN  57           HA       GLN  57  -5.669   3.191  -2.245
  417   1HB   GLN  57          1HB       GLN  57  -3.453   5.227  -2.424
  418   2HB   GLN  57          2HB       GLN  57  -5.097   5.629  -1.944
  419   1HG   GLN  57          1HG       GLN  57  -4.844   3.890  -0.124
  420   2HG   GLN  57          2HG       GLN  57  -3.126   3.869  -0.522
  421   2HE2  GLN  57          2HE2      GLN  57  -5.183   6.701  -0.644
  422   1HE2  GLN  57          1HE2      GLN  57  -4.425   7.544   0.659
  423    H    ILE  58           H        ILE  58  -6.464   2.478  -4.469
  424    HA   ILE  58           HA       ILE  58  -6.151   4.426  -6.569
  425    HB   ILE  58           HB       ILE  58  -8.169   2.194  -6.542
  426   1HG1  ILE  58          1HG1      ILE  58  -6.150   1.071  -5.969
  427   2HG1  ILE  58          2HG1      ILE  58  -6.362   0.839  -7.701
  428   1HG2  ILE  58          1HG2      ILE  58  -8.032   4.062  -8.323
  429   2HG2  ILE  58          2HG2      ILE  58  -6.612   3.186  -8.895
  430   3HG2  ILE  58          3HG2      ILE  58  -8.183   2.386  -8.851
  431   1HD1  ILE  58          1HD1      ILE  58  -4.530   2.841  -6.397
  432   2HD1  ILE  58          2HD1      ILE  58  -4.049   1.319  -7.146
  433   3HD1  ILE  58          3HD1      ILE  58  -4.738   2.608  -8.133
  434    H    ASN  59           H        ASN  59  -7.076   6.352  -6.077
  435    HA   ASN  59           HA       ASN  59  -9.497   6.597  -4.630
  436   1HB   ASN  59          1HB       ASN  59  -7.751   8.352  -4.716
  437   2HB   ASN  59          2HB       ASN  59  -8.121   8.615  -6.418
  438   2HD2  ASN  59          2HD2      ASN  59  -8.319  10.806  -5.178
  439   1HD2  ASN  59          1HD2      ASN  59  -9.933  11.234  -4.733
  440    H    SER  60           H        SER  60 -11.174   5.501  -5.573
  441    HA   SER  60           HA       SER  60 -11.729   5.500  -8.341
  442   1HB   SER  60          1HB       SER  60 -13.610   4.253  -7.813
  443   2HB   SER  60          2HB       SER  60 -12.595   3.952  -6.404
  444    HG   SER  60           HG       SER  60 -13.766   5.849  -5.486
  445    H    ARG  61           H        ARG  61 -12.086   7.959  -6.046
  446    HA   ARG  61           HA       ARG  61 -14.282   9.237  -7.512
  447   1HB   ARG  61          1HB       ARG  61 -13.998   9.057  -4.875
  448   2HB   ARG  61          2HB       ARG  61 -13.014  10.493  -5.118
  449   1HG   ARG  61          1HG       ARG  61 -15.599  10.582  -6.481
  450   2HG   ARG  61          2HG       ARG  61 -15.709  10.472  -4.724
  451   1HD   ARG  61          1HD       ARG  61 -13.873  12.444  -6.037
  452   2HD   ARG  61          2HD       ARG  61 -15.585  12.805  -5.823
  453    HE   ARG  61           HE       ARG  61 -14.947  12.147  -3.350
  454   1HH1  ARG  61          1HH1      ARG  61 -13.173  14.092  -5.632
  455   2HH1  ARG  61          2HH1      ARG  61 -12.430  15.073  -4.413
  456   1HH2  ARG  61          1HH2      ARG  61 -13.975  13.435  -1.739
  457   2HH2  ARG  61          2HH2      ARG  61 -12.884  14.699  -2.201
  458    H    TRP  62           H        TRP  62 -11.424   8.899  -8.358
  459    HA   TRP  62           HA       TRP  62 -11.094  11.533  -9.460
  460   1HB   TRP  62          1HB       TRP  62  -9.725  10.904  -7.043
  461   2HB   TRP  62          2HB       TRP  62  -8.534  11.030  -8.333
  462    HD1  TRP  62           HD1      TRP  62 -11.117  13.120  -6.428
  463    HE1  TRP  62           HE1      TRP  62 -10.622  15.612  -6.840
  464    HE3  TRP  62           HE3      TRP  62  -7.478  12.647  -9.987
  465    HZ2  TRP  62           HZ2      TRP  62  -8.914  17.171  -8.459
  466    HZ3  TRP  62           HZ3      TRP  62  -6.464  14.688 -10.916
  467    HH2  TRP  62           HH2      TRP  62  -7.168  16.902 -10.166
  468    H    TRP  63           H        TRP  63 -10.393   8.185  -9.453
  469    HA   TRP  63           HA       TRP  63  -8.791   8.549 -11.888
  470   1HB   TRP  63          1HB       TRP  63  -8.335   6.568  -9.653
  471   2HB   TRP  63          2HB       TRP  63  -7.561   6.449 -11.230
  472    HD1  TRP  63           HD1      TRP  63  -6.533   7.421  -8.005
  473    HE1  TRP  63           HE1      TRP  63  -4.779   9.313  -8.033
  474    HE3  TRP  63           HE3      TRP  63  -7.236   9.076 -12.758
  475    HZ2  TRP  63           HZ2      TRP  63  -3.835  11.272  -9.862
  476    HZ3  TRP  63           HZ3      TRP  63  -5.925  10.956 -13.583
  477    HH2  TRP  63           HH2      TRP  63  -4.234  12.039 -12.168
  478    H    CYS  64           H        CYS  64 -10.051   5.712 -10.216
  479    HA   CYS  64           HA       CYS  64 -11.119   4.763 -12.756
  480   1HB   CYS  64          1HB       CYS  64 -11.145   2.607 -11.841
  481   2HB   CYS  64          2HB       CYS  64  -9.735   3.346 -11.092
  482    H    ASN  65           H        ASN  65 -13.187   3.821 -12.961
  483    HA   ASN  65           HA       ASN  65 -15.221   5.362 -11.527
  484   1HB   ASN  65          1HB       ASN  65 -15.010   5.019 -14.141
  485   2HB   ASN  65          2HB       ASN  65 -15.884   3.530 -13.795
  486   2HD2  ASN  65          2HD2      ASN  65 -17.933   3.720 -12.681
  487   1HD2  ASN  65          1HD2      ASN  65 -18.901   5.129 -12.928
  488    H    ASP  66           H        ASP  66 -15.788   4.411  -9.671
  489    HA   ASP  66           HA       ASP  66 -16.086   1.508  -9.557
  490   1HB   ASP  66          1HB       ASP  66 -16.123   1.723  -7.182
  491   2HB   ASP  66          2HB       ASP  66 -14.843   2.777  -7.774
  492    H    GLY  67           H        GLY  67 -17.985   4.386  -9.718
  493   1HA   GLY  67          1HA       GLY  67 -20.391   2.856 -10.039
  494   2HA   GLY  67          2HA       GLY  67 -20.253   4.605 -10.097
  495    H    ARG  68           H        ARG  68 -18.946   3.097  -7.307
  496    HA   ARG  68           HA       ARG  68 -21.405   3.291  -5.781
  497   1HB   ARG  68          1HB       ARG  68 -18.608   2.569  -4.887
  498   2HB   ARG  68          2HB       ARG  68 -20.067   2.415  -3.919
  499   1HG   ARG  68          1HG       ARG  68 -20.810   0.952  -6.022
  500   2HG   ARG  68          2HG       ARG  68 -19.063   0.725  -6.123
  501   1HD   ARG  68          1HD       ARG  68 -20.713   0.255  -3.644
  502   2HD   ARG  68          2HD       ARG  68 -20.225  -1.008  -4.773
  503    HE   ARG  68           HE       ARG  68 -17.952   0.411  -3.915
  504   1HH1  ARG  68          1HH1      ARG  68 -20.328  -1.848  -2.734
  505   2HH1  ARG  68          2HH1      ARG  68 -19.264  -2.551  -1.562
  506   1HH2  ARG  68          1HH2      ARG  68 -16.544  -0.511  -2.376
  507   2HH2  ARG  68          2HH2      ARG  68 -17.113  -1.791  -1.358
  508    H    THR  69           H        THR  69 -19.030   5.406  -6.733
  509    HA   THR  69           HA       THR  69 -19.605   7.189  -4.460
  510    HB   THR  69           HB       THR  69 -17.006   7.319  -5.970
  511    HG1  THR  69           HG1      THR  69 -16.346   5.604  -4.936
  512   1HG2  THR  69          1HG2      THR  69 -18.021   8.356  -3.333
  513   2HG2  THR  69          2HG2      THR  69 -16.302   8.300  -3.725
  514   3HG2  THR  69          3HG2      THR  69 -17.400   9.273  -4.705
  515    HA   PRO  70           HA       PRO  70 -21.161   9.411  -8.122
  516   1HB   PRO  70          1HB       PRO  70 -22.652  11.180  -6.677
  517   2HB   PRO  70          2HB       PRO  70 -23.216   9.564  -7.119
  518   1HG   PRO  70          1HG       PRO  70 -22.039  10.522  -4.538
  519   2HG   PRO  70          2HG       PRO  70 -23.424   9.447  -4.807
  520   1HD   PRO  70          1HD       PRO  70 -20.989   8.505  -4.131
  521   2HD   PRO  70          2HD       PRO  70 -22.082   7.609  -5.207
  522    H    GLY  71           H        GLY  71 -19.331  10.456  -8.821
  523   1HA   GLY  71          1HA       GLY  71 -18.429  12.786  -7.257
  524   2HA   GLY  71          2HA       GLY  71 -18.830  12.966  -8.959
  525    H    SER  72           H        SER  72 -17.702  10.257  -9.536
  526    HA   SER  72           HA       SER  72 -14.961  10.233  -8.843
  527   1HB   SER  72          1HB       SER  72 -14.796   8.587 -10.771
  528   2HB   SER  72          2HB       SER  72 -15.957   8.171  -9.512
  529    HG   SER  72           HG       SER  72 -17.496   9.361 -10.988
  530    H    ARG  73           H        ARG  73 -14.361   9.679 -11.883
  531    HA   ARG  73           HA       ARG  73 -14.430  12.196 -13.165
  532   1HB   ARG  73          1HB       ARG  73 -12.290  11.783 -11.290
  533   2HB   ARG  73          2HB       ARG  73 -11.629  11.840 -12.919
  534   1HG   ARG  73          1HG       ARG  73 -13.595  13.932 -12.294
  535   2HG   ARG  73          2HG       ARG  73 -12.085  14.009 -11.383
  536   1HD   ARG  73          1HD       ARG  73 -11.500  15.234 -13.221
  537   2HD   ARG  73          2HD       ARG  73 -11.027  13.624 -13.766
  538    HE   ARG  73           HE       ARG  73 -13.565  13.815 -14.642
  539   1HH1  ARG  73          1HH1      ARG  73 -10.815  15.938 -14.917
  540   2HH1  ARG  73          2HH1      ARG  73 -11.313  16.596 -16.439
  541   1HH2  ARG  73          1HH2      ARG  73 -14.228  14.676 -16.647
  542   2HH2  ARG  73          2HH2      ARG  73 -13.253  15.879 -17.422
  543    H    ASN  74           H        ASN  74 -12.679   9.167 -12.748
  544    HA   ASN  74           HA       ASN  74 -12.155   7.467 -14.172
  545   1HB   ASN  74          1HB       ASN  74 -14.540   8.201 -15.090
  546   2HB   ASN  74          2HB       ASN  74 -13.590   8.749 -16.468
  547   2HD2  ASN  74          2HD2      ASN  74 -14.259   7.263 -17.924
  548   1HD2  ASN  74          1HD2      ASN  74 -13.946   5.570 -17.789
  549    H    LEU  75           H        LEU  75 -10.582   9.892 -13.914
  550    HA   LEU  75           HA       LEU  75  -9.464  10.869 -16.257
  551   1HB   LEU  75          1HB       LEU  75  -8.703  10.473 -13.433
  552   2HB   LEU  75          2HB       LEU  75  -7.383  10.755 -14.543
  553    HG   LEU  75           HG       LEU  75  -9.772  12.555 -14.052
  554   1HD1  LEU  75          1HD1      LEU  75  -8.164  12.558 -12.217
  555   2HD1  LEU  75          2HD1      LEU  75  -6.862  12.927 -13.348
  556   3HD1  LEU  75          3HD1      LEU  75  -8.152  14.098 -13.077
  557   1HD2  LEU  75          1HD2      LEU  75  -7.516  12.720 -16.020
  558   2HD2  LEU  75          2HD2      LEU  75  -9.244  12.957 -16.281
  559   3HD2  LEU  75          3HD2      LEU  75  -8.305  14.179 -15.423
  560    H    CYS  76           H        CYS  76  -8.532   8.317 -14.167
  561    HA   CYS  76           HA       CYS  76  -6.420   7.259 -15.737
  562   1HB   CYS  76          1HB       CYS  76  -7.267   7.152 -13.166
  563   2HB   CYS  76          2HB       CYS  76  -7.764   5.572 -13.754
  564    H    ASN  77           H        ASN  77  -9.822   6.626 -15.296
  565    HA   ASN  77           HA       ASN  77 -11.338   5.294 -16.360
  566   1HB   ASN  77          1HB       ASN  77 -10.079   6.598 -18.312
  567   2HB   ASN  77          2HB       ASN  77  -9.543   4.971 -18.722
  568   2HD2  ASN  77          2HD2      ASN  77 -11.701   3.452 -18.148
  569   1HD2  ASN  77          1HD2      ASN  77 -13.033   3.895 -19.154
  570    H    ILE  78           H        ILE  78  -9.967   3.929 -14.583
  571    HA   ILE  78           HA       ILE  78  -9.193   1.448 -15.934
  572    HB   ILE  78           HB       ILE  78  -7.445   1.162 -14.572
  573   1HG1  ILE  78          1HG1      ILE  78  -9.419   1.835 -12.486
  574   2HG1  ILE  78          2HG1      ILE  78  -8.188   0.579 -12.505
  575   1HG2  ILE  78          1HG2      ILE  78  -7.379   3.546 -15.369
  576   2HG2  ILE  78          2HG2      ILE  78  -7.910   4.013 -13.754
  577   3HG2  ILE  78          3HG2      ILE  78  -6.371   3.177 -13.968
  578   1HD1  ILE  78          1HD1      ILE  78  -6.501   2.310 -11.949
  579   2HD1  ILE  78          2HD1      ILE  78  -7.814   3.476 -11.793
  580   3HD1  ILE  78          3HD1      ILE  78  -7.737   2.086 -10.711
  581    HA   PRO  79           HA       PRO  79 -12.454  -0.572 -13.704
  582   1HB   PRO  79          1HB       PRO  79 -11.621  -3.124 -13.733
  583   2HB   PRO  79          2HB       PRO  79 -12.096  -2.297 -15.221
  584   1HG   PRO  79          1HG       PRO  79  -9.364  -2.872 -14.162
  585   2HG   PRO  79          2HG       PRO  79  -9.958  -2.938 -15.831
  586   1HD   PRO  79          1HD       PRO  79  -8.520  -0.838 -14.744
  587   2HD   PRO  79          2HD       PRO  79  -9.568  -0.717 -16.171
  588    H    CYS  80           H        CYS  80 -12.664  -0.154 -11.562
  589    HA   CYS  80           HA       CYS  80 -10.566  -0.329  -9.703
  590   1HB   CYS  80          1HB       CYS  80 -13.450  -0.435  -8.889
  591   2HB   CYS  80          2HB       CYS  80 -12.107   0.391  -8.106
  592    H    SER  81           H        SER  81 -13.523  -2.348  -9.830
  593    HA   SER  81           HA       SER  81 -12.756  -4.206  -7.936
  594   1HB   SER  81          1HB       SER  81 -14.345  -5.769  -9.144
  595   2HB   SER  81          2HB       SER  81 -15.015  -4.200  -8.697
  596    HG   SER  81           HG       SER  81 -15.193  -3.686 -10.741
  597    H    ALA  82           H        ALA  82 -11.687  -3.943 -11.248
  598    HA   ALA  82           HA       ALA  82 -10.708  -6.612 -11.489
  599   1HB   ALA  82          1HB       ALA  82 -11.193  -4.696 -13.284
  600   2HB   ALA  82          2HB       ALA  82 -10.097  -6.042 -13.591
  601   3HB   ALA  82          3HB       ALA  82  -9.452  -4.475 -13.102
  602    H    LEU  83           H        LEU  83  -9.669  -4.046  -9.656
  603    HA   LEU  83           HA       LEU  83  -6.863  -4.925  -9.688
  604   1HB   LEU  83          1HB       LEU  83  -6.204  -2.833  -9.028
  605   2HB   LEU  83          2HB       LEU  83  -7.629  -2.434  -9.966
  606    HG   LEU  83           HG       LEU  83  -8.711  -2.710  -7.482
  607   1HD1  LEU  83          1HD1      LEU  83  -6.203  -2.932  -6.756
  608   2HD1  LEU  83          2HD1      LEU  83  -6.224  -1.174  -6.908
  609   3HD1  LEU  83          3HD1      LEU  83  -7.337  -1.977  -5.800
  610   1HD2  LEU  83          1HD2      LEU  83  -7.903  -0.526  -9.241
  611   2HD2  LEU  83          2HD2      LEU  83  -9.416  -0.784  -8.373
  612   3HD2  LEU  83          3HD2      LEU  83  -8.038  -0.055  -7.547
  613    H    LEU  84           H        LEU  84  -9.730  -5.187  -7.961
  614    HA   LEU  84           HA       LEU  84  -8.329  -5.785  -5.453
  615   1HB   LEU  84          1HB       LEU  84 -11.300  -5.588  -5.667
  616   2HB   LEU  84          2HB       LEU  84 -10.258  -5.232  -4.301
  617    HG   LEU  84           HG       LEU  84 -10.046  -3.524  -6.731
  618   1HD1  LEU  84          1HD1      LEU  84 -12.447  -3.671  -6.350
  619   2HD1  LEU  84          2HD1      LEU  84 -12.213  -3.247  -4.655
  620   3HD1  LEU  84          3HD1      LEU  84 -11.833  -2.075  -5.916
  621   1HD2  LEU  84          1HD2      LEU  84  -9.755  -3.067  -3.767
  622   2HD2  LEU  84          2HD2      LEU  84  -8.466  -3.152  -4.967
  623   3HD2  LEU  84          3HD2      LEU  84  -9.605  -1.806  -4.992
  624    H    SER  85           H        SER  85  -8.169  -7.606  -7.555
  625    HA   SER  85           HA       SER  85  -9.682  -9.850  -6.422
  626   1HB   SER  85          1HB       SER  85  -9.046 -10.388  -9.174
  627   2HB   SER  85          2HB       SER  85 -10.631 -10.340  -8.402
  628    HG   SER  85           HG       SER  85  -9.474  -8.538 -10.050
  629    H    SER  86           H        SER  86  -7.192  -8.930  -5.734
  630    HA   SER  86           HA       SER  86  -5.182  -9.786  -5.063
  631   1HB   SER  86          1HB       SER  86  -6.566 -12.071  -5.458
  632   2HB   SER  86          2HB       SER  86  -5.364 -12.239  -6.738
  633    HG   SER  86           HG       SER  86  -4.871 -11.854  -3.971
  634    H    ASP  87           H        ASP  87  -5.948  -8.401  -7.570
  635    HA   ASP  87           HA       ASP  87  -3.509  -8.892  -9.135
  636   1HB   ASP  87          1HB       ASP  87  -5.756  -9.526 -10.128
  637   2HB   ASP  87          2HB       ASP  87  -6.131  -7.809 -10.135
  638    H    ILE  88           H        ILE  88  -2.115  -7.238  -8.878
  639    HA   ILE  88           HA       ILE  88  -3.120  -4.613  -8.130
  640    HB   ILE  88           HB       ILE  88  -0.500  -4.158  -8.302
  641   1HG1  ILE  88          1HG1      ILE  88  -0.507  -7.034  -7.427
  642   2HG1  ILE  88          2HG1      ILE  88  -0.262  -6.608  -9.118
  643   1HG2  ILE  88          1HG2      ILE  88  -2.260  -5.165  -6.169
  644   2HG2  ILE  88          2HG2      ILE  88  -0.528  -5.233  -5.843
  645   3HG2  ILE  88          3HG2      ILE  88  -1.289  -3.695  -6.248
  646   1HD1  ILE  88          1HD1      ILE  88   1.421  -5.116  -7.251
  647   2HD1  ILE  88          2HD1      ILE  88   1.705  -6.857  -7.267
  648   3HD1  ILE  88          3HD1      ILE  88   1.834  -5.929  -8.761
  649    H    THR  89           H        THR  89  -2.554  -6.228 -10.975
  650    HA   THR  89           HA       THR  89  -1.164  -4.574 -12.638
  651    HB   THR  89           HB       THR  89  -3.773  -5.801 -13.510
  652    HG1  THR  89           HG1      THR  89  -1.423  -7.029 -12.623
  653   1HG2  THR  89          1HG2      THR  89  -1.688  -4.486 -14.858
  654   2HG2  THR  89          2HG2      THR  89  -1.507  -6.199 -15.236
  655   3HG2  THR  89          3HG2      THR  89  -3.033  -5.378 -15.570
  656    H    ALA  90           H        ALA  90  -4.690  -4.339 -12.074
  657    HA   ALA  90           HA       ALA  90  -5.059  -2.039 -13.564
  658   1HB   ALA  90          1HB       ALA  90  -6.638  -3.533 -11.577
  659   2HB   ALA  90          2HB       ALA  90  -7.119  -1.864 -11.882
  660   3HB   ALA  90          3HB       ALA  90  -7.057  -3.022 -13.211
  661    H    SER  91           H        SER  91  -4.485  -2.434 -10.083
  662    HA   SER  91           HA       SER  91  -4.752   0.293  -9.397
  663   1HB   SER  91          1HB       SER  91  -2.941  -0.803  -7.580
  664   2HB   SER  91          2HB       SER  91  -4.692  -0.717  -7.395
  665    HG   SER  91           HG       SER  91  -4.301  -2.833  -7.229
  666    H    VAL  92           H        VAL  92  -2.063  -1.602 -10.537
  667    HA   VAL  92           HA       VAL  92  -0.157   0.469 -10.034
  668    HB   VAL  92           HB       VAL  92   0.098  -2.002 -11.744
  669   1HG1  VAL  92          1HG1      VAL  92   1.956   0.301 -11.288
  670   2HG1  VAL  92          2HG1      VAL  92   2.619  -1.316 -11.519
  671   3HG1  VAL  92          3HG1      VAL  92   1.617  -0.586 -12.774
  672   1HG2  VAL  92          1HG2      VAL  92   0.146  -1.713  -9.002
  673   2HG2  VAL  92          2HG2      VAL  92   0.843  -3.053  -9.913
  674   3HG2  VAL  92          3HG2      VAL  92   1.854  -1.687  -9.441
  675    H    ASN  93           H        ASN  93  -1.673  -0.782 -13.017
  676    HA   ASN  93           HA       ASN  93  -0.550   0.787 -14.856
  677   1HB   ASN  93          1HB       ASN  93  -2.073  -0.234 -16.084
  678   2HB   ASN  93          2HB       ASN  93  -2.914  -0.696 -14.626
  679   2HD2  ASN  93          2HD2      ASN  93  -2.717   1.637 -17.192
  680   1HD2  ASN  93          1HD2      ASN  93  -4.275   2.341 -16.946
  681    H    CYS  94           H        CYS  94  -3.154   1.655 -12.681
  682    HA   CYS  94           HA       CYS  94  -3.571   4.267 -13.627
  683   1HB   CYS  94          1HB       CYS  94  -4.971   2.826 -11.960
  684   2HB   CYS  94          2HB       CYS  94  -3.939   3.564 -10.737
  685    H    ALA  95           H        ALA  95  -1.529   3.036 -10.964
  686    HA   ALA  95           HA       ALA  95  -0.544   5.629 -10.308
  687   1HB   ALA  95          1HB       ALA  95  -0.339   4.217  -8.540
  688   2HB   ALA  95          2HB       ALA  95   0.239   2.877  -9.531
  689   3HB   ALA  95          3HB       ALA  95   1.307   4.233  -9.170
  690    H    LYS  96           H        LYS  96   0.647   3.046 -12.411
  691    HA   LYS  96           HA       LYS  96   3.190   3.936 -12.951
  692   1HB   LYS  96          1HB       LYS  96   1.585   1.999 -14.008
  693   2HB   LYS  96          2HB       LYS  96   1.617   3.153 -15.333
  694   1HG   LYS  96          1HG       LYS  96   4.215   3.078 -14.869
  695   2HG   LYS  96          2HG       LYS  96   3.803   1.498 -14.201
  696   1HD   LYS  96          1HD       LYS  96   2.472   1.898 -16.719
  697   2HD   LYS  96          2HD       LYS  96   4.207   2.163 -16.894
  698   1HE   LYS  96          1HE       LYS  96   3.824  -0.132 -15.266
  699   2HE   LYS  96          2HE       LYS  96   2.795  -0.296 -16.688
  700   1HZ   LYS  96          1HZ       LYS  96   4.851   0.313 -18.005
  701   2HZ   LYS  96          2HZ       LYS  96   5.732   0.042 -16.587
  702   3HZ   LYS  96          3HZ       LYS  96   4.846  -1.218 -17.285
  703    H    LYS  97           H        LYS  97   0.089   4.989 -13.904
  704    HA   LYS  97           HA       LYS  97   0.969   7.099 -15.693
  705   1HB   LYS  97          1HB       LYS  97  -1.432   5.719 -15.337
  706   2HB   LYS  97          2HB       LYS  97  -1.776   7.348 -14.774
  707   1HG   LYS  97          1HG       LYS  97  -0.415   7.781 -17.122
  708   2HG   LYS  97          2HG       LYS  97  -1.383   6.348 -17.474
  709   1HD   LYS  97          1HD       LYS  97  -3.389   7.455 -17.100
  710   2HD   LYS  97          2HD       LYS  97  -2.625   8.717 -16.132
  711   1HE   LYS  97          1HE       LYS  97  -3.263   9.636 -18.265
  712   2HE   LYS  97          2HE       LYS  97  -1.504   9.550 -18.173
  713   1HZ   LYS  97          1HZ       LYS  97  -3.096   7.409 -19.445
  714   2HZ   LYS  97          2HZ       LYS  97  -2.602   8.775 -20.309
  715   3HZ   LYS  97          3HZ       LYS  97  -1.448   7.742 -19.626
  716    H    ILE  98           H        ILE  98  -0.136   6.741 -12.380
  717    HA   ILE  98           HA       ILE  98  -0.470   9.448 -11.764
  718    HB   ILE  98           HB       ILE  98   0.262   7.150  -9.975
  719   1HG1  ILE  98          1HG1      ILE  98  -2.352   8.656 -10.231
  720   2HG1  ILE  98          2HG1      ILE  98  -1.998   7.190 -11.140
  721   1HG2  ILE  98          1HG2      ILE  98   0.147  10.020  -9.437
  722   2HG2  ILE  98          2HG2      ILE  98  -0.847   9.048  -8.351
  723   3HG2  ILE  98          3HG2      ILE  98   0.879   8.718  -8.499
  724   1HD1  ILE  98          1HD1      ILE  98  -1.614   6.058  -8.920
  725   2HD1  ILE  98          2HD1      ILE  98  -2.299   7.500  -8.171
  726   3HD1  ILE  98          3HD1      ILE  98  -3.275   6.533  -9.278
  727    H    VAL  99           H        VAL  99   2.306   7.320 -11.322
  728    HA   VAL  99           HA       VAL  99   4.046   9.347 -10.367
  729    HB   VAL  99           HB       VAL  99   4.186   6.758 -10.109
  730   1HG1  VAL  99          1HG1      VAL  99   4.396   6.314 -12.530
  731   2HG1  VAL  99          2HG1      VAL  99   5.942   7.163 -12.525
  732   3HG1  VAL  99          3HG1      VAL  99   5.750   5.675 -11.598
  733   1HG2  VAL  99          1HG2      VAL  99   6.617   8.497 -10.471
  734   2HG2  VAL  99          2HG2      VAL  99   5.656   8.330  -9.003
  735   3HG2  VAL  99          3HG2      VAL  99   6.582   6.958  -9.610
  736    H    SER 100           H        SER 100   3.157   8.214 -13.536
  737    HA   SER 100           HA       SER 100   5.426   9.464 -14.837
  738   1HB   SER 100          1HB       SER 100   4.387   7.428 -15.796
  739   2HB   SER 100          2HB       SER 100   2.887   8.324 -16.038
  740    HG   SER 100           HG       SER 100   5.386   8.704 -17.301
  741    H    ASP 101           H        ASP 101   2.539  10.446 -13.512
  742    HA   ASP 101           HA       ASP 101   2.099  12.671 -15.346
  743   1HB   ASP 101          1HB       ASP 101   0.508  11.258 -13.352
  744   2HB   ASP 101          2HB       ASP 101   0.359  13.007 -13.216
  745    H    GLY 102           H        GLY 102   4.051  12.057 -12.734
  746   1HA   GLY 102          1HA       GLY 102   3.935  14.850 -11.792
  747   2HA   GLY 102          2HA       GLY 102   5.458  14.152 -12.318
  748    H    ASN 103           H        ASN 103   2.800  12.968 -10.256
  749    HA   ASN 103           HA       ASN 103   4.125  13.195  -7.813
  750   1HB   ASN 103          1HB       ASN 103   2.026  11.171  -8.618
  751   2HB   ASN 103          2HB       ASN 103   2.473  11.581  -6.965
  752   2HD2  ASN 103          2HD2      ASN 103   2.387  14.034  -6.554
  753   1HD2  ASN 103          1HD2      ASN 103   0.959  14.827  -7.115
  754    H    GLY 104           H        GLY 104   6.230  12.468  -7.869
  755   1HA   GLY 104          1HA       GLY 104   7.959  10.926  -8.284
  756   2HA   GLY 104          2HA       GLY 104   6.752   9.704  -8.643
  757    H    MET 105           H        MET 105   5.316   9.206  -6.621
  758    HA   MET 105           HA       MET 105   5.364   7.899  -4.740
  759   1HB   MET 105          1HB       MET 105   8.189   8.847  -4.232
  760   2HB   MET 105          2HB       MET 105   7.369   7.488  -3.476
  761   1HG   MET 105          1HG       MET 105   8.519   7.722  -6.217
  762   2HG   MET 105          2HG       MET 105   8.745   6.461  -5.008
  763   1HE   MET 105          1HE       MET 105   5.803   5.988  -4.082
  764   2HE   MET 105          2HE       MET 105   5.186   4.727  -5.150
  765   3HE   MET 105          3HE       MET 105   6.802   4.583  -4.460
  766    H    ASN 106           H        ASN 106   5.373  11.039  -5.176
  767    HA   ASN 106           HA       ASN 106   5.473  11.886  -2.401
  768   1HB   ASN 106          1HB       ASN 106   5.475  13.187  -5.063
  769   2HB   ASN 106          2HB       ASN 106   4.740  14.086  -3.750
  770   2HD2  ASN 106          2HD2      ASN 106   6.107  14.137  -1.709
  771   1HD2  ASN 106          1HD2      ASN 106   7.798  14.415  -1.928
  772    H    ALA 107           H        ALA 107   3.162  11.239  -4.945
  773    HA   ALA 107           HA       ALA 107   0.921  12.568  -3.936
  774   1HB   ALA 107          1HB       ALA 107   1.437  10.485  -5.895
  775   2HB   ALA 107          2HB       ALA 107  -0.112  10.279  -5.078
  776   3HB   ALA 107          3HB       ALA 107   0.249  11.788  -5.915
  777    H    TRP 108           H        TRP 108   2.285   9.427  -3.163
  778    HA   TRP 108           HA       TRP 108   0.132   8.783  -1.340
  779   1HB   TRP 108          1HB       TRP 108   2.725   7.310  -1.854
  780   2HB   TRP 108          2HB       TRP 108   1.307   6.678  -1.016
  781    HD1  TRP 108           HD1      TRP 108  -0.820   6.023  -2.518
  782    HE1  TRP 108           HE1      TRP 108  -1.062   5.509  -5.028
  783    HE3  TRP 108           HE3      TRP 108   3.627   7.928  -4.173
  784    HZ2  TRP 108           HZ2      TRP 108   0.430   5.866  -7.404
  785    HZ3  TRP 108           HZ3      TRP 108   4.142   7.804  -6.575
  786    HH2  TRP 108           HH2      TRP 108   2.577   6.795  -8.154
  787    H    VAL 109           H        VAL 109   0.064   9.409   0.681
  788    HA   VAL 109           HA       VAL 109   2.150  10.895   1.900
  789    HB   VAL 109           HB       VAL 109   0.098   9.911   3.660
  790   1HG1  VAL 109          1HG1      VAL 109   1.037  12.658   2.890
  791   2HG1  VAL 109          2HG1      VAL 109  -0.105  12.308   4.188
  792   3HG1  VAL 109          3HG1      VAL 109   1.557  11.723   4.293
  793   1HG2  VAL 109          1HG2      VAL 109  -1.172   9.940   1.560
  794   2HG2  VAL 109          2HG2      VAL 109  -1.733  11.175   2.685
  795   3HG2  VAL 109          3HG2      VAL 109  -0.708  11.625   1.323
  796    H    ALA 110           H        ALA 110   1.275   7.538   2.054
  797    HA   ALA 110           HA       ALA 110   2.454   6.964   4.564
  798   1HB   ALA 110          1HB       ALA 110   2.511   4.822   2.549
  799   2HB   ALA 110          2HB       ALA 110   1.825   4.837   4.174
  800   3HB   ALA 110          3HB       ALA 110   0.928   5.548   2.833
  801    H    TRP 111           H        TRP 111   3.762   7.633   1.492
  802    HA   TRP 111           HA       TRP 111   6.305   6.353   2.090
  803   1HB   TRP 111          1HB       TRP 111   5.537   6.250  -0.218
  804   2HB   TRP 111          2HB       TRP 111   5.458   8.003  -0.300
  805    HD1  TRP 111           HD1      TRP 111   7.898   5.104  -0.489
  806    HE1  TRP 111           HE1      TRP 111  10.199   5.983  -1.237
  807    HE3  TRP 111           HE3      TRP 111   6.991  10.129  -0.192
  808    HZ2  TRP 111           HZ2      TRP 111  11.462   8.472  -1.648
  809    HZ3  TRP 111           HZ3      TRP 111   8.799  11.690  -0.780
  810    HH2  TRP 111           HH2      TRP 111  10.989  10.876  -1.492
  811    H    ARG 112           H        ARG 112   4.890   9.605   1.969
  812    HA   ARG 112           HA       ARG 112   7.453  10.790   2.687
  813   1HB   ARG 112          1HB       ARG 112   4.964  11.698   1.491
  814   2HB   ARG 112          2HB       ARG 112   5.527  12.766   2.769
  815   1HG   ARG 112          1HG       ARG 112   7.822  12.414   1.413
  816   2HG   ARG 112          2HG       ARG 112   6.655  12.245   0.100
  817   1HD   ARG 112          1HD       ARG 112   7.416  14.567   0.378
  818   2HD   ARG 112          2HD       ARG 112   5.682  14.394   0.645
  819    HE   ARG 112           HE       ARG 112   6.335  14.350   3.103
  820   1HH1  ARG 112          1HH1      ARG 112   8.122  16.086   0.668
  821   2HH1  ARG 112          2HH1      ARG 112   8.726  17.274   1.774
  822   1HH2  ARG 112          1HH2      ARG 112   7.124  15.910   4.567
  823   2HH2  ARG 112          2HH2      ARG 112   8.159  17.173   3.991
  824    H    ASN 113           H        ASN 113   6.533   9.068   4.601
  825    HA   ASN 113           HA       ASN 113   6.210  10.862   6.845
  826   1HB   ASN 113          1HB       ASN 113   3.875  10.057   5.857
  827   2HB   ASN 113          2HB       ASN 113   4.235   8.629   6.825
  828   2HD2  ASN 113          2HD2      ASN 113   3.064   8.744   8.597
  829   1HD2  ASN 113          1HD2      ASN 113   2.904  10.126   9.621
  830    H    ARG 114           H        ARG 114   5.762   7.401   6.174
  831    HA   ARG 114           HA       ARG 114   7.547   6.787   8.409
  832   1HB   ARG 114          1HB       ARG 114   5.348   5.369   7.010
  833   2HB   ARG 114          2HB       ARG 114   6.644   4.383   7.667
  834   1HG   ARG 114          1HG       ARG 114   5.679   4.485   9.656
  835   2HG   ARG 114          2HG       ARG 114   5.932   6.232   9.671
  836   1HD   ARG 114          1HD       ARG 114   3.747   5.920   8.022
  837   2HD   ARG 114          2HD       ARG 114   3.491   4.695   9.262
  838    HE   ARG 114           HE       ARG 114   3.443   7.569   9.607
  839   1HH1  ARG 114          1HH1      ARG 114   3.628   4.446  11.142
  840   2HH1  ARG 114          2HH1      ARG 114   3.079   5.026  12.678
  841   1HH2  ARG 114          1HH2      ARG 114   2.718   8.341  11.627
  842   2HH2  ARG 114          2HH2      ARG 114   2.561   7.240  12.954
  843    H    CYS 115           H        CYS 115   7.802   7.248   5.161
  844    HA   CYS 115           HA       CYS 115   9.914   5.215   4.892
  845   1HB   CYS 115          1HB       CYS 115   7.915   5.171   3.301
  846   2HB   CYS 115          2HB       CYS 115   8.595   6.632   2.591
  847    H    LYS 116           H        LYS 116   9.113   8.590   4.081
  848    HA   LYS 116           HA       LYS 116  11.543   9.312   2.953
  849   1HB   LYS 116          1HB       LYS 116   9.400  10.666   3.048
  850   2HB   LYS 116          2HB       LYS 116   9.862  11.126   4.680
  851   1HG   LYS 116          1HG       LYS 116  11.127  12.754   3.883
  852   2HG   LYS 116          2HG       LYS 116  12.074  11.590   2.952
  853   1HD   LYS 116          1HD       LYS 116  10.384  11.705   1.155
  854   2HD   LYS 116          2HD       LYS 116   9.516  12.932   2.078
  855   1HE   LYS 116          1HE       LYS 116  12.360  13.179   1.102
  856   2HE   LYS 116          2HE       LYS 116  10.953  13.895   0.315
  857   1HZ   LYS 116          1HZ       LYS 116  10.536  15.139   2.385
  858   2HZ   LYS 116          2HZ       LYS 116  11.972  14.523   3.033
  859   3HZ   LYS 116          3HZ       LYS 116  12.021  15.531   1.675
  860    H    GLY 117           H        GLY 117  13.318   8.483   4.024
  861   1HA   GLY 117          1HA       GLY 117  13.753   9.463   6.772
  862   2HA   GLY 117          2HA       GLY 117  14.983   9.672   5.537
  863    H    THR 118           H        THR 118  13.686   6.790   4.753
  864    HA   THR 118           HA       THR 118  15.501   5.319   6.546
  865    HB   THR 118           HB       THR 118  14.051   3.335   6.165
  866    HG1  THR 118           HG1      THR 118  11.895   4.831   5.336
  867   1HG2  THR 118          1HG2      THR 118  13.196   5.784   7.574
  868   2HG2  THR 118          2HG2      THR 118  11.955   4.551   7.347
  869   3HG2  THR 118          3HG2      THR 118  13.452   4.152   8.190
  870    H    ASP 119           H        ASP 119  15.013   2.869   4.923
  871    HA   ASP 119           HA       ASP 119  16.411   3.567   2.454
  872   1HB   ASP 119          1HB       ASP 119  17.858   2.711   4.442
  873   2HB   ASP 119          2HB       ASP 119  17.266   1.166   3.878
  874    H    VAL 120           H        VAL 120  15.038   2.972   0.910
  875    HA   VAL 120           HA       VAL 120  13.249   0.756   1.187
  876    HB   VAL 120           HB       VAL 120  12.596   1.261  -1.141
  877   1HG1  VAL 120          1HG1      VAL 120  11.918   2.619   1.024
  878   2HG1  VAL 120          2HG1      VAL 120  12.729   3.928   0.164
  879   3HG1  VAL 120          3HG1      VAL 120  11.362   3.097  -0.580
  880   1HG2  VAL 120          1HG2      VAL 120  14.973   3.071  -0.980
  881   2HG2  VAL 120          2HG2      VAL 120  14.500   1.955  -2.262
  882   3HG2  VAL 120          3HG2      VAL 120  13.622   3.469  -2.042
  883    H    GLN 121           H        GLN 121  16.369   1.340  -0.251
  884    HA   GLN 121           HA       GLN 121  16.512  -0.846  -2.000
  885   1HB   GLN 121          1HB       GLN 121  18.353   1.068  -0.832
  886   2HB   GLN 121          2HB       GLN 121  19.078  -0.532  -0.914
  887   1HG   GLN 121          1HG       GLN 121  17.677   0.385  -3.339
  888   2HG   GLN 121          2HG       GLN 121  19.158   1.244  -2.916
  889   2HE2  GLN 121          2HE2      GLN 121  17.963  -2.098  -3.050
  890   1HE2  GLN 121          1HE2      GLN 121  19.376  -2.754  -3.795
  891    H    ALA 122           H        ALA 122  16.605  -0.593   1.421
  892    HA   ALA 122           HA       ALA 122  17.657  -3.278   1.804
  893   1HB   ALA 122          1HB       ALA 122  17.227  -0.917   3.493
  894   2HB   ALA 122          2HB       ALA 122  16.880  -2.457   4.278
  895   3HB   ALA 122          3HB       ALA 122  18.472  -2.163   3.579
  896    H    TRP 123           H        TRP 123  14.648  -1.630   1.515
  897    HA   TRP 123           HA       TRP 123  13.003  -3.370   3.022
  898   1HB   TRP 123          1HB       TRP 123  12.562  -1.361   0.874
  899   2HB   TRP 123          2HB       TRP 123  11.276  -2.529   1.159
  900    HD1  TRP 123           HD1      TRP 123  11.623   0.789   1.918
  901    HE1  TRP 123           HE1      TRP 123  10.770   1.463   4.252
  902    HE3  TRP 123           HE3      TRP 123  11.543  -3.793   4.148
  903    HZ2  TRP 123           HZ2      TRP 123  10.156   0.184   6.681
  904    HZ3  TRP 123           HZ3      TRP 123  10.811  -3.991   6.469
  905    HH2  TRP 123           HH2      TRP 123  10.125  -2.019   7.723
  906    H    ILE 124           H        ILE 124  14.635  -3.785   0.055
  907    HA   ILE 124           HA       ILE 124  13.119  -6.263  -0.445
  908    HB   ILE 124           HB       ILE 124  13.761  -5.991  -2.863
  909   1HG1  ILE 124          1HG1      ILE 124  13.934  -3.188  -3.005
  910   2HG1  ILE 124          2HG1      ILE 124  15.081  -3.669  -1.759
  911   1HG2  ILE 124          1HG2      ILE 124  11.611  -4.987  -1.432
  912   2HG2  ILE 124          2HG2      ILE 124  12.087  -3.660  -2.492
  913   3HG2  ILE 124          3HG2      ILE 124  11.691  -5.238  -3.175
  914   1HD1  ILE 124          1HD1      ILE 124  15.646  -5.468  -3.699
  915   2HD1  ILE 124          2HD1      ILE 124  15.162  -4.069  -4.657
  916   3HD1  ILE 124          3HD1      ILE 124  16.474  -3.925  -3.488
  917    H    ARG 125           H        ARG 125  15.821  -5.303   0.854
  918    HA   ARG 125           HA       ARG 125  17.884  -6.572  -0.605
  919   1HB   ARG 125          1HB       ARG 125  18.010  -4.857   1.352
  920   2HB   ARG 125          2HB       ARG 125  17.954  -6.282   2.380
  921   1HG   ARG 125          1HG       ARG 125  19.916  -7.130   0.948
  922   2HG   ARG 125          2HG       ARG 125  20.067  -5.449   0.433
  923   1HD   ARG 125          1HD       ARG 125  21.208  -5.010   2.285
  924   2HD   ARG 125          2HD       ARG 125  19.784  -5.426   3.238
  925    HE   ARG 125           HE       ARG 125  21.873  -7.360   2.465
  926   1HH1  ARG 125          1HH1      ARG 125  19.485  -6.152   4.697
  927   2HH1  ARG 125          2HH1      ARG 125  19.811  -7.357   5.899
  928   1HH2  ARG 125          1HH2      ARG 125  22.308  -8.950   4.041
  929   2HH2  ARG 125          2HH2      ARG 125  21.416  -8.947   5.525
  930    H    GLY 126           H        GLY 126  17.521  -8.660  -1.178
  931   1HA   GLY 126          1HA       GLY 126  17.193 -10.579   1.043
  932   2HA   GLY 126          2HA       GLY 126  18.097 -10.910  -0.427
  933    H    CYS 127           H        CYS 127  15.382  -9.197  -1.256
  934    HA   CYS 127           HA       CYS 127  13.426 -11.236  -1.214
  935   1HB   CYS 127          1HB       CYS 127  13.653  -8.550  -2.309
  936   2HB   CYS 127          2HB       CYS 127  12.464  -9.585  -3.072
  937    H    ARG 128           H        ARG 128  13.098 -12.880  -2.563
  938    HA   ARG 128           HA       ARG 128  14.891 -13.306  -4.764
  939   1HB   ARG 128          1HB       ARG 128  12.509 -14.896  -3.795
  940   2HB   ARG 128          2HB       ARG 128  13.606 -15.418  -5.067
  941   1HG   ARG 128          1HG       ARG 128  15.440 -15.515  -3.517
  942   2HG   ARG 128          2HG       ARG 128  14.441 -14.828  -2.235
  943   1HD   ARG 128          1HD       ARG 128  14.104 -16.974  -1.662
  944   2HD   ARG 128          2HD       ARG 128  12.938 -16.958  -2.984
  945    HE   ARG 128           HE       ARG 128  15.579 -17.622  -3.856
  946   1HH1  ARG 128          1HH1      ARG 128  12.684 -18.895  -2.395
  947   2HH1  ARG 128          2HH1      ARG 128  12.976 -20.518  -2.925
  948   1HH2  ARG 128          1HH2      ARG 128  15.972 -19.754  -4.558
  949   2HH2  ARG 128          2HH2      ARG 128  14.846 -21.007  -4.154
  950    H    LEU 129           H        LEU 129  14.433 -11.640  -6.224
  951    HA   LEU 129           HA       LEU 129  12.164 -12.185  -7.950
  952   1HB   LEU 129          1HB       LEU 129  11.241 -10.003  -7.907
  953   2HB   LEU 129          2HB       LEU 129  11.382 -10.525  -6.240
  954    HG   LEU 129           HG       LEU 129  13.759  -9.182  -6.677
  955   1HD1  LEU 129          1HD1      LEU 129  12.939  -8.340  -8.814
  956   2HD1  LEU 129          2HD1      LEU 129  11.518  -7.672  -8.012
  957   3HD1  LEU 129          3HD1      LEU 129  13.120  -7.036  -7.642
  958   1HD2  LEU 129          1HD2      LEU 129  11.147  -8.390  -5.426
  959   2HD2  LEU 129          2HD2      LEU 129  12.618  -8.961  -4.640
  960   3HD2  LEU 129          3HD2      LEU 129  12.571  -7.352  -5.359

  No H/Q in entry =         960
  Start of MODEL    5
    1    H1   LYS   1           H1       LYS   1  -6.613  -9.745   3.238
    2    H2   LYS   1           H2       LYS   1  -7.765  -9.927   2.014
    3    H3   LYS   1           H3       LYS   1  -7.476 -11.193   3.100
    4    HA   LYS   1           HA       LYS   1  -5.502 -11.788   2.148
    5   1HB   LYS   1          1HB       LYS   1  -7.728 -11.356   0.486
    6   2HB   LYS   1          2HB       LYS   1  -6.336 -10.824  -0.446
    7   1HG   LYS   1          1HG       LYS   1  -5.279 -12.972  -0.187
    8   2HG   LYS   1          2HG       LYS   1  -6.575 -13.515   0.881
    9   1HD   LYS   1          1HD       LYS   1  -8.105 -13.685  -0.847
   10   2HD   LYS   1          2HD       LYS   1  -7.223 -12.552  -1.873
   11   1HE   LYS   1          1HE       LYS   1  -6.195 -14.243  -2.877
   12   2HE   LYS   1          2HE       LYS   1  -5.530 -14.769  -1.330
   13   1HZ   LYS   1          1HZ       LYS   1  -7.887 -15.796  -1.046
   14   2HZ   LYS   1          2HZ       LYS   1  -7.930 -15.710  -2.736
   15   3HZ   LYS   1          3HZ       LYS   1  -6.717 -16.602  -1.964
   16    H    VAL   2           H        VAL   2  -3.819 -10.482   2.882
   17    HA   VAL   2           HA       VAL   2  -3.185  -8.083   1.318
   18    HB   VAL   2           HB       VAL   2  -2.164  -9.088   3.975
   19   1HG1  VAL   2          1HG1      VAL   2  -0.562  -7.778   2.224
   20   2HG1  VAL   2          2HG1      VAL   2  -1.305  -6.425   3.073
   21   3HG1  VAL   2          3HG1      VAL   2  -0.423  -7.655   3.977
   22   1HG2  VAL   2          1HG2      VAL   2  -4.330  -7.465   3.265
   23   2HG2  VAL   2          2HG2      VAL   2  -3.670  -7.729   4.879
   24   3HG2  VAL   2          3HG2      VAL   2  -3.102  -6.374   3.904
   25    H    PHE   3           H        PHE   3  -1.159  -7.812   0.313
   26    HA   PHE   3           HA       PHE   3   0.056 -10.187  -0.701
   27   1HB   PHE   3          1HB       PHE   3   0.675  -7.244  -0.962
   28   2HB   PHE   3          2HB       PHE   3   1.707  -8.479  -1.670
   29    HD1  PHE   3           HD1      PHE   3   0.158 -10.331  -2.992
   30    HD2  PHE   3           HD2      PHE   3  -0.690  -6.201  -2.436
   31    HE1  PHE   3           HE1      PHE   3  -1.243 -10.352  -5.010
   32    HE2  PHE   3           HE2      PHE   3  -2.096  -6.213  -4.447
   33    HZ   PHE   3           HZ       PHE   3  -2.376  -8.290  -5.742
   34    H    GLY   4           H        GLY   4   2.405 -10.547  -0.574
   35   1HA   GLY   4          1HA       GLY   4   4.072 -11.258   0.904
   36   2HA   GLY   4          2HA       GLY   4   3.314 -10.306   2.176
   37    H    ARG   5           H        ARG   5   6.124 -10.372   1.551
   38    HA   ARG   5           HA       ARG   5   6.500  -7.517   1.113
   39   1HB   ARG   5          1HB       ARG   5   7.567  -8.880   3.028
   40   2HB   ARG   5          2HB       ARG   5   8.675  -9.479   1.800
   41   1HG   ARG   5          1HG       ARG   5   8.686  -6.723   1.459
   42   2HG   ARG   5          2HG       ARG   5   8.669  -6.963   3.208
   43   1HD   ARG   5          1HD       ARG   5  10.484  -8.830   2.074
   44   2HD   ARG   5          2HD       ARG   5  10.840  -7.242   1.396
   45    HE   ARG   5           HE       ARG   5  10.647  -6.692   4.009
   46   1HH1  ARG   5          1HH1      ARG   5  12.366  -9.189   2.291
   47   2HH1  ARG   5          2HH1      ARG   5  13.637  -9.298   3.462
   48   1HH2  ARG   5          1HH2      ARG   5  12.316  -6.829   5.556
   49   2HH2  ARG   5          2HH2      ARG   5  13.609  -7.957   5.318
   50    H    CYS   6           H        CYS   6   8.113 -10.491  -0.038
   51    HA   CYS   6           HA       CYS   6   9.146  -9.021  -2.296
   52   1HB   CYS   6          1HB       CYS   6   9.338 -11.997  -1.922
   53   2HB   CYS   6          2HB       CYS   6  10.389 -10.922  -2.840
   54    H    GLU   7           H        GLU   7   6.658 -11.456  -1.691
   55    HA   GLU   7           HA       GLU   7   6.029 -12.257  -4.242
   56   1HB   GLU   7          1HB       GLU   7   4.859 -12.806  -1.986
   57   2HB   GLU   7          2HB       GLU   7   3.845 -11.417  -2.348
   58   1HG   GLU   7          1HG       GLU   7   2.959 -12.433  -4.274
   59   2HG   GLU   7          2HG       GLU   7   4.199 -13.686  -4.278
   60    H    LEU   8           H        LEU   8   4.869  -9.375  -2.563
   61    HA   LEU   8           HA       LEU   8   3.509  -8.238  -4.753
   62   1HB   LEU   8          1HB       LEU   8   3.084  -7.585  -2.433
   63   2HB   LEU   8          2HB       LEU   8   4.706  -6.938  -2.301
   64    HG   LEU   8           HG       LEU   8   2.665  -5.347  -2.673
   65   1HD1  LEU   8          1HD1      LEU   8   5.080  -4.742  -2.589
   66   2HD1  LEU   8          2HD1      LEU   8   5.143  -4.969  -4.337
   67   3HD1  LEU   8          3HD1      LEU   8   4.106  -3.720  -3.647
   68   1HD2  LEU   8          1HD2      LEU   8   2.106  -6.743  -4.810
   69   2HD2  LEU   8          2HD2      LEU   8   1.909  -4.991  -4.814
   70   3HD2  LEU   8          3HD2      LEU   8   3.332  -5.719  -5.557
   71    H    ALA   9           H        ALA   9   6.840  -7.884  -3.529
   72    HA   ALA   9           HA       ALA   9   7.599  -5.782  -5.242
   73   1HB   ALA   9          1HB       ALA   9   8.828  -6.702  -3.201
   74   2HB   ALA   9          2HB       ALA   9   9.530  -7.870  -4.322
   75   3HB   ALA   9          3HB       ALA   9   9.787  -6.144  -4.571
   76    H    ALA  10           H        ALA  10   8.118  -9.300  -5.628
   77    HA   ALA  10           HA       ALA  10   9.398  -9.284  -8.060
   78   1HB   ALA  10          1HB       ALA  10   9.116 -11.516  -8.012
   79   2HB   ALA  10          2HB       ALA  10   7.368 -11.389  -7.807
   80   3HB   ALA  10          3HB       ALA  10   8.434 -11.229  -6.411
   81    H    ALA  11           H        ALA  11   5.976  -8.956  -7.305
   82    HA   ALA  11           HA       ALA  11   5.050  -9.070  -9.963
   83   1HB   ALA  11          1HB       ALA  11   3.765  -7.668  -7.639
   84   2HB   ALA  11          2HB       ALA  11   3.586  -9.384  -8.000
   85   3HB   ALA  11          3HB       ALA  11   2.968  -8.177  -9.127
   86    H    MET  12           H        MET  12   6.208  -6.565  -7.943
   87    HA   MET  12           HA       MET  12   5.519  -4.328  -9.518
   88   1HB   MET  12          1HB       MET  12   8.070  -4.436  -7.946
   89   2HB   MET  12          2HB       MET  12   7.020  -3.069  -8.219
   90   1HG   MET  12          1HG       MET  12   6.181  -5.434  -6.594
   91   2HG   MET  12          2HG       MET  12   6.999  -4.035  -5.904
   92   1HE   MET  12          1HE       MET  12   6.175  -1.591  -6.604
   93   2HE   MET  12          2HE       MET  12   5.415  -1.870  -8.170
   94   3HE   MET  12          3HE       MET  12   4.480  -1.168  -6.849
   95    H    LYS  13           H        LYS  13   8.526  -6.216  -9.376
   96    HA   LYS  13           HA       LYS  13  10.006  -4.881 -11.282
   97   1HB   LYS  13          1HB       LYS  13  10.648  -6.892  -9.791
   98   2HB   LYS  13          2HB       LYS  13  10.018  -7.885 -11.100
   99   1HG   LYS  13          1HG       LYS  13  11.804  -5.920 -12.165
  100   2HG   LYS  13          2HG       LYS  13  12.588  -6.791 -10.845
  101   1HD   LYS  13          1HD       LYS  13  12.877  -8.573 -12.142
  102   2HD   LYS  13          2HD       LYS  13  11.146  -8.643 -12.483
  103   1HE   LYS  13          1HE       LYS  13  11.733  -8.205 -14.598
  104   2HE   LYS  13          2HE       LYS  13  11.953  -6.547 -14.040
  105   1HZ   LYS  13          1HZ       LYS  13  14.252  -8.167 -13.539
  106   2HZ   LYS  13          2HZ       LYS  13  13.859  -8.133 -15.183
  107   3HZ   LYS  13          3HZ       LYS  13  14.136  -6.686 -14.348
  108    H    ARG  14           H        ARG  14   7.741  -7.570 -11.756
  109    HA   ARG  14           HA       ARG  14   7.994  -7.710 -14.552
  110   1HB   ARG  14          1HB       ARG  14   5.676  -8.469 -12.764
  111   2HB   ARG  14          2HB       ARG  14   5.804  -8.899 -14.464
  112   1HG   ARG  14          1HG       ARG  14   7.992 -10.037 -13.850
  113   2HG   ARG  14          2HG       ARG  14   7.489  -9.846 -12.170
  114   1HD   ARG  14          1HD       ARG  14   6.659 -11.934 -12.621
  115   2HD   ARG  14          2HD       ARG  14   5.269 -10.937 -13.042
  116    HE   ARG  14           HE       ARG  14   7.165 -11.793 -15.117
  117   1HH1  ARG  14          1HH1      ARG  14   3.950 -11.744 -13.774
  118   2HH1  ARG  14          2HH1      ARG  14   3.213 -12.433 -15.181
  119   1HH2  ARG  14          1HH2      ARG  14   6.202 -12.701 -16.973
  120   2HH2  ARG  14          2HH2      ARG  14   4.493 -12.978 -17.000
  121    H    HIS  15           H        HIS  15   5.917  -5.796 -12.427
  122    HA   HIS  15           HA       HIS  15   4.322  -4.752 -14.535
  123   1HB   HIS  15          1HB       HIS  15   4.622  -4.259 -11.613
  124   2HB   HIS  15          2HB       HIS  15   3.825  -3.024 -12.582
  125    HD1  HIS  15           HD1      HIS  15   2.485  -4.921 -10.375
  126    HD2  HIS  15           HD2      HIS  15   2.210  -5.320 -14.501
  127    HE1  HIS  15           HE1      HIS  15   0.374  -6.224 -10.785
  128    HE2  HIS  15           HE2      HIS  15   0.275  -6.529 -13.284
  129    H    GLY  16           H        GLY  16   7.536  -4.123 -13.810
  130   1HA   GLY  16          1HA       GLY  16   7.529  -1.871 -15.517
  131   2HA   GLY  16          2HA       GLY  16   8.914  -2.577 -14.716
  132    H    LEU  17           H        LEU  17   7.564  -2.088 -11.964
  133    HA   LEU  17           HA       LEU  17   7.566   0.817 -11.985
  134   1HB   LEU  17          1HB       LEU  17   7.390  -0.842  -9.502
  135   2HB   LEU  17          2HB       LEU  17   6.753   0.763  -9.792
  136    HG   LEU  17           HG       LEU  17   5.574  -1.877 -10.356
  137   1HD1  LEU  17          1HD1      LEU  17   4.946   0.139  -8.719
  138   2HD1  LEU  17          2HD1      LEU  17   3.998   0.618 -10.126
  139   3HD1  LEU  17          3HD1      LEU  17   3.739  -0.962  -9.385
  140   1HD2  LEU  17          1HD2      LEU  17   5.365   0.420 -12.286
  141   2HD2  LEU  17          2HD2      LEU  17   5.677  -1.282 -12.627
  142   3HD2  LEU  17          3HD2      LEU  17   4.072  -0.766 -12.110
  143    H    ASP  18           H        ASP  18   9.838  -1.423 -12.004
  144    HA   ASP  18           HA       ASP  18  11.607  -0.488  -9.967
  145   1HB   ASP  18          1HB       ASP  18  12.148  -2.647 -10.505
  146   2HB   ASP  18          2HB       ASP  18  11.786  -2.434 -12.208
  147    H    ASN  19           H        ASN  19  11.801   1.684 -10.196
  148    HA   ASN  19           HA       ASN  19  12.760   3.635 -10.824
  149   1HB   ASN  19          1HB       ASN  19  14.711   1.853 -11.260
  150   2HB   ASN  19          2HB       ASN  19  14.456   2.376 -12.922
  151   2HD2  ASN  19          2HD2      ASN  19  16.406   2.846 -10.461
  152   1HD2  ASN  19          1HD2      ASN  19  16.785   4.521 -10.640
  153    H    TYR  20           H        TYR  20  10.394   2.763 -12.070
  154    HA   TYR  20           HA       TYR  20  10.453   3.316 -14.865
  155   1HB   TYR  20          1HB       TYR  20   8.581   2.110 -13.702
  156   2HB   TYR  20          2HB       TYR  20   8.139   3.624 -12.924
  157    HD1  TYR  20           HD1      TYR  20   8.679   2.202 -16.338
  158    HD2  TYR  20           HD2      TYR  20   6.515   4.941 -13.906
  159    HE1  TYR  20           HE1      TYR  20   7.247   2.766 -18.256
  160    HE2  TYR  20           HE2      TYR  20   5.077   5.511 -15.817
  161    HH   TYR  20           HH       TYR  20   5.817   4.630 -19.002
  162    H    ARG  21           H        ARG  21   9.207   5.341 -15.706
  163    HA   ARG  21           HA       ARG  21  10.464   7.600 -15.578
  164   1HB   ARG  21          1HB       ARG  21   7.633   7.014 -15.842
  165   2HB   ARG  21          2HB       ARG  21   7.896   8.609 -15.151
  166   1HG   ARG  21          1HG       ARG  21   8.121   9.328 -17.239
  167   2HG   ARG  21          2HG       ARG  21   9.689   8.519 -17.240
  168   1HD   ARG  21          1HD       ARG  21   8.325   6.419 -17.908
  169   2HD   ARG  21          2HD       ARG  21   7.072   7.578 -18.349
  170    HE   ARG  21           HE       ARG  21   9.680   7.253 -19.631
  171   1HH1  ARG  21          1HH1      ARG  21   6.606   8.886 -19.457
  172   2HH1  ARG  21          2HH1      ARG  21   6.738   9.575 -21.041
  173   1HH2  ARG  21          1HH2      ARG  21   9.861   8.158 -21.717
  174   2HH2  ARG  21          2HH2      ARG  21   8.588   9.161 -22.326
  175    H    GLY  22           H        GLY  22   8.348   6.530 -12.995
  176   1HA   GLY  22          1HA       GLY  22   7.992   7.338 -10.860
  177   2HA   GLY  22          2HA       GLY  22   8.857   8.801 -11.308
  178    H    TYR  23           H        TYR  23   9.004   5.852  -9.625
  179    HA   TYR  23           HA       TYR  23  11.905   6.185  -9.261
  180   1HB   TYR  23          1HB       TYR  23   9.764   6.012  -7.179
  181   2HB   TYR  23          2HB       TYR  23  11.404   5.493  -6.808
  182    HD1  TYR  23           HD1      TYR  23   9.621   8.400  -8.337
  183    HD2  TYR  23           HD2      TYR  23  12.851   7.061  -5.914
  184    HE1  TYR  23           HE1      TYR  23  10.241  10.733  -7.889
  185    HE2  TYR  23           HE2      TYR  23  13.479   9.393  -5.458
  186    HH   TYR  23           HH       TYR  23  12.996  11.533  -5.790
  187    H    SER  24           H        SER  24  12.703   4.354  -7.676
  188    HA   SER  24           HA       SER  24  12.510   1.950  -9.199
  189   1HB   SER  24          1HB       SER  24  14.288   1.132  -7.821
  190   2HB   SER  24          2HB       SER  24  14.621   2.830  -8.160
  191    HG   SER  24           HG       SER  24  14.368   3.292  -6.114
  192    H    LEU  25           H        LEU  25  12.220  -0.151  -8.233
  193    HA   LEU  25           HA       LEU  25   9.744  -0.658  -7.271
  194   1HB   LEU  25          1HB       LEU  25  12.313  -2.170  -6.911
  195   2HB   LEU  25          2HB       LEU  25  10.799  -2.794  -6.285
  196    HG   LEU  25           HG       LEU  25  11.673  -2.458  -9.123
  197   1HD1  LEU  25          1HD1      LEU  25  11.140  -4.615  -7.295
  198   2HD1  LEU  25          2HD1      LEU  25  10.145  -4.757  -8.744
  199   3HD1  LEU  25          3HD1      LEU  25  11.900  -4.650  -8.887
  200   1HD2  LEU  25          1HD2      LEU  25   8.853  -2.448  -8.098
  201   2HD2  LEU  25          2HD2      LEU  25   9.607  -1.367  -9.269
  202   3HD2  LEU  25          3HD2      LEU  25   9.259  -3.038  -9.710
  203    H    GLY  26           H        GLY  26  12.657  -0.466  -5.200
  204   1HA   GLY  26          1HA       GLY  26  12.875   0.266  -3.028
  205   2HA   GLY  26          2HA       GLY  26  11.615  -0.921  -2.743
  206    H    ASN  27           H        ASN  27  11.298   2.123  -4.527
  207    HA   ASN  27           HA       ASN  27  10.129   3.566  -2.379
  208   1HB   ASN  27          1HB       ASN  27   9.895   4.068  -5.352
  209   2HB   ASN  27          2HB       ASN  27   9.507   5.219  -4.076
  210   2HD2  ASN  27          2HD2      ASN  27  11.998   3.717  -5.911
  211   1HD2  ASN  27          1HD2      ASN  27  13.315   4.648  -5.291
  212    H    TRP  28           H        TRP  28   8.854   1.537  -4.919
  213    HA   TRP  28           HA       TRP  28   6.106   2.191  -4.531
  214   1HB   TRP  28          1HB       TRP  28   7.413  -0.194  -5.829
  215   2HB   TRP  28          2HB       TRP  28   5.689   0.174  -5.896
  216    HD1  TRP  28           HD1      TRP  28   9.013   1.186  -7.365
  217    HE1  TRP  28           HE1      TRP  28   8.627   2.864  -9.264
  218    HE3  TRP  28           HE3      TRP  28   4.031   2.016  -6.677
  219    HZ2  TRP  28           HZ2      TRP  28   6.473   4.344 -10.354
  220    HZ3  TRP  28           HZ3      TRP  28   2.861   3.567  -8.179
  221    HH2  TRP  28           HH2      TRP  28   4.061   4.713  -9.988
  222    H    VAL  29           H        VAL  29   8.219  -0.418  -3.376
  223    HA   VAL  29           HA       VAL  29   6.198  -1.853  -2.038
  224    HB   VAL  29           HB       VAL  29   9.174  -1.775  -1.525
  225   1HG1  VAL  29          1HG1      VAL  29   7.883  -2.696   0.363
  226   2HG1  VAL  29          2HG1      VAL  29   7.173  -3.885  -0.730
  227   3HG1  VAL  29          3HG1      VAL  29   8.908  -3.902  -0.414
  228   1HG2  VAL  29          1HG2      VAL  29   7.493  -3.539  -3.296
  229   2HG2  VAL  29          2HG2      VAL  29   8.766  -2.423  -3.787
  230   3HG2  VAL  29          3HG2      VAL  29   9.171  -3.877  -2.874
  231    H    CYS  30           H        CYS  30   8.625   0.456  -0.907
  232    HA   CYS  30           HA       CYS  30   7.926   0.451   1.789
  233   1HB   CYS  30          1HB       CYS  30   9.969   1.469   0.671
  234   2HB   CYS  30          2HB       CYS  30   8.952   2.848   0.277
  235    H    ALA  31           H        ALA  31   6.802   2.568  -0.847
  236    HA   ALA  31           HA       ALA  31   5.125   4.178   0.741
  237   1HB   ALA  31          1HB       ALA  31   4.740   3.585  -2.184
  238   2HB   ALA  31          2HB       ALA  31   5.954   4.705  -1.566
  239   3HB   ALA  31          3HB       ALA  31   4.241   5.024  -1.296
  240    H    ALA  32           H        ALA  32   4.427   1.294  -1.215
  241    HA   ALA  32           HA       ALA  32   1.642   1.279  -0.684
  242   1HB   ALA  32          1HB       ALA  32   2.213   0.082  -2.574
  243   2HB   ALA  32          2HB       ALA  32   1.924  -1.199  -1.398
  244   3HB   ALA  32          3HB       ALA  32   3.574  -0.715  -1.788
  245    H    LYS  33           H        LYS  33   4.353  -0.533   0.735
  246    HA   LYS  33           HA       LYS  33   3.045  -2.210   2.439
  247   1HB   LYS  33          1HB       LYS  33   5.512  -2.094   2.084
  248   2HB   LYS  33          2HB       LYS  33   5.554  -0.683   3.130
  249   1HG   LYS  33          1HG       LYS  33   4.179  -2.791   4.473
  250   2HG   LYS  33          2HG       LYS  33   5.719  -3.396   3.856
  251   1HD   LYS  33          1HD       LYS  33   6.895  -1.566   4.950
  252   2HD   LYS  33          2HD       LYS  33   5.362  -0.909   5.529
  253   1HE   LYS  33          1HE       LYS  33   5.422  -3.605   6.323
  254   2HE   LYS  33          2HE       LYS  33   7.019  -2.948   6.682
  255   1HZ   LYS  33          1HZ       LYS  33   4.858  -1.206   7.437
  256   2HZ   LYS  33          2HZ       LYS  33   4.836  -2.688   8.252
  257   3HZ   LYS  33          3HZ       LYS  33   6.207  -1.702   8.327
  258    H    PHE  34           H        PHE  34   4.163   1.070   3.286
  259    HA   PHE  34           HA       PHE  34   2.761   0.981   5.757
  260   1HB   PHE  34          1HB       PHE  34   4.484   2.886   4.404
  261   2HB   PHE  34          2HB       PHE  34   3.370   3.572   5.568
  262    HD1  PHE  34           HD1      PHE  34   3.346   2.392   7.899
  263    HD2  PHE  34           HD2      PHE  34   6.535   2.108   5.096
  264    HE1  PHE  34           HE1      PHE  34   4.881   1.757   9.715
  265    HE2  PHE  34           HE2      PHE  34   8.076   1.472   6.906
  266    HZ   PHE  34           HZ       PHE  34   7.250   1.297   9.219
  267    H    GLU  35           H        GLU  35   1.850   1.842   2.590
  268    HA   GLU  35           HA       GLU  35  -0.132   3.758   3.250
  269   1HB   GLU  35          1HB       GLU  35   0.981   2.625   0.917
  270   2HB   GLU  35          2HB       GLU  35  -0.745   2.306   0.846
  271   1HG   GLU  35          1HG       GLU  35   0.685   4.931   0.913
  272   2HG   GLU  35          2HG       GLU  35  -0.511   4.342  -0.240
  273    H    SER  36           H        SER  36  -0.367   0.335   2.313
  274    HA   SER  36           HA       SER  36  -2.944   0.203   3.747
  275   1HB   SER  36          1HB       SER  36  -3.658  -1.411   1.906
  276   2HB   SER  36          2HB       SER  36  -3.518   0.281   1.433
  277    HG   SER  36           HG       SER  36  -1.276  -0.377   0.804
  278    H    ASN  37           H        ASN  37   0.059  -0.847   3.979
  279    HA   ASN  37           HA       ASN  37   1.088  -2.666   4.907
  280   1HB   ASN  37          1HB       ASN  37  -1.101  -2.297   6.423
  281   2HB   ASN  37          2HB       ASN  37  -1.481  -3.892   5.779
  282   2HD2  ASN  37          2HD2      ASN  37  -1.024  -5.347   7.256
  283   1HD2  ASN  37          1HD2      ASN  37   0.411  -5.408   8.217
  284    H    PHE  38           H        PHE  38  -0.010  -2.683   2.213
  285    HA   PHE  38           HA       PHE  38  -0.018  -3.975   0.402
  286   1HB   PHE  38          1HB       PHE  38   0.894  -6.083   2.359
  287   2HB   PHE  38          2HB       PHE  38   0.722  -6.377   0.631
  288    HD1  PHE  38           HD1      PHE  38   1.687  -3.794  -0.447
  289    HD2  PHE  38           HD2      PHE  38   3.203  -6.229   2.694
  290    HE1  PHE  38           HE1      PHE  38   3.932  -2.878  -0.837
  291    HE2  PHE  38           HE2      PHE  38   5.456  -5.314   2.312
  292    HZ   PHE  38           HZ       PHE  38   5.825  -3.643   0.543
  293    H    ASN  39           H        ASN  39  -2.379  -3.629   2.194
  294    HA   ASN  39           HA       ASN  39  -3.901  -6.052   1.868
  295   1HB   ASN  39          1HB       ASN  39  -4.272  -4.472   3.766
  296   2HB   ASN  39          2HB       ASN  39  -4.876  -3.288   2.612
  297   2HD2  ASN  39          2HD2      ASN  39  -6.689  -3.580   4.256
  298   1HD2  ASN  39          1HD2      ASN  39  -7.904  -4.738   3.843
  299    H    THR  40           H        THR  40  -4.489  -6.643  -0.095
  300    HA   THR  40           HA       THR  40  -4.715  -4.896  -2.305
  301    HB   THR  40           HB       THR  40  -5.083  -6.772  -3.573
  302    HG1  THR  40           HG1      THR  40  -6.206  -8.588  -1.971
  303   1HG2  THR  40          1HG2      THR  40  -3.390  -7.194  -1.424
  304   2HG2  THR  40          2HG2      THR  40  -4.386  -8.648  -1.477
  305   3HG2  THR  40          3HG2      THR  40  -3.469  -8.156  -2.900
  306    H    GLN  41           H        GLN  41  -6.860  -6.115   0.077
  307    HA   GLN  41           HA       GLN  41  -9.238  -5.105  -1.255
  308   1HB   GLN  41          1HB       GLN  41  -8.616  -6.954   0.969
  309   2HB   GLN  41          2HB       GLN  41 -10.110  -6.060   1.095
  310   1HG   GLN  41          1HG       GLN  41 -10.526  -6.897  -1.323
  311   2HG   GLN  41          2HG       GLN  41  -9.290  -8.090  -0.925
  312   2HE2  GLN  41          2HE2      GLN  41 -10.247  -9.942  -0.505
  313   1HE2  GLN  41          1HE2      GLN  41 -11.644 -10.166   0.486
  314    H    ALA  42           H        ALA  42  -6.891  -3.659   0.369
  315    HA   ALA  42           HA       ALA  42  -8.065  -2.346   2.537
  316   1HB   ALA  42          1HB       ALA  42  -5.806  -2.072   2.543
  317   2HB   ALA  42          2HB       ALA  42  -6.283  -0.526   1.841
  318   3HB   ALA  42          3HB       ALA  42  -5.717  -1.831   0.798
  319    H    THR  43           H        THR  43  -9.793  -1.100   2.550
  320    HA   THR  43           HA       THR  43 -10.091   0.968   0.483
  321    HB   THR  43           HB       THR  43 -12.440   0.599   0.275
  322    HG1  THR  43           HG1      THR  43 -13.220  -1.409   1.546
  323   1HG2  THR  43          1HG2      THR  43 -10.674  -1.760  -0.040
  324   2HG2  THR  43          2HG2      THR  43 -12.411  -2.042  -0.166
  325   3HG2  THR  43          3HG2      THR  43 -11.625  -0.887  -1.243
  326    H    ASN  44           H        ASN  44 -10.155   2.928   1.491
  327    HA   ASN  44           HA       ASN  44 -11.464   3.096   4.111
  328   1HB   ASN  44          1HB       ASN  44  -8.990   2.870   4.422
  329   2HB   ASN  44          2HB       ASN  44  -8.789   4.373   3.526
  330   2HD2  ASN  44          2HD2      ASN  44  -9.758   2.918   6.500
  331   1HD2  ASN  44          1HD2      ASN  44  -9.937   4.380   7.404
  332    H    ARG  45           H        ARG  45 -12.981   4.585   4.035
  333    HA   ARG  45           HA       ARG  45 -13.039   6.567   1.945
  334   1HB   ARG  45          1HB       ARG  45 -14.894   5.974   4.252
  335   2HB   ARG  45          2HB       ARG  45 -15.180   7.264   3.092
  336   1HG   ARG  45          1HG       ARG  45 -16.083   5.844   1.655
  337   2HG   ARG  45          2HG       ARG  45 -14.655   4.807   1.710
  338   1HD   ARG  45          1HD       ARG  45 -16.508   3.487   2.398
  339   2HD   ARG  45          2HD       ARG  45 -15.559   3.842   3.841
  340    HE   ARG  45           HE       ARG  45 -17.321   5.760   4.039
  341   1HH1  ARG  45          1HH1      ARG  45 -17.863   2.477   3.003
  342   2HH1  ARG  45          2HH1      ARG  45 -19.500   2.433   3.570
  343   1HH2  ARG  45          1HH2      ARG  45 -19.473   5.709   4.789
  344   2HH2  ARG  45          2HH2      ARG  45 -20.415   4.270   4.584
  345    H    ASN  46           H        ASN  46 -12.975   8.798   2.185
  346    HA   ASN  46           HA       ASN  46 -11.695   9.733   4.667
  347   1HB   ASN  46          1HB       ASN  46 -11.578  11.207   2.051
  348   2HB   ASN  46          2HB       ASN  46 -10.485  11.314   3.426
  349   2HD2  ASN  46          2HD2      ASN  46 -10.898  10.080   0.386
  350   1HD2  ASN  46          1HD2      ASN  46  -9.679   8.856   0.414
  351    H    THR  47           H        THR  47 -12.008  12.247   4.847
  352    HA   THR  47           HA       THR  47 -14.858  12.643   5.151
  353    HB   THR  47           HB       THR  47 -14.208  14.778   6.257
  354    HG1  THR  47           HG1      THR  47 -12.241  15.142   5.137
  355   1HG2  THR  47          1HG2      THR  47 -14.344  12.507   7.420
  356   2HG2  THR  47          2HG2      THR  47 -12.581  12.509   7.377
  357   3HG2  THR  47          3HG2      THR  47 -13.442  13.777   8.249
  358    H    ASP  48           H        ASP  48 -12.341  13.640   2.993
  359    HA   ASP  48           HA       ASP  48 -13.594  15.983   1.985
  360   1HB   ASP  48          1HB       ASP  48 -12.015  15.634   0.037
  361   2HB   ASP  48          2HB       ASP  48 -11.256  15.767   1.620
  362    H    GLY  49           H        GLY  49 -14.292  12.696   1.625
  363   1HA   GLY  49          1HA       GLY  49 -16.014  13.312  -0.695
  364   2HA   GLY  49          2HA       GLY  49 -16.432  12.170   0.571
  365    H    SER  50           H        SER  50 -13.213  12.296  -0.763
  366    HA   SER  50           HA       SER  50 -13.672  10.228  -2.701
  367   1HB   SER  50          1HB       SER  50 -11.002  10.231  -2.522
  368   2HB   SER  50          2HB       SER  50 -11.887  11.465  -3.416
  369    HG   SER  50           HG       SER  50 -10.469  12.507  -2.064
  370    H    THR  51           H        THR  51 -11.640   8.484  -2.487
  371    HA   THR  51           HA       THR  51 -11.474   7.320   0.140
  372    HB   THR  51           HB       THR  51 -12.923   5.724  -1.974
  373    HG1  THR  51           HG1      THR  51 -14.799   6.309  -1.043
  374   1HG2  THR  51          1HG2      THR  51 -12.502   5.257   0.978
  375   2HG2  THR  51          2HG2      THR  51 -13.438   4.224  -0.104
  376   3HG2  THR  51          3HG2      THR  51 -11.698   4.395  -0.333
  377    H    ASP  52           H        ASP  52 -10.101   5.366   0.156
  378    HA   ASP  52           HA       ASP  52  -8.320   5.272  -2.188
  379   1HB   ASP  52          1HB       ASP  52  -7.515   4.375   0.562
  380   2HB   ASP  52          2HB       ASP  52  -6.495   4.906  -0.771
  381    H    TYR  53           H        TYR  53  -9.176   3.627  -3.344
  382    HA   TYR  53           HA       TYR  53  -9.706   1.111  -1.942
  383   1HB   TYR  53          1HB       TYR  53 -10.496   1.979  -4.726
  384   2HB   TYR  53          2HB       TYR  53 -10.883   0.427  -3.995
  385    HD1  TYR  53           HD1      TYR  53 -12.176   0.580  -1.699
  386    HD2  TYR  53           HD2      TYR  53 -12.067   3.667  -4.623
  387    HE1  TYR  53           HE1      TYR  53 -14.264   1.508  -0.789
  388    HE2  TYR  53           HE2      TYR  53 -14.151   4.605  -3.718
  389    HH   TYR  53           HH       TYR  53 -15.877   4.256  -2.322
  390    H    GLY  54           H        GLY  54  -7.328   0.770  -1.796
  391   1HA   GLY  54          1HA       GLY  54  -5.915   0.266  -4.252
  392   2HA   GLY  54          2HA       GLY  54  -6.474  -1.218  -3.509
  393    H    ILE  55           H        ILE  55  -4.159  -1.641  -3.632
  394    HA   ILE  55           HA       ILE  55  -2.931  -1.363  -1.071
  395    HB   ILE  55           HB       ILE  55  -2.548  -3.310  -2.639
  396   1HG1  ILE  55          1HG1      ILE  55  -0.046  -1.823  -1.803
  397   2HG1  ILE  55          2HG1      ILE  55  -1.033  -2.821  -0.739
  398   1HG2  ILE  55          1HG2      ILE  55  -1.871  -1.231  -4.422
  399   2HG2  ILE  55          2HG2      ILE  55  -0.402  -2.165  -4.139
  400   3HG2  ILE  55          3HG2      ILE  55  -1.860  -2.970  -4.722
  401   1HD1  ILE  55          1HD1      ILE  55  -0.467  -4.488  -2.864
  402   2HD1  ILE  55          2HD1      ILE  55   1.027  -3.585  -2.618
  403   3HD1  ILE  55          3HD1      ILE  55   0.317  -4.494  -1.284
  404    H    LEU  56           H        LEU  56  -3.045   0.431  -3.962
  405    HA   LEU  56           HA       LEU  56  -0.866   2.187  -3.065
  406   1HB   LEU  56          1HB       LEU  56  -1.539   1.121  -5.689
  407   2HB   LEU  56          2HB       LEU  56  -1.476   2.872  -5.704
  408    HG   LEU  56           HG       LEU  56   0.696   2.337  -6.288
  409   1HD1  LEU  56          1HD1      LEU  56   0.383   3.508  -3.875
  410   2HD1  LEU  56          2HD1      LEU  56   1.394   2.131  -3.436
  411   3HD1  LEU  56          3HD1      LEU  56   1.940   3.270  -4.666
  412   1HD2  LEU  56          1HD2      LEU  56   0.059  -0.176  -5.425
  413   2HD2  LEU  56          2HD2      LEU  56   1.643   0.330  -6.012
  414   3HD2  LEU  56          3HD2      LEU  56   1.312   0.300  -4.280
  415    H    GLN  57           H        GLN  57  -4.052   1.858  -2.854
  416    HA   GLN  57           HA       GLN  57  -5.727   3.253  -2.292
  417   1HB   GLN  57          1HB       GLN  57  -3.628   5.393  -2.638
  418   2HB   GLN  57          2HB       GLN  57  -5.256   5.699  -2.052
  419   1HG   GLN  57          1HG       GLN  57  -4.597   3.809  -0.325
  420   2HG   GLN  57          2HG       GLN  57  -2.972   4.372  -0.711
  421   2HE2  GLN  57          2HE2      GLN  57  -3.362   7.044  -1.062
  422   1HE2  GLN  57          1HE2      GLN  57  -3.871   7.767   0.421
  423    H    ILE  58           H        ILE  58  -6.578   2.443  -4.457
  424    HA   ILE  58           HA       ILE  58  -6.380   4.325  -6.635
  425    HB   ILE  58           HB       ILE  58  -8.321   2.031  -6.476
  426   1HG1  ILE  58          1HG1      ILE  58  -6.228   1.020  -5.914
  427   2HG1  ILE  58          2HG1      ILE  58  -6.514   0.682  -7.617
  428   1HG2  ILE  58          1HG2      ILE  58  -8.416   3.764  -8.316
  429   2HG2  ILE  58          2HG2      ILE  58  -6.865   3.128  -8.865
  430   3HG2  ILE  58          3HG2      ILE  58  -8.285   2.083  -8.834
  431   1HD1  ILE  58          1HD1      ILE  58  -4.988   2.507  -8.215
  432   2HD1  ILE  58          2HD1      ILE  58  -4.680   2.792  -6.502
  433   3HD1  ILE  58          3HD1      ILE  58  -4.202   1.264  -7.241
  434    H    ASN  59           H        ASN  59  -7.305   6.241  -6.014
  435    HA   ASN  59           HA       ASN  59  -9.736   6.422  -4.590
  436   1HB   ASN  59          1HB       ASN  59  -8.031   8.215  -4.649
  437   2HB   ASN  59          2HB       ASN  59  -8.389   8.484  -6.352
  438   2HD2  ASN  59          2HD2      ASN  59  -8.662  10.671  -5.182
  439   1HD2  ASN  59          1HD2      ASN  59 -10.280  11.061  -4.717
  440    H    SER  60           H        SER  60 -11.402   5.322  -5.534
  441    HA   SER  60           HA       SER  60 -11.956   5.301  -8.295
  442   1HB   SER  60          1HB       SER  60 -13.883   4.103  -7.752
  443   2HB   SER  60          2HB       SER  60 -12.823   3.756  -6.386
  444    HG   SER  60           HG       SER  60 -14.858   4.340  -5.628
  445    H    ARG  61           H        ARG  61 -12.321   7.790  -6.031
  446    HA   ARG  61           HA       ARG  61 -14.497   9.055  -7.535
  447   1HB   ARG  61          1HB       ARG  61 -14.278   8.887  -4.901
  448   2HB   ARG  61          2HB       ARG  61 -13.270  10.310  -5.119
  449   1HG   ARG  61          1HG       ARG  61 -15.604  10.730  -6.638
  450   2HG   ARG  61          2HG       ARG  61 -16.113  10.107  -5.066
  451   1HD   ARG  61          1HD       ARG  61 -15.251  11.902  -3.923
  452   2HD   ARG  61          2HD       ARG  61 -14.040  12.242  -5.157
  453    HE   ARG  61           HE       ARG  61 -15.769  13.265  -6.480
  454   1HH1  ARG  61          1HH1      ARG  61 -16.634  12.513  -3.190
  455   2HH1  ARG  61          2HH1      ARG  61 -17.945  13.644  -3.141
  456   1HH2  ARG  61          1HH2      ARG  61 -17.493  14.756  -6.425
  457   2HH2  ARG  61          2HH2      ARG  61 -18.434  14.917  -4.979
  458    H    TRP  62           H        TRP  62 -11.619   8.731  -8.339
  459    HA   TRP  62           HA       TRP  62 -11.300  11.363  -9.444
  460   1HB   TRP  62          1HB       TRP  62 -10.246  11.262  -7.026
  461   2HB   TRP  62          2HB       TRP  62  -8.910  10.499  -7.883
  462    HD1  TRP  62           HD1      TRP  62  -7.381  12.034  -9.373
  463    HE1  TRP  62           HE1      TRP  62  -7.216  14.581  -9.698
  464    HE3  TRP  62           HE3      TRP  62 -11.742  13.428  -7.098
  465    HZ2  TRP  62           HZ2      TRP  62  -8.733  16.879  -9.074
  466    HZ3  TRP  62           HZ3      TRP  62 -12.311  15.820  -7.005
  467    HH2  TRP  62           HH2      TRP  62 -10.836  17.508  -7.972
  468    H    TRP  63           H        TRP  63 -10.558   8.024  -9.404
  469    HA   TRP  63           HA       TRP  63  -8.934   8.388 -11.826
  470   1HB   TRP  63          1HB       TRP  63  -8.485   6.434  -9.564
  471   2HB   TRP  63          2HB       TRP  63  -7.705   6.289 -11.136
  472    HD1  TRP  63           HD1      TRP  63  -6.727   7.349  -7.907
  473    HE1  TRP  63           HE1      TRP  63  -4.956   9.223  -7.967
  474    HE3  TRP  63           HE3      TRP  63  -7.320   8.838 -12.728
  475    HZ2  TRP  63           HZ2      TRP  63  -3.955  11.106  -9.846
  476    HZ3  TRP  63           HZ3      TRP  63  -5.975  10.675 -13.595
  477    HH2  TRP  63           HH2      TRP  63  -4.300  11.793 -12.186
  478    H    CYS  64           H        CYS  64 -10.202   5.557 -10.137
  479    HA   CYS  64           HA       CYS  64 -11.223   4.575 -12.680
  480   1HB   CYS  64          1HB       CYS  64 -11.300   2.432 -11.722
  481   2HB   CYS  64          2HB       CYS  64  -9.886   3.169 -10.980
  482    H    ASN  65           H        ASN  65 -13.292   3.715 -12.973
  483    HA   ASN  65           HA       ASN  65 -15.344   5.278 -11.599
  484   1HB   ASN  65          1HB       ASN  65 -15.277   5.203 -14.090
  485   2HB   ASN  65          2HB       ASN  65 -15.616   3.477 -14.015
  486   2HD2  ASN  65          2HD2      ASN  65 -17.626   3.128 -14.595
  487   1HD2  ASN  65          1HD2      ASN  65 -19.004   4.047 -14.103
  488    H    ASP  66           H        ASP  66 -16.011   4.372  -9.756
  489    HA   ASP  66           HA       ASP  66 -16.351   1.471  -9.609
  490   1HB   ASP  66          1HB       ASP  66 -16.483   1.739  -7.226
  491   2HB   ASP  66          2HB       ASP  66 -15.125   2.700  -7.802
  492    H    GLY  67           H        GLY  67 -18.184   4.350  -9.962
  493   1HA   GLY  67          1HA       GLY  67 -20.611   2.861 -10.268
  494   2HA   GLY  67          2HA       GLY  67 -20.436   4.604 -10.398
  495    H    ARG  68           H        ARG  68 -19.171   3.386  -7.500
  496    HA   ARG  68           HA       ARG  68 -21.673   3.528  -6.037
  497   1HB   ARG  68          1HB       ARG  68 -18.889   2.679  -5.434
  498   2HB   ARG  68          2HB       ARG  68 -19.860   3.256  -4.088
  499   1HG   ARG  68          1HG       ARG  68 -21.399   1.423  -5.651
  500   2HG   ARG  68          2HG       ARG  68 -19.844   0.696  -5.239
  501   1HD   ARG  68          1HD       ARG  68 -20.800   0.178  -3.286
  502   2HD   ARG  68          2HD       ARG  68 -20.581   1.881  -2.883
  503    HE   ARG  68           HE       ARG  68 -22.951   1.934  -4.103
  504   1HH1  ARG  68          1HH1      ARG  68 -21.697  -0.203  -1.653
  505   2HH1  ARG  68          2HH1      ARG  68 -23.246  -0.502  -0.940
  506   1HH2  ARG  68          1HH2      ARG  68 -24.993   1.546  -3.170
  507   2HH2  ARG  68          2HH2      ARG  68 -25.120   0.491  -1.802
  508    H    THR  69           H        THR  69 -19.606   5.773  -7.211
  509    HA   THR  69           HA       THR  69 -20.421   7.719  -5.183
  510    HB   THR  69           HB       THR  69 -17.632   7.930  -6.239
  511    HG1  THR  69           HG1      THR  69 -17.889   5.790  -5.309
  512   1HG2  THR  69          1HG2      THR  69 -19.255   9.033  -4.023
  513   2HG2  THR  69          2HG2      THR  69 -17.551   8.735  -3.680
  514   3HG2  THR  69          3HG2      THR  69 -18.010   9.801  -5.008
  515    HA   PRO  70           HA       PRO  70 -21.406   9.725  -9.080
  516   1HB   PRO  70          1HB       PRO  70 -22.626  11.893  -8.002
  517   2HB   PRO  70          2HB       PRO  70 -23.413  10.314  -8.122
  518   1HG   PRO  70          1HG       PRO  70 -22.058  11.582  -5.771
  519   2HG   PRO  70          2HG       PRO  70 -23.588  10.687  -5.832
  520   1HD   PRO  70          1HD       PRO  70 -21.273   9.564  -4.985
  521   2HD   PRO  70          2HD       PRO  70 -22.533   8.637  -5.826
  522    H    GLY  71           H        GLY  71 -20.348  11.204 -10.296
  523   1HA   GLY  71          1HA       GLY  71 -18.771  13.281  -8.947
  524   2HA   GLY  71          2HA       GLY  71 -19.225  13.276 -10.645
  525    H    SER  72           H        SER  72 -18.373  10.266 -10.458
  526    HA   SER  72           HA       SER  72 -15.597  10.211 -10.040
  527   1HB   SER  72          1HB       SER  72 -16.914   8.163 -10.079
  528   2HB   SER  72          2HB       SER  72 -17.332   8.434 -11.771
  529    HG   SER  72           HG       SER  72 -14.665   8.159 -10.858
  530    H    ARG  73           H        ARG  73 -13.946  10.885 -11.228
  531    HA   ARG  73           HA       ARG  73 -14.411  12.272 -13.696
  532   1HB   ARG  73          1HB       ARG  73 -12.096  11.824 -11.887
  533   2HB   ARG  73          2HB       ARG  73 -11.737  12.220 -13.562
  534   1HG   ARG  73          1HG       ARG  73 -13.385  14.178 -13.206
  535   2HG   ARG  73          2HG       ARG  73 -13.123  13.867 -11.489
  536   1HD   ARG  73          1HD       ARG  73 -10.954  14.565 -11.551
  537   2HD   ARG  73          2HD       ARG  73 -10.727  14.061 -13.227
  538    HE   ARG  73           HE       ARG  73 -12.302  16.450 -12.527
  539   1HH1  ARG  73          1HH1      ARG  73  -9.761  14.883 -14.322
  540   2HH1  ARG  73          2HH1      ARG  73  -9.427  16.268 -15.307
  541   1HH2  ARG  73          1HH2      ARG  73 -11.870  18.279 -13.819
  542   2HH2  ARG  73          2HH2      ARG  73 -10.626  18.199 -15.021
  543    H    ASN  74           H        ASN  74 -12.805   9.269 -12.747
  544    HA   ASN  74           HA       ASN  74 -12.246   7.383 -13.914
  545   1HB   ASN  74          1HB       ASN  74 -14.621   7.972 -14.939
  546   2HB   ASN  74          2HB       ASN  74 -13.669   8.358 -16.370
  547   2HD2  ASN  74          2HD2      ASN  74 -14.433   6.684 -17.592
  548   1HD2  ASN  74          1HD2      ASN  74 -14.062   5.028 -17.269
  549    H    LEU  75           H        LEU  75 -10.642   9.762 -13.938
  550    HA   LEU  75           HA       LEU  75  -9.507  10.533 -16.327
  551   1HB   LEU  75          1HB       LEU  75  -8.707  10.248 -13.504
  552   2HB   LEU  75          2HB       LEU  75  -7.393  10.403 -14.646
  553    HG   LEU  75           HG       LEU  75  -9.702  12.342 -14.306
  554   1HD1  LEU  75          1HD1      LEU  75  -8.176  12.312 -12.375
  555   2HD1  LEU  75          2HD1      LEU  75  -6.824  12.651 -13.456
  556   3HD1  LEU  75          3HD1      LEU  75  -8.114  13.837 -13.259
  557   1HD2  LEU  75          1HD2      LEU  75  -7.274  12.372 -16.082
  558   2HD2  LEU  75          2HD2      LEU  75  -8.971  12.536 -16.534
  559   3HD2  LEU  75          3HD2      LEU  75  -8.160  13.840 -15.668
  560    H    CYS  76           H        CYS  76  -8.547   8.085 -14.126
  561    HA   CYS  76           HA       CYS  76  -6.522   6.879 -15.667
  562   1HB   CYS  76          1HB       CYS  76  -7.443   6.840 -13.106
  563   2HB   CYS  76          2HB       CYS  76  -7.932   5.257 -13.690
  564    H    ASN  77           H        ASN  77  -9.948   6.422 -15.282
  565    HA   ASN  77           HA       ASN  77 -11.505   5.095 -16.303
  566   1HB   ASN  77          1HB       ASN  77 -10.348   6.399 -18.261
  567   2HB   ASN  77          2HB       ASN  77  -9.667   4.826 -18.662
  568   2HD2  ASN  77          2HD2      ASN  77 -11.968   6.820 -19.564
  569   1HD2  ASN  77          1HD2      ASN  77 -13.210   5.717 -20.035
  570    H    ILE  78           H        ILE  78 -10.193   3.693 -14.545
  571    HA   ILE  78           HA       ILE  78  -9.479   1.193 -15.900
  572    HB   ILE  78           HB       ILE  78  -7.725   0.837 -14.551
  573   1HG1  ILE  78          1HG1      ILE  78  -9.594   1.736 -12.446
  574   2HG1  ILE  78          2HG1      ILE  78  -8.469   0.386 -12.447
  575   1HG2  ILE  78          1HG2      ILE  78  -7.619   3.217 -15.451
  576   2HG2  ILE  78          2HG2      ILE  78  -7.970   3.728 -13.799
  577   3HG2  ILE  78          3HG2      ILE  78  -6.513   2.796 -14.143
  578   1HD1  ILE  78          1HD1      ILE  78  -6.639   2.095 -12.088
  579   2HD1  ILE  78          2HD1      ILE  78  -7.928   3.258 -11.775
  580   3HD1  ILE  78          3HD1      ILE  78  -7.754   1.835 -10.747
  581    HA   PRO  79           HA       PRO  79 -12.751  -0.720 -13.596
  582   1HB   PRO  79          1HB       PRO  79 -11.466  -3.294 -13.638
  583   2HB   PRO  79          2HB       PRO  79 -12.773  -2.717 -14.671
  584   1HG   PRO  79          1HG       PRO  79 -10.223  -3.268 -15.551
  585   2HG   PRO  79          2HG       PRO  79 -11.352  -2.173 -16.367
  586   1HD   PRO  79          1HD       PRO  79  -9.057  -1.532 -14.560
  587   2HD   PRO  79          2HD       PRO  79  -9.618  -0.686 -16.019
  588    H    CYS  80           H        CYS  80 -12.852  -0.241 -11.467
  589    HA   CYS  80           HA       CYS  80 -10.728  -0.420  -9.666
  590   1HB   CYS  80          1HB       CYS  80 -13.596  -0.576  -8.788
  591   2HB   CYS  80          2HB       CYS  80 -12.245   0.246  -8.012
  592    H    SER  81           H        SER  81 -13.617  -2.534  -9.794
  593    HA   SER  81           HA       SER  81 -12.780  -4.372  -7.899
  594   1HB   SER  81          1HB       SER  81 -14.274  -5.991  -9.331
  595   2HB   SER  81          2HB       SER  81 -15.004  -4.617  -8.496
  596    HG   SER  81           HG       SER  81 -15.238  -5.125 -10.996
  597    H    ALA  82           H        ALA  82 -11.668  -3.995 -11.165
  598    HA   ALA  82           HA       ALA  82 -10.646  -6.648 -11.479
  599   1HB   ALA  82          1HB       ALA  82 -11.206  -5.172 -13.383
  600   2HB   ALA  82          2HB       ALA  82  -9.570  -5.823 -13.467
  601   3HB   ALA  82          3HB       ALA  82  -9.829  -4.154 -12.961
  602    H    LEU  83           H        LEU  83  -9.664  -4.071  -9.605
  603    HA   LEU  83           HA       LEU  83  -6.846  -4.910  -9.623
  604   1HB   LEU  83          1HB       LEU  83  -6.233  -2.821  -8.874
  605   2HB   LEU  83          2HB       LEU  83  -7.613  -2.437  -9.885
  606    HG   LEU  83           HG       LEU  83  -8.800  -2.764  -7.443
  607   1HD1  LEU  83          1HD1      LEU  83  -6.007  -2.395  -6.951
  608   2HD1  LEU  83          2HD1      LEU  83  -6.902  -0.988  -6.376
  609   3HD1  LEU  83          3HD1      LEU  83  -7.325  -2.600  -5.798
  610   1HD2  LEU  83          1HD2      LEU  83  -9.139  -0.953  -9.087
  611   2HD2  LEU  83          2HD2      LEU  83  -9.010  -0.358  -7.432
  612   3HD2  LEU  83          3HD2      LEU  83  -7.642  -0.203  -8.534
  613    H    LEU  84           H        LEU  84  -9.718  -5.270  -7.932
  614    HA   LEU  84           HA       LEU  84  -8.323  -5.889  -5.422
  615   1HB   LEU  84          1HB       LEU  84 -11.295  -5.708  -5.644
  616   2HB   LEU  84          2HB       LEU  84 -10.259  -5.369  -4.269
  617    HG   LEU  84           HG       LEU  84 -10.003  -3.611  -6.648
  618   1HD1  LEU  84          1HD1      LEU  84 -12.429  -3.844  -6.364
  619   2HD1  LEU  84          2HD1      LEU  84 -12.267  -3.365  -4.676
  620   3HD1  LEU  84          3HD1      LEU  84 -11.863  -2.224  -5.958
  621   1HD2  LEU  84          1HD2      LEU  84  -8.707  -3.564  -4.386
  622   2HD2  LEU  84          2HD2      LEU  84  -9.239  -2.057  -5.133
  623   3HD2  LEU  84          3HD2      LEU  84 -10.155  -2.748  -3.795
  624    H    SER  85           H        SER  85  -8.136  -7.678  -7.547
  625    HA   SER  85           HA       SER  85  -9.660  -9.944  -6.471
  626   1HB   SER  85          1HB       SER  85  -9.597  -8.962  -9.215
  627   2HB   SER  85          2HB       SER  85  -9.112 -10.654  -9.107
  628    HG   SER  85           HG       SER  85 -11.570  -9.534  -8.806
  629    H    SER  86           H        SER  86  -7.187  -9.039  -5.712
  630    HA   SER  86           HA       SER  86  -5.184  -9.896  -5.023
  631   1HB   SER  86          1HB       SER  86  -5.705 -12.332  -6.742
  632   2HB   SER  86          2HB       SER  86  -4.654 -12.205  -5.330
  633    HG   SER  86           HG       SER  86  -7.476 -12.243  -5.437
  634    H    ASP  87           H        ASP  87  -5.911  -8.495  -7.528
  635    HA   ASP  87           HA       ASP  87  -3.453  -8.974  -9.067
  636   1HB   ASP  87          1HB       ASP  87  -5.686  -9.604 -10.092
  637   2HB   ASP  87          2HB       ASP  87  -6.064  -7.888 -10.093
  638    H    ILE  88           H        ILE  88  -2.062  -7.312  -8.828
  639    HA   ILE  88           HA       ILE  88  -3.075  -4.701  -8.043
  640    HB   ILE  88           HB       ILE  88  -0.456  -4.238  -8.225
  641   1HG1  ILE  88          1HG1      ILE  88  -0.419  -7.102  -7.335
  642   2HG1  ILE  88          2HG1      ILE  88  -0.262  -6.712  -9.046
  643   1HG2  ILE  88          1HG2      ILE  88  -2.200  -5.268  -6.089
  644   2HG2  ILE  88          2HG2      ILE  88  -0.466  -5.326  -5.776
  645   3HG2  ILE  88          3HG2      ILE  88  -1.240  -3.791  -6.165
  646   1HD1  ILE  88          1HD1      ILE  88   1.497  -5.168  -7.296
  647   2HD1  ILE  88          2HD1      ILE  88   1.797  -6.906  -7.292
  648   3HD1  ILE  88          3HD1      ILE  88   1.842  -6.007  -8.809
  649    H    THR  89           H        THR  89  -2.486  -6.285 -10.913
  650    HA   THR  89           HA       THR  89  -1.114  -4.589 -12.547
  651    HB   THR  89           HB       THR  89  -3.700  -5.802 -13.485
  652    HG1  THR  89           HG1      THR  89  -1.282  -7.106 -12.765
  653   1HG2  THR  89          1HG2      THR  89  -1.464  -4.576 -14.733
  654   2HG2  THR  89          2HG2      THR  89  -2.880  -5.303 -15.493
  655   3HG2  THR  89          3HG2      THR  89  -1.453  -6.286 -15.165
  656    H    ALA  90           H        ALA  90  -4.642  -4.412 -11.988
  657    HA   ALA  90           HA       ALA  90  -5.033  -2.086 -13.437
  658   1HB   ALA  90          1HB       ALA  90  -6.603  -3.749 -11.645
  659   2HB   ALA  90          2HB       ALA  90  -7.065  -2.048 -11.614
  660   3HB   ALA  90          3HB       ALA  90  -7.069  -2.934 -13.138
  661    H    SER  91           H        SER  91  -4.490  -2.554  -9.959
  662    HA   SER  91           HA       SER  91  -4.798   0.154  -9.217
  663   1HB   SER  91          1HB       SER  91  -2.970  -1.014  -7.426
  664   2HB   SER  91          2HB       SER  91  -4.714  -0.854  -7.217
  665    HG   SER  91           HG       SER  91  -4.418  -2.986  -7.093
  666    H    VAL  92           H        VAL  92  -2.074  -1.675 -10.381
  667    HA   VAL  92           HA       VAL  92  -0.203   0.412  -9.804
  668    HB   VAL  92           HB       VAL  92   0.115  -2.027 -11.550
  669   1HG1  VAL  92          1HG1      VAL  92   2.031   0.218 -10.923
  670   2HG1  VAL  92          2HG1      VAL  92   2.580  -1.372 -11.451
  671   3HG1  VAL  92          3HG1      VAL  92   1.553  -0.399 -12.503
  672   1HG2  VAL  92          1HG2      VAL  92  -0.040  -2.395  -9.100
  673   2HG2  VAL  92          2HG2      VAL  92   1.528  -2.847  -9.770
  674   3HG2  VAL  92          3HG2      VAL  92   1.350  -1.332  -8.883
  675    H    ASN  93           H        ASN  93  -1.660  -0.813 -12.826
  676    HA   ASN  93           HA       ASN  93  -0.531   0.814 -14.616
  677   1HB   ASN  93          1HB       ASN  93  -1.998  -0.225 -15.897
  678   2HB   ASN  93          2HB       ASN  93  -2.851  -0.745 -14.467
  679   2HD2  ASN  93          2HD2      ASN  93  -2.714   1.583 -17.024
  680   1HD2  ASN  93          1HD2      ASN  93  -4.285   2.257 -16.777
  681    H    CYS  94           H        CYS  94  -3.128   1.575 -12.412
  682    HA   CYS  94           HA       CYS  94  -3.629   4.189 -13.348
  683   1HB   CYS  94          1HB       CYS  94  -4.956   2.630 -11.666
  684   2HB   CYS  94          2HB       CYS  94  -4.026   3.526 -10.468
  685    H    ALA  95           H        ALA  95  -1.607   2.970 -10.669
  686    HA   ALA  95           HA       ALA  95  -0.687   5.567  -9.950
  687   1HB   ALA  95          1HB       ALA  95  -0.110   4.445  -8.165
  688   2HB   ALA  95          2HB       ALA  95   1.245   3.787  -9.081
  689   3HB   ALA  95          3HB       ALA  95  -0.280   2.904  -9.004
  690    H    LYS  96           H        LYS  96   0.569   3.061 -12.092
  691    HA   LYS  96           HA       LYS  96   3.105   4.015 -12.582
  692   1HB   LYS  96          1HB       LYS  96   1.523   2.061 -13.688
  693   2HB   LYS  96          2HB       LYS  96   1.629   3.218 -15.008
  694   1HG   LYS  96          1HG       LYS  96   4.218   3.091 -14.292
  695   2HG   LYS  96          2HG       LYS  96   3.691   1.465 -13.852
  696   1HD   LYS  96          1HD       LYS  96   2.760   2.422 -16.474
  697   2HD   LYS  96          2HD       LYS  96   4.503   2.189 -16.334
  698   1HE   LYS  96          1HE       LYS  96   4.281  -0.021 -16.435
  699   2HE   LYS  96          2HE       LYS  96   3.090  -0.012 -15.136
  700   1HZ   LYS  96          1HZ       LYS  96   2.340   0.729 -17.894
  701   2HZ   LYS  96          2HZ       LYS  96   2.382  -0.891 -17.408
  702   3HZ   LYS  96          3HZ       LYS  96   1.346   0.198 -16.634
  703    H    LYS  97           H        LYS  97  -0.016   4.954 -13.648
  704    HA   LYS  97           HA       LYS  97   0.841   7.102 -15.389
  705   1HB   LYS  97          1HB       LYS  97  -1.319   5.722 -15.626
  706   2HB   LYS  97          2HB       LYS  97  -1.952   6.723 -14.327
  707   1HG   LYS  97          1HG       LYS  97  -1.115   8.669 -15.913
  708   2HG   LYS  97          2HG       LYS  97  -1.344   7.422 -17.143
  709   1HD   LYS  97          1HD       LYS  97  -3.622   7.223 -15.599
  710   2HD   LYS  97          2HD       LYS  97  -3.316   8.961 -15.651
  711   1HE   LYS  97          1HE       LYS  97  -2.962   7.684 -18.238
  712   2HE   LYS  97          2HE       LYS  97  -4.587   7.460 -17.592
  713   1HZ   LYS  97          1HZ       LYS  97  -3.213  10.077 -17.882
  714   2HZ   LYS  97          2HZ       LYS  97  -4.390   9.476 -18.936
  715   3HZ   LYS  97          3HZ       LYS  97  -4.796   9.837 -17.335
  716    H    ILE  98           H        ILE  98  -0.202   6.682 -12.084
  717    HA   ILE  98           HA       ILE  98  -0.705   9.371 -11.467
  718    HB   ILE  98           HB       ILE  98   0.114   7.089  -9.701
  719   1HG1  ILE  98          1HG1      ILE  98  -2.528   8.553  -9.943
  720   2HG1  ILE  98          2HG1      ILE  98  -2.155   7.073 -10.817
  721   1HG2  ILE  98          1HG2      ILE  98  -0.407   9.959  -9.040
  722   2HG2  ILE  98          2HG2      ILE  98  -0.789   8.689  -7.877
  723   3HG2  ILE  98          3HG2      ILE  98   0.866   8.890  -8.452
  724   1HD1  ILE  98          1HD1      ILE  98  -1.672   6.094  -8.478
  725   2HD1  ILE  98          2HD1      ILE  98  -2.594   7.479  -7.893
  726   3HD1  ILE  98          3HD1      ILE  98  -3.344   6.319  -8.990
  727    H    VAL  99           H        VAL  99   2.167   7.384 -11.028
  728    HA   VAL  99           HA       VAL  99   3.807   9.515 -10.095
  729    HB   VAL  99           HB       VAL  99   4.127   6.992  -9.707
  730   1HG1  VAL  99          1HG1      VAL  99   4.202   6.545 -12.214
  731   2HG1  VAL  99          2HG1      VAL  99   5.839   7.198 -12.166
  732   3HG1  VAL  99          3HG1      VAL  99   5.434   5.763 -11.224
  733   1HG2  VAL  99          1HG2      VAL  99   5.621   8.824  -8.936
  734   2HG2  VAL  99          2HG2      VAL  99   6.461   7.308  -9.259
  735   3HG2  VAL  99          3HG2      VAL  99   6.551   8.631 -10.422
  736    H    SER 100           H        SER 100   2.900   8.364 -13.225
  737    HA   SER 100           HA       SER 100   5.129   9.677 -14.559
  738   1HB   SER 100          1HB       SER 100   4.012   7.497 -15.350
  739   2HB   SER 100          2HB       SER 100   2.689   8.522 -15.906
  740    HG   SER 100           HG       SER 100   3.957   9.375 -17.420
  741    H    ASP 101           H        ASP 101   2.181  10.518 -13.269
  742    HA   ASP 101           HA       ASP 101   1.433  12.539 -15.189
  743   1HB   ASP 101          1HB       ASP 101   0.197  11.247 -12.970
  744   2HB   ASP 101          2HB       ASP 101   0.170  12.982 -12.669
  745    H    GLY 102           H        GLY 102   3.795  12.332 -12.875
  746   1HA   GLY 102          1HA       GLY 102   3.791  15.258 -12.450
  747   2HA   GLY 102          2HA       GLY 102   5.247  14.384 -12.894
  748    H    ASN 103           H        ASN 103   3.603  12.362 -10.904
  749    HA   ASN 103           HA       ASN 103   4.150  13.512  -8.356
  750   1HB   ASN 103          1HB       ASN 103   3.121  10.945  -9.378
  751   2HB   ASN 103          2HB       ASN 103   3.950  10.855  -7.826
  752   2HD2  ASN 103          2HD2      ASN 103   1.023  11.129  -9.144
  753   1HD2  ASN 103          1HD2      ASN 103   0.204  12.026  -7.917
  754    H    GLY 104           H        GLY 104   5.323  10.892  -7.313
  755   1HA   GLY 104          1HA       GLY 104   8.065  11.741  -7.528
  756   2HA   GLY 104          2HA       GLY 104   7.737  10.201  -8.312
  757    H    MET 105           H        MET 105   5.700   9.407  -6.399
  758    HA   MET 105           HA       MET 105   5.688   7.934  -4.648
  759   1HB   MET 105          1HB       MET 105   8.486   8.872  -3.986
  760   2HB   MET 105          2HB       MET 105   7.656   7.481  -3.304
  761   1HG   MET 105          1HG       MET 105   8.860   7.831  -6.006
  762   2HG   MET 105          2HG       MET 105   9.056   6.516  -4.850
  763   1HE   MET 105          1HE       MET 105   6.308   6.010  -3.926
  764   2HE   MET 105          2HE       MET 105   5.327   5.088  -5.065
  765   3HE   MET 105          3HE       MET 105   6.912   4.487  -4.579
  766    H    ASN 106           H        ASN 106   5.616  11.075  -4.809
  767    HA   ASN 106           HA       ASN 106   5.594  11.698  -1.971
  768   1HB   ASN 106          1HB       ASN 106   5.655  13.220  -4.515
  769   2HB   ASN 106          2HB       ASN 106   4.848  13.984  -3.158
  770   2HD2  ASN 106          2HD2      ASN 106   7.817  12.173  -3.844
  771   1HD2  ASN 106          1HD2      ASN 106   8.856  13.182  -2.903
  772    H    ALA 107           H        ALA 107   3.413  11.135  -4.633
  773    HA   ALA 107           HA       ALA 107   1.082  12.335  -3.731
  774   1HB   ALA 107          1HB       ALA 107   1.718  10.070  -5.514
  775   2HB   ALA 107          2HB       ALA 107   0.073  10.123  -4.879
  776   3HB   ALA 107          3HB       ALA 107   0.710  11.489  -5.795
  777    H    TRP 108           H        TRP 108   2.451   9.190  -2.921
  778    HA   TRP 108           HA       TRP 108   0.291   8.562  -1.109
  779   1HB   TRP 108          1HB       TRP 108   2.904   7.106  -1.575
  780   2HB   TRP 108          2HB       TRP 108   1.490   6.472  -0.735
  781    HD1  TRP 108           HD1      TRP 108  -0.524   5.591  -2.209
  782    HE1  TRP 108           HE1      TRP 108  -0.792   5.116  -4.725
  783    HE3  TRP 108           HE3      TRP 108   3.677   7.942  -3.935
  784    HZ2  TRP 108           HZ2      TRP 108   0.589   5.666  -7.133
  785    HZ3  TRP 108           HZ3      TRP 108   4.130   7.921  -6.353
  786    HH2  TRP 108           HH2      TRP 108   2.621   6.805  -7.914
  787    H    VAL 109           H        VAL 109   0.189   9.221   0.902
  788    HA   VAL 109           HA       VAL 109   2.229  10.753   2.130
  789    HB   VAL 109           HB       VAL 109   0.198   9.712   3.884
  790   1HG1  VAL 109          1HG1      VAL 109   1.078  12.480   3.124
  791   2HG1  VAL 109          2HG1      VAL 109  -0.072  12.107   4.408
  792   3HG1  VAL 109          3HG1      VAL 109   1.599  11.558   4.535
  793   1HG2  VAL 109          1HG2      VAL 109  -0.595  11.291   1.453
  794   2HG2  VAL 109          2HG2      VAL 109  -1.155   9.681   1.904
  795   3HG2  VAL 109          3HG2      VAL 109  -1.618  11.079   2.874
  796    H    ALA 110           H        ALA 110   1.447   7.379   2.281
  797    HA   ALA 110           HA       ALA 110   2.651   6.836   4.789
  798   1HB   ALA 110          1HB       ALA 110   2.620   4.786   2.626
  799   2HB   ALA 110          2HB       ALA 110   2.263   4.618   4.346
  800   3HB   ALA 110          3HB       ALA 110   1.087   5.373   3.270
  801    H    TRP 111           H        TRP 111   3.909   7.482   1.673
  802    HA   TRP 111           HA       TRP 111   6.485   6.278   2.235
  803   1HB   TRP 111          1HB       TRP 111   5.654   6.221  -0.063
  804   2HB   TRP 111          2HB       TRP 111   5.584   7.975  -0.102
  805    HD1  TRP 111           HD1      TRP 111   7.968   5.073  -0.503
  806    HE1  TRP 111           HE1      TRP 111  10.268   5.953  -1.252
  807    HE3  TRP 111           HE3      TRP 111   7.179  10.083   0.150
  808    HZ2  TRP 111           HZ2      TRP 111  11.575   8.437  -1.530
  809    HZ3  TRP 111           HZ3      TRP 111   9.006  11.643  -0.380
  810    HH2  TRP 111           HH2      TRP 111  11.158  10.835  -1.202
  811    H    ARG 112           H        ARG 112   5.006   9.508   2.170
  812    HA   ARG 112           HA       ARG 112   7.550  10.731   2.894
  813   1HB   ARG 112          1HB       ARG 112   5.042  11.605   1.721
  814   2HB   ARG 112          2HB       ARG 112   5.577  12.663   3.017
  815   1HG   ARG 112          1HG       ARG 112   7.597  11.880   1.003
  816   2HG   ARG 112          2HG       ARG 112   6.329  12.993   0.488
  817   1HD   ARG 112          1HD       ARG 112   7.220  13.877   3.013
  818   2HD   ARG 112          2HD       ARG 112   8.660  13.513   2.063
  819    HE   ARG 112           HE       ARG 112   7.393  14.968   0.309
  820   1HH1  ARG 112          1HH1      ARG 112   7.550  15.471   3.753
  821   2HH1  ARG 112          2HH1      ARG 112   7.381  17.191   3.639
  822   1HH2  ARG 112          1HH2      ARG 112   7.171  17.231   0.150
  823   2HH2  ARG 112          2HH2      ARG 112   7.165  18.191   1.591
  824    H    ASN 113           H        ASN 113   6.704   8.973   4.793
  825    HA   ASN 113           HA       ASN 113   6.348  10.728   7.063
  826   1HB   ASN 113          1HB       ASN 113   4.050   9.668   6.014
  827   2HB   ASN 113          2HB       ASN 113   4.471   8.475   7.239
  828   2HD2  ASN 113          2HD2      ASN 113   3.463   8.828   9.066
  829   1HD2  ASN 113          1HD2      ASN 113   3.105  10.370   9.758
  830    H    ARG 114           H        ARG 114   6.028   7.268   6.320
  831    HA   ARG 114           HA       ARG 114   7.877   6.687   8.519
  832   1HB   ARG 114          1HB       ARG 114   5.646   5.230   7.216
  833   2HB   ARG 114          2HB       ARG 114   6.981   4.267   7.823
  834   1HG   ARG 114          1HG       ARG 114   5.710   6.316   9.581
  835   2HG   ARG 114          2HG       ARG 114   4.933   4.749   9.341
  836   1HD   ARG 114          1HD       ARG 114   6.213   4.174  11.113
  837   2HD   ARG 114          2HD       ARG 114   7.430   3.929   9.861
  838    HE   ARG 114           HE       ARG 114   7.245   6.506  11.261
  839   1HH1  ARG 114          1HH1      ARG 114   9.021   3.627  10.422
  840   2HH1  ARG 114          2HH1      ARG 114  10.527   4.223  11.036
  841   1HH2  ARG 114          1HH2      ARG 114   9.223   7.298  12.070
  842   2HH2  ARG 114          2HH2      ARG 114  10.643   6.309  11.973
  843    H    CYS 115           H        CYS 115   8.053   7.192   5.294
  844    HA   CYS 115           HA       CYS 115  10.148   5.155   4.934
  845   1HB   CYS 115          1HB       CYS 115   8.089   5.142   3.405
  846   2HB   CYS 115          2HB       CYS 115   8.778   6.592   2.678
  847    H    LYS 116           H        LYS 116   9.312   8.523   4.113
  848    HA   LYS 116           HA       LYS 116  11.677   9.282   2.921
  849   1HB   LYS 116          1HB       LYS 116   9.438  10.581   3.390
  850   2HB   LYS 116          2HB       LYS 116  10.314  11.173   4.795
  851   1HG   LYS 116          1HG       LYS 116  11.733  11.335   2.214
  852   2HG   LYS 116          2HG       LYS 116  10.335  12.393   2.413
  853   1HD   LYS 116          1HD       LYS 116  12.223  12.282   4.681
  854   2HD   LYS 116          2HD       LYS 116  12.819  13.049   3.208
  855   1HE   LYS 116          1HE       LYS 116  10.207  13.764   4.526
  856   2HE   LYS 116          2HE       LYS 116  11.726  14.597   4.856
  857   1HZ   LYS 116          1HZ       LYS 116  11.328  14.446   2.073
  858   2HZ   LYS 116          2HZ       LYS 116   9.933  15.081   2.787
  859   3HZ   LYS 116          3HZ       LYS 116  11.431  15.821   3.052
  860    H    GLY 117           H        GLY 117  13.551   8.523   3.815
  861   1HA   GLY 117          1HA       GLY 117  14.169   9.493   6.537
  862   2HA   GLY 117          2HA       GLY 117  15.331   9.561   5.222
  863    H    THR 118           H        THR 118  13.927   6.751   4.561
  864    HA   THR 118           HA       THR 118  15.638   5.236   6.419
  865    HB   THR 118           HB       THR 118  14.131   3.334   6.143
  866    HG1  THR 118           HG1      THR 118  11.999   4.459   5.041
  867   1HG2  THR 118          1HG2      THR 118  12.767   5.908   6.929
  868   2HG2  THR 118          2HG2      THR 118  12.096   4.306   7.233
  869   3HG2  THR 118          3HG2      THR 118  13.619   4.782   7.985
  870    H    ASP 119           H        ASP 119  15.096   2.783   4.818
  871    HA   ASP 119           HA       ASP 119  16.589   3.384   2.380
  872   1HB   ASP 119          1HB       ASP 119  17.945   2.508   4.418
  873   2HB   ASP 119          2HB       ASP 119  17.310   0.977   3.866
  874    H    VAL 120           H        VAL 120  15.116   2.884   0.880
  875    HA   VAL 120           HA       VAL 120  13.297   0.699   1.124
  876    HB   VAL 120           HB       VAL 120  12.679   1.235  -1.217
  877   1HG1  VAL 120          1HG1      VAL 120  11.692   2.415   0.742
  878   2HG1  VAL 120          2HG1      VAL 120  12.866   3.708   0.495
  879   3HG1  VAL 120          3HG1      VAL 120  11.668   3.355  -0.750
  880   1HG2  VAL 120          1HG2      VAL 120  15.184   2.133  -1.541
  881   2HG2  VAL 120          2HG2      VAL 120  13.839   2.640  -2.562
  882   3HG2  VAL 120          3HG2      VAL 120  14.366   3.663  -1.225
  883    H    GLN 121           H        GLN 121  16.411   1.236  -0.369
  884    HA   GLN 121           HA       GLN 121  16.483  -0.972  -2.098
  885   1HB   GLN 121          1HB       GLN 121  18.545   0.702  -0.725
  886   2HB   GLN 121          2HB       GLN 121  19.058  -0.805  -1.471
  887   1HG   GLN 121          1HG       GLN 121  19.401   0.699  -3.167
  888   2HG   GLN 121          2HG       GLN 121  17.789   0.095  -3.549
  889   2HE2  GLN 121          2HE2      GLN 121  16.600   1.685  -4.304
  890   1HE2  GLN 121          1HE2      GLN 121  16.523   3.292  -3.675
  891    H    ALA 122           H        ALA 122  16.634  -0.686   1.310
  892    HA   ALA 122           HA       ALA 122  17.701  -3.363   1.710
  893   1HB   ALA 122          1HB       ALA 122  18.117  -1.208   3.166
  894   2HB   ALA 122          2HB       ALA 122  18.016  -2.803   3.911
  895   3HB   ALA 122          3HB       ALA 122  16.623  -1.722   3.949
  896    H    TRP 123           H        TRP 123  14.679  -1.714   1.476
  897    HA   TRP 123           HA       TRP 123  13.057  -3.442   3.006
  898   1HB   TRP 123          1HB       TRP 123  12.589  -1.472   0.828
  899   2HB   TRP 123          2HB       TRP 123  11.310  -2.638   1.148
  900    HD1  TRP 123           HD1      TRP 123  11.738   0.706   1.876
  901    HE1  TRP 123           HE1      TRP 123  10.881   1.409   4.200
  902    HE3  TRP 123           HE3      TRP 123  11.505  -3.868   4.114
  903    HZ2  TRP 123           HZ2      TRP 123  10.207   0.154   6.625
  904    HZ3  TRP 123           HZ3      TRP 123  10.746  -4.040   6.428
  905    HH2  TRP 123           HH2      TRP 123  10.103  -2.046   7.671
  906    H    ILE 124           H        ILE 124  14.673  -3.918   0.045
  907    HA   ILE 124           HA       ILE 124  13.143  -6.397  -0.408
  908    HB   ILE 124           HB       ILE 124  13.789  -6.181  -2.827
  909   1HG1  ILE 124          1HG1      ILE 124  14.008  -3.317  -2.847
  910   2HG1  ILE 124          2HG1      ILE 124  15.274  -3.989  -1.824
  911   1HG2  ILE 124          1HG2      ILE 124  11.558  -5.522  -1.730
  912   2HG2  ILE 124          2HG2      ILE 124  12.087  -3.860  -1.997
  913   3HG2  ILE 124          3HG2      ILE 124  11.888  -4.954  -3.367
  914   1HD1  ILE 124          1HD1      ILE 124  14.902  -5.330  -4.409
  915   2HD1  ILE 124          2HD1      ILE 124  15.485  -3.668  -4.485
  916   3HD1  ILE 124          3HD1      ILE 124  16.380  -4.875  -3.562
  917    H    ARG 125           H        ARG 125  15.824  -5.466   0.914
  918    HA   ARG 125           HA       ARG 125  17.897  -6.765  -0.516
  919   1HB   ARG 125          1HB       ARG 125  18.039  -5.010   1.391
  920   2HB   ARG 125          2HB       ARG 125  17.926  -6.398   2.464
  921   1HG   ARG 125          1HG       ARG 125  19.917  -6.740   0.369
  922   2HG   ARG 125          2HG       ARG 125  20.234  -5.355   1.416
  923   1HD   ARG 125          1HD       ARG 125  19.614  -7.153   3.285
  924   2HD   ARG 125          2HD       ARG 125  20.211  -8.251   2.042
  925    HE   ARG 125           HE       ARG 125  21.752  -6.265   3.513
  926   1HH1  ARG 125          1HH1      ARG 125  21.629  -8.617   0.944
  927   2HH1  ARG 125          2HH1      ARG 125  23.351  -8.764   0.823
  928   1HH2  ARG 125          1HH2      ARG 125  24.019  -6.453   3.361
  929   2HH2  ARG 125          2HH2      ARG 125  24.709  -7.535   2.197
  930    H    GLY 126           H        GLY 126  17.611  -8.866  -1.033
  931   1HA   GLY 126          1HA       GLY 126  17.201 -10.733   1.216
  932   2HA   GLY 126          2HA       GLY 126  18.147 -11.097  -0.220
  933    H    CYS 127           H        CYS 127  15.417  -9.396  -1.102
  934    HA   CYS 127           HA       CYS 127  13.459 -11.411  -1.075
  935   1HB   CYS 127          1HB       CYS 127  13.769  -8.793  -2.303
  936   2HB   CYS 127          2HB       CYS 127  12.589  -9.849  -3.050
  937    H    ARG 128           H        ARG 128  12.378 -11.747  -3.473
  938    HA   ARG 128           HA       ARG 128  14.506 -12.998  -5.084
  939   1HB   ARG 128          1HB       ARG 128  12.342 -14.236  -3.804
  940   2HB   ARG 128          2HB       ARG 128  11.903 -14.184  -5.506
  941   1HG   ARG 128          1HG       ARG 128  14.559 -15.017  -5.480
  942   2HG   ARG 128          2HG       ARG 128  13.792 -15.878  -4.144
  943   1HD   ARG 128          1HD       ARG 128  12.443 -17.079  -5.515
  944   2HD   ARG 128          2HD       ARG 128  12.282 -15.767  -6.681
  945    HE   ARG 128           HE       ARG 128  14.913 -16.816  -6.713
  946   1HH1  ARG 128          1HH1      ARG 128  11.657 -17.531  -7.725
  947   2HH1  ARG 128          2HH1      ARG 128  12.151 -18.520  -9.059
  948   1HH2  ARG 128          1HH2      ARG 128  15.573 -18.115  -8.466
  949   2HH2  ARG 128          2HH2      ARG 128  14.378 -18.852  -9.480
  950    H    LEU 129           H        LEU 129  14.485 -10.818  -6.121
  951    HA   LEU 129           HA       LEU 129  12.612 -10.852  -8.367
  952   1HB   LEU 129          1HB       LEU 129  12.317  -8.397  -8.194
  953   2HB   LEU 129          2HB       LEU 129  11.599  -9.286  -6.865
  954    HG   LEU 129           HG       LEU 129  14.165  -8.642  -5.975
  955   1HD1  LEU 129          1HD1      LEU 129  13.933  -7.004  -8.032
  956   2HD1  LEU 129          2HD1      LEU 129  12.986  -6.068  -6.874
  957   3HD1  LEU 129          3HD1      LEU 129  14.662  -6.483  -6.513
  958   1HD2  LEU 129          1HD2      LEU 129  11.749  -8.637  -4.929
  959   2HD2  LEU 129          2HD2      LEU 129  13.043  -7.654  -4.244
  960   3HD2  LEU 129          3HD2      LEU 129  11.838  -6.915  -5.300

  No H/Q in entry =         960
  Start of MODEL    6
    1    H1   LYS   1           H1       LYS   1  -7.377  -9.488   1.701
    2    H2   LYS   1           H2       LYS   1  -7.808 -10.025   0.155
    3    H3   LYS   1           H3       LYS   1  -8.122 -10.995   1.506
    4    HA   LYS   1           HA       LYS   1  -5.908 -11.538   1.826
    5   1HB   LYS   1          1HB       LYS   1  -6.093 -11.312  -1.174
    6   2HB   LYS   1          2HB       LYS   1  -5.304 -12.565  -0.227
    7   1HG   LYS   1          1HG       LYS   1  -7.415 -13.449   0.478
    8   2HG   LYS   1          2HG       LYS   1  -8.278 -12.102  -0.268
    9   1HD   LYS   1          1HD       LYS   1  -6.499 -13.842  -1.927
   10   2HD   LYS   1          2HD       LYS   1  -8.124 -14.388  -1.508
   11   1HE   LYS   1          1HE       LYS   1  -7.466 -11.780  -2.871
   12   2HE   LYS   1          2HE       LYS   1  -8.028 -13.235  -3.690
   13   1HZ   LYS   1          1HZ       LYS   1  -9.599 -12.046  -1.495
   14   2HZ   LYS   1          2HZ       LYS   1  -9.729 -11.440  -3.068
   15   3HZ   LYS   1          3HZ       LYS   1 -10.119 -13.055  -2.748
   16    H    VAL   2           H        VAL   2  -3.978 -10.700   2.269
   17    HA   VAL   2           HA       VAL   2  -3.184  -8.202   0.939
   18    HB   VAL   2           HB       VAL   2  -2.329  -9.431   3.563
   19   1HG1  VAL   2          1HG1      VAL   2  -0.660  -7.975   1.980
   20   2HG1  VAL   2          2HG1      VAL   2  -1.414  -6.713   2.952
   21   3HG1  VAL   2          3HG1      VAL   2  -0.568  -8.044   3.740
   22   1HG2  VAL   2          1HG2      VAL   2  -4.333  -7.508   2.789
   23   2HG2  VAL   2          2HG2      VAL   2  -4.055  -8.274   4.353
   24   3HG2  VAL   2          3HG2      VAL   2  -3.179  -6.805   3.922
   25    H    PHE   3           H        PHE   3  -1.229  -8.011  -0.145
   26    HA   PHE   3           HA       PHE   3   0.045 -10.420  -1.018
   27   1HB   PHE   3          1HB       PHE   3   0.697  -7.492  -1.409
   28   2HB   PHE   3          2HB       PHE   3   1.669  -8.787  -2.089
   29    HD1  PHE   3           HD1      PHE   3  -0.038 -10.642  -3.274
   30    HD2  PHE   3           HD2      PHE   3  -0.585  -6.439  -2.936
   31    HE1  PHE   3           HE1      PHE   3  -1.476 -10.671  -5.267
   32    HE2  PHE   3           HE2      PHE   3  -2.019  -6.456  -4.924
   33    HZ   PHE   3           HZ       PHE   3  -2.469  -8.575  -6.098
   34    H    GLY   4           H        GLY   4   2.491 -10.552  -0.911
   35   1HA   GLY   4          1HA       GLY   4   4.134 -11.188   0.647
   36   2HA   GLY   4          2HA       GLY   4   3.303 -10.236   1.873
   37    H    ARG   5           H        ARG   5   6.132 -10.192   1.278
   38    HA   ARG   5           HA       ARG   5   6.379  -7.332   0.782
   39   1HB   ARG   5          1HB       ARG   5   8.439  -9.340   1.719
   40   2HB   ARG   5          2HB       ARG   5   8.687  -7.601   1.611
   41   1HG   ARG   5          1HG       ARG   5   6.930  -7.256   3.285
   42   2HG   ARG   5          2HG       ARG   5   6.715  -9.004   3.405
   43   1HD   ARG   5          1HD       ARG   5   9.488  -8.179   3.720
   44   2HD   ARG   5          2HD       ARG   5   8.422  -7.462   4.927
   45    HE   ARG   5           HE       ARG   5   9.117 -10.257   4.649
   46   1HH1  ARG   5          1HH1      ARG   5   6.944  -7.917   6.044
   47   2HH1  ARG   5          2HH1      ARG   5   6.421  -8.971   7.316
   48   1HH2  ARG   5          1HH2      ARG   5   8.433 -11.650   6.319
   49   2HH2  ARG   5          2HH2      ARG   5   7.268 -11.092   7.472
   50    H    CYS   6           H        CYS   6   8.067 -10.283  -0.316
   51    HA   CYS   6           HA       CYS   6   9.095  -8.811  -2.580
   52   1HB   CYS   6          1HB       CYS   6   9.378 -11.774  -2.266
   53   2HB   CYS   6          2HB       CYS   6  10.462 -10.612  -3.025
   54    H    GLU   7           H        GLU   7   6.652 -11.279  -1.950
   55    HA   GLU   7           HA       GLU   7   6.070 -12.157  -4.486
   56   1HB   GLU   7          1HB       GLU   7   4.576 -11.845  -1.997
   57   2HB   GLU   7          2HB       GLU   7   3.548 -11.673  -3.412
   58   1HG   GLU   7          1HG       GLU   7   5.424 -13.987  -3.104
   59   2HG   GLU   7          2HG       GLU   7   3.809 -13.996  -2.397
   60    H    LEU   8           H        LEU   8   4.833  -9.252  -2.899
   61    HA   LEU   8           HA       LEU   8   3.501  -8.198  -5.149
   62   1HB   LEU   8          1HB       LEU   8   3.035  -7.525  -2.820
   63   2HB   LEU   8          2HB       LEU   8   4.611  -6.769  -2.731
   64    HG   LEU   8           HG       LEU   8   2.455  -5.340  -3.162
   65   1HD1  LEU   8          1HD1      LEU   8   5.204  -5.070  -4.226
   66   2HD1  LEU   8          2HD1      LEU   8   3.993  -3.922  -4.795
   67   3HD1  LEU   8          3HD1      LEU   8   4.327  -4.068  -3.069
   68   1HD2  LEU   8          1HD2      LEU   8   1.933  -6.802  -5.212
   69   2HD2  LEU   8          2HD2      LEU   8   1.773  -5.053  -5.368
   70   3HD2  LEU   8          3HD2      LEU   8   3.195  -5.869  -6.017
   71    H    ALA   9           H        ALA   9   6.792  -7.755  -3.853
   72    HA   ALA   9           HA       ALA   9   7.551  -5.662  -5.574
   73   1HB   ALA   9          1HB       ALA   9   9.422  -7.751  -4.504
   74   2HB   ALA   9          2HB       ALA   9   8.780  -6.427  -3.530
   75   3HB   ALA   9          3HB       ALA   9   9.784  -6.080  -4.939
   76    H    ALA  10           H        ALA  10   8.128  -9.175  -5.919
   77    HA   ALA  10           HA       ALA  10   9.444  -9.162  -8.332
   78   1HB   ALA  10          1HB       ALA  10   9.259 -11.387  -8.180
   79   2HB   ALA  10          2HB       ALA  10   7.496 -11.319  -8.165
   80   3HB   ALA  10          3HB       ALA  10   8.401 -11.100  -6.667
   81    H    ALA  11           H        ALA  11   5.987  -8.955  -7.648
   82    HA   ALA  11           HA       ALA  11   5.125  -9.100 -10.322
   83   1HB   ALA  11          1HB       ALA  11   3.881  -8.109  -7.803
   84   2HB   ALA  11          2HB       ALA  11   3.416  -9.482  -8.806
   85   3HB   ALA  11          3HB       ALA  11   3.081  -7.839  -9.351
   86    H    MET  12           H        MET  12   6.159  -6.554  -8.292
   87    HA   MET  12           HA       MET  12   5.446  -4.349  -9.904
   88   1HB   MET  12          1HB       MET  12   7.905  -4.423  -8.178
   89   2HB   MET  12          2HB       MET  12   6.910  -3.041  -8.570
   90   1HG   MET  12          1HG       MET  12   5.097  -4.606  -7.337
   91   2HG   MET  12          2HG       MET  12   6.571  -5.068  -6.489
   92   1HE   MET  12          1HE       MET  12   4.870  -2.178  -8.083
   93   2HE   MET  12          2HE       MET  12   4.696  -0.953  -6.826
   94   3HE   MET  12          3HE       MET  12   6.210  -1.090  -7.719
   95    H    LYS  13           H        LYS  13   8.497  -6.151  -9.642
   96    HA   LYS  13           HA       LYS  13  10.025  -4.773 -11.476
   97   1HB   LYS  13          1HB       LYS  13  10.420  -6.996  -9.992
   98   2HB   LYS  13          2HB       LYS  13  10.242  -7.727 -11.581
   99   1HG   LYS  13          1HG       LYS  13  12.006  -5.437 -11.655
  100   2HG   LYS  13          2HG       LYS  13  12.549  -6.651 -10.494
  101   1HD   LYS  13          1HD       LYS  13  13.283  -7.948 -12.144
  102   2HD   LYS  13          2HD       LYS  13  11.683  -7.953 -12.889
  103   1HE   LYS  13          1HE       LYS  13  12.904  -7.012 -14.578
  104   2HE   LYS  13          2HE       LYS  13  12.424  -5.560 -13.699
  105   1HZ   LYS  13          1HZ       LYS  13  14.882  -6.758 -12.774
  106   2HZ   LYS  13          2HZ       LYS  13  14.952  -6.181 -14.362
  107   3HZ   LYS  13          3HZ       LYS  13  14.523  -5.137 -13.102
  108    H    ARG  14           H        ARG  14   7.835  -7.501 -12.065
  109    HA   ARG  14           HA       ARG  14   8.188  -7.594 -14.854
  110   1HB   ARG  14          1HB       ARG  14   6.835  -9.109 -13.012
  111   2HB   ARG  14          2HB       ARG  14   5.515  -8.330 -13.874
  112   1HG   ARG  14          1HG       ARG  14   6.271  -9.223 -15.964
  113   2HG   ARG  14          2HG       ARG  14   7.734  -9.860 -15.211
  114   1HD   ARG  14          1HD       ARG  14   6.485 -11.447 -13.948
  115   2HD   ARG  14          2HD       ARG  14   4.957 -10.694 -14.401
  116    HE   ARG  14           HE       ARG  14   5.083 -11.724 -16.480
  117   1HH1  ARG  14          1HH1      ARG  14   7.970 -12.314 -14.620
  118   2HH1  ARG  14          2HH1      ARG  14   8.537 -13.577 -15.660
  119   1HH2  ARG  14          1HH2      ARG  14   5.821 -13.386 -17.854
  120   2HH2  ARG  14          2HH2      ARG  14   7.316 -14.187 -17.498
  121    H    HIS  15           H        HIS  15   5.994  -5.764 -12.771
  122    HA   HIS  15           HA       HIS  15   4.466  -4.711 -14.929
  123   1HB   HIS  15          1HB       HIS  15   4.597  -4.313 -11.985
  124   2HB   HIS  15          2HB       HIS  15   3.857  -3.037 -12.944
  125    HD1  HIS  15           HD1      HIS  15   2.448  -5.117 -10.898
  126    HD2  HIS  15           HD2      HIS  15   2.298  -5.150 -15.051
  127    HE1  HIS  15           HE1      HIS  15   0.348  -6.370 -11.485
  128    HE2  HIS  15           HE2      HIS  15   0.324  -6.453 -14.002
  129    H    GLY  16           H        GLY  16   7.623  -4.045 -14.047
  130   1HA   GLY  16          1HA       GLY  16   7.649  -1.737 -15.681
  131   2HA   GLY  16          2HA       GLY  16   9.012  -2.450 -14.849
  132    H    LEU  17           H        LEU  17   7.518  -2.071 -12.145
  133    HA   LEU  17           HA       LEU  17   7.504   0.828 -12.064
  134   1HB   LEU  17          1HB       LEU  17   7.185  -0.915  -9.653
  135   2HB   LEU  17          2HB       LEU  17   6.566   0.700  -9.922
  136    HG   LEU  17           HG       LEU  17   5.423  -1.917 -10.662
  137   1HD1  LEU  17          1HD1      LEU  17   4.723   0.305  -9.122
  138   2HD1  LEU  17          2HD1      LEU  17   3.621   0.320 -10.499
  139   3HD1  LEU  17          3HD1      LEU  17   3.730  -1.110  -9.473
  140   1HD2  LEU  17          1HD2      LEU  17   5.303   0.474 -12.482
  141   2HD2  LEU  17          2HD2      LEU  17   5.653  -1.205 -12.892
  142   3HD2  LEU  17          3HD2      LEU  17   4.016  -0.731 -12.438
  143    H    ASP  18           H        ASP  18   9.776  -1.474 -11.892
  144    HA   ASP  18           HA       ASP  18  11.383  -0.438  -9.762
  145   1HB   ASP  18          1HB       ASP  18  11.933  -2.634 -10.123
  146   2HB   ASP  18          2HB       ASP  18  11.737  -2.517 -11.862
  147    H    ASN  19           H        ASN  19  11.786   1.657 -10.012
  148    HA   ASN  19           HA       ASN  19  12.818   3.560 -10.670
  149   1HB   ASN  19          1HB       ASN  19  14.604   1.469 -11.361
  150   2HB   ASN  19          2HB       ASN  19  14.604   2.604 -12.707
  151   2HD2  ASN  19          2HD2      ASN  19  16.220   1.856 -10.050
  152   1HD2  ASN  19          1HD2      ASN  19  16.795   3.411  -9.565
  153    H    TYR  20           H        TYR  20  10.472   2.723 -11.969
  154    HA   TYR  20           HA       TYR  20  10.625   3.206 -14.770
  155   1HB   TYR  20          1HB       TYR  20   8.682   2.104 -13.602
  156   2HB   TYR  20          2HB       TYR  20   8.257   3.675 -12.933
  157    HD1  TYR  20           HD1      TYR  20   8.860   1.999 -16.216
  158    HD2  TYR  20           HD2      TYR  20   6.751   5.012 -14.078
  159    HE1  TYR  20           HE1      TYR  20   7.531   2.487 -18.226
  160    HE2  TYR  20           HE2      TYR  20   5.415   5.508 -16.082
  161    HH   TYR  20           HH       TYR  20   5.530   5.251 -18.482
  162    H    ARG  21           H        ARG  21   9.523   5.243 -15.730
  163    HA   ARG  21           HA       ARG  21  10.858   7.461 -15.574
  164   1HB   ARG  21          1HB       ARG  21   8.022   6.967 -16.013
  165   2HB   ARG  21          2HB       ARG  21   8.323   8.587 -15.401
  166   1HG   ARG  21          1HG       ARG  21   9.509   9.221 -17.261
  167   2HG   ARG  21          2HG       ARG  21   9.966   7.565 -17.665
  168   1HD   ARG  21          1HD       ARG  21   7.097   7.917 -17.723
  169   2HD   ARG  21          2HD       ARG  21   7.906   9.062 -18.792
  170    HE   ARG  21           HE       ARG  21   8.161   6.131 -18.954
  171   1HH1  ARG  21          1HH1      ARG  21   8.301   9.299 -20.398
  172   2HH1  ARG  21          2HH1      ARG  21   8.572   8.698 -22.000
  173   1HH2  ARG  21          1HH2      ARG  21   8.518   5.331 -21.059
  174   2HH2  ARG  21          2HH2      ARG  21   8.695   6.442 -22.376
  175    H    GLY  22           H        GLY  22   8.561   6.502 -13.109
  176   1HA   GLY  22          1HA       GLY  22   8.063   7.388 -11.037
  177   2HA   GLY  22          2HA       GLY  22   8.970   8.829 -11.473
  178    H    TYR  23           H        TYR  23   9.004   5.859  -9.761
  179    HA   TYR  23           HA       TYR  23  11.854   6.252  -9.160
  180   1HB   TYR  23          1HB       TYR  23   9.565   6.029  -7.241
  181   2HB   TYR  23          2HB       TYR  23  11.196   5.591  -6.748
  182    HD1  TYR  23           HD1      TYR  23   9.299   8.391  -8.320
  183    HD2  TYR  23           HD2      TYR  23  12.601   7.237  -5.898
  184    HE1  TYR  23           HE1      TYR  23   9.781  10.756  -7.866
  185    HE2  TYR  23           HE2      TYR  23  13.092   9.602  -5.436
  186    HH   TYR  23           HH       TYR  23  12.689  11.770  -6.290
  187    H    SER  24           H        SER  24  12.606   4.466  -7.559
  188    HA   SER  24           HA       SER  24  12.446   2.018  -9.048
  189   1HB   SER  24          1HB       SER  24  14.282   1.274  -7.682
  190   2HB   SER  24          2HB       SER  24  14.587   2.945  -8.156
  191    HG   SER  24           HG       SER  24  13.704   1.966  -5.653
  192    H    LEU  25           H        LEU  25  12.317  -0.056  -7.938
  193    HA   LEU  25           HA       LEU  25   9.908  -0.677  -6.931
  194   1HB   LEU  25          1HB       LEU  25  12.549  -1.905  -6.934
  195   2HB   LEU  25          2HB       LEU  25  11.551  -2.455  -5.602
  196    HG   LEU  25           HG       LEU  25  10.383  -2.434  -8.336
  197   1HD1  LEU  25          1HD1      LEU  25  12.807  -3.752  -7.761
  198   2HD1  LEU  25          2HD1      LEU  25  11.546  -4.984  -7.800
  199   3HD1  LEU  25          3HD1      LEU  25  11.786  -3.924  -9.188
  200   1HD2  LEU  25          1HD2      LEU  25  10.102  -4.144  -5.872
  201   2HD2  LEU  25          2HD2      LEU  25   8.924  -3.015  -6.542
  202   3HD2  LEU  25          3HD2      LEU  25   9.313  -4.500  -7.409
  203    H    GLY  26           H        GLY  26  12.768  -0.134  -4.847
  204   1HA   GLY  26          1HA       GLY  26  12.903   0.788  -2.741
  205   2HA   GLY  26          2HA       GLY  26  11.754  -0.486  -2.377
  206    H    ASN  27           H        ASN  27  11.216   2.425  -4.331
  207    HA   ASN  27           HA       ASN  27   9.871   3.845  -2.265
  208   1HB   ASN  27          1HB       ASN  27   9.653   4.262  -5.250
  209   2HB   ASN  27          2HB       ASN  27   9.233   5.424  -3.994
  210   2HD2  ASN  27          2HD2      ASN  27  11.928   3.544  -5.290
  211   1HD2  ASN  27          1HD2      ASN  27  13.151   4.703  -4.908
  212    H    TRP  28           H        TRP  28   8.831   1.684  -4.811
  213    HA   TRP  28           HA       TRP  28   6.037   2.138  -4.553
  214   1HB   TRP  28          1HB       TRP  28   7.576  -0.184  -5.690
  215   2HB   TRP  28          2HB       TRP  28   5.832   0.041  -5.839
  216    HD1  TRP  28           HD1      TRP  28   9.087   1.110  -7.329
  217    HE1  TRP  28           HE1      TRP  28   8.673   2.765  -9.242
  218    HE3  TRP  28           HE3      TRP  28   4.110   1.935  -6.593
  219    HZ2  TRP  28           HZ2      TRP  28   6.504   4.223 -10.327
  220    HZ3  TRP  28           HZ3      TRP  28   2.919   3.462  -8.106
  221    HH2  TRP  28           HH2      TRP  28   4.095   4.586  -9.942
  222    H    VAL  29           H        VAL  29   8.206  -0.396  -3.281
  223    HA   VAL  29           HA       VAL  29   6.191  -1.826  -1.940
  224    HB   VAL  29           HB       VAL  29   9.143  -1.669  -1.314
  225   1HG1  VAL  29          1HG1      VAL  29   7.030  -2.969   0.055
  226   2HG1  VAL  29          2HG1      VAL  29   8.014  -4.207  -0.726
  227   3HG1  VAL  29          3HG1      VAL  29   8.762  -3.051   0.375
  228   1HG2  VAL  29          1HG2      VAL  29   7.584  -3.449  -3.175
  229   2HG2  VAL  29          2HG2      VAL  29   8.903  -2.349  -3.576
  230   3HG2  VAL  29          3HG2      VAL  29   9.226  -3.805  -2.636
  231    H    CYS  30           H        CYS  30   8.523   0.581  -0.812
  232    HA   CYS  30           HA       CYS  30   7.794   0.637   1.866
  233   1HB   CYS  30          1HB       CYS  30   9.736   1.792   0.585
  234   2HB   CYS  30          2HB       CYS  30   8.597   3.117   0.380
  235    H    ALA  31           H        ALA  31   6.591   2.632  -0.822
  236    HA   ALA  31           HA       ALA  31   4.765   4.141   0.703
  237   1HB   ALA  31          1HB       ALA  31   5.009   3.566  -2.229
  238   2HB   ALA  31          2HB       ALA  31   3.689   4.542  -1.585
  239   3HB   ALA  31          3HB       ALA  31   5.360   5.059  -1.358
  240    H    ALA  32           H        ALA  32   4.308   1.214  -1.261
  241    HA   ALA  32           HA       ALA  32   1.513   1.038  -0.841
  242   1HB   ALA  32          1HB       ALA  32   2.387  -0.087  -2.719
  243   2HB   ALA  32          2HB       ALA  32   1.845  -1.348  -1.612
  244   3HB   ALA  32          3HB       ALA  32   3.562  -0.967  -1.743
  245    H    LYS  33           H        LYS  33   4.217  -0.761   0.626
  246    HA   LYS  33           HA       LYS  33   2.895  -2.431   2.311
  247   1HB   LYS  33          1HB       LYS  33   5.339  -2.385   2.043
  248   2HB   LYS  33          2HB       LYS  33   5.408  -0.888   2.960
  249   1HG   LYS  33          1HG       LYS  33   4.771  -1.962   4.959
  250   2HG   LYS  33          2HG       LYS  33   4.276  -3.424   4.101
  251   1HD   LYS  33          1HD       LYS  33   6.688  -3.663   3.381
  252   2HD   LYS  33          2HD       LYS  33   7.069  -2.381   4.532
  253   1HE   LYS  33          1HE       LYS  33   7.455  -4.512   5.578
  254   2HE   LYS  33          2HE       LYS  33   6.052  -3.752   6.326
  255   1HZ   LYS  33          1HZ       LYS  33   4.648  -5.131   4.845
  256   2HZ   LYS  33          2HZ       LYS  33   6.037  -5.939   4.319
  257   3HZ   LYS  33          3HZ       LYS  33   5.564  -6.039   5.941
  258    H    PHE  34           H        PHE  34   3.971   0.857   3.183
  259    HA   PHE  34           HA       PHE  34   2.540   0.766   5.636
  260   1HB   PHE  34          1HB       PHE  34   4.217   2.703   4.268
  261   2HB   PHE  34          2HB       PHE  34   3.077   3.372   5.418
  262    HD1  PHE  34           HD1      PHE  34   3.079   2.248   7.766
  263    HD2  PHE  34           HD2      PHE  34   6.281   1.967   4.976
  264    HE1  PHE  34           HE1      PHE  34   4.621   1.682   9.599
  265    HE2  PHE  34           HE2      PHE  34   7.828   1.399   6.803
  266    HZ   PHE  34           HZ       PHE  34   6.999   1.257   9.118
  267    H    GLU  35           H        GLU  35   1.654   1.579   2.450
  268    HA   GLU  35           HA       GLU  35  -0.385   3.451   3.009
  269   1HB   GLU  35          1HB       GLU  35   0.715   2.070   0.744
  270   2HB   GLU  35          2HB       GLU  35  -1.040   1.995   0.680
  271   1HG   GLU  35          1HG       GLU  35  -1.258   4.306   0.555
  272   2HG   GLU  35          2HG       GLU  35   0.373   4.587   1.169
  273    H    SER  36           H        SER  36  -0.545   0.000   2.188
  274    HA   SER  36           HA       SER  36  -3.136  -0.151   3.595
  275   1HB   SER  36          1HB       SER  36  -3.771  -1.826   1.760
  276   2HB   SER  36          2HB       SER  36  -3.701  -0.130   1.283
  277    HG   SER  36           HG       SER  36  -1.473  -1.835   1.003
  278    H    ASN  37           H        ASN  37  -0.111  -1.150   3.877
  279    HA   ASN  37           HA       ASN  37   0.929  -2.946   4.841
  280   1HB   ASN  37          1HB       ASN  37  -1.210  -2.603   6.371
  281   2HB   ASN  37          2HB       ASN  37  -1.698  -4.136   5.654
  282   2HD2  ASN  37          2HD2      ASN  37  -1.369  -5.645   7.120
  283   1HD2  ASN  37          1HD2      ASN  37   0.074  -5.864   8.043
  284    H    PHE  38           H        PHE  38  -0.106  -2.960   2.140
  285    HA   PHE  38           HA       PHE  38  -0.051  -4.227   0.317
  286   1HB   PHE  38          1HB       PHE  38   0.822  -6.336   2.284
  287   2HB   PHE  38          2HB       PHE  38   0.648  -6.657   0.561
  288    HD1  PHE  38           HD1      PHE  38   1.678  -4.350  -0.748
  289    HD2  PHE  38           HD2      PHE  38   3.065  -6.228   2.807
  290    HE1  PHE  38           HE1      PHE  38   3.923  -3.436  -1.153
  291    HE2  PHE  38           HE2      PHE  38   5.316  -5.314   2.411
  292    HZ   PHE  38           HZ       PHE  38   5.750  -3.922   0.427
  293    H    ASN  39           H        ASN  39  -2.446  -3.918   2.106
  294    HA   ASN  39           HA       ASN  39  -3.986  -6.305   1.557
  295   1HB   ASN  39          1HB       ASN  39  -4.349  -4.983   3.634
  296   2HB   ASN  39          2HB       ASN  39  -4.905  -3.636   2.647
  297   2HD2  ASN  39          2HD2      ASN  39  -6.765  -4.037   4.174
  298   1HD2  ASN  39          1HD2      ASN  39  -8.002  -5.110   3.623
  299    H    THR  40           H        THR  40  -4.591  -6.647  -0.447
  300    HA   THR  40           HA       THR  40  -4.748  -4.651  -2.440
  301    HB   THR  40           HB       THR  40  -5.109  -6.363  -3.919
  302    HG1  THR  40           HG1      THR  40  -6.459  -7.998  -2.045
  303   1HG2  THR  40          1HG2      THR  40  -3.387  -6.997  -1.932
  304   2HG2  THR  40          2HG2      THR  40  -4.470  -8.388  -1.890
  305   3HG2  THR  40          3HG2      THR  40  -3.629  -7.970  -3.382
  306    H    GLN  41           H        GLN  41  -6.866  -5.747  -0.061
  307    HA   GLN  41           HA       GLN  41  -9.211  -4.619  -1.407
  308   1HB   GLN  41          1HB       GLN  41  -8.736  -6.798   0.531
  309   2HB   GLN  41          2HB       GLN  41 -10.201  -5.875   0.750
  310   1HG   GLN  41          1HG       GLN  41  -9.634  -6.796  -1.990
  311   2HG   GLN  41          2HG       GLN  41 -10.033  -8.039  -0.806
  312   2HE2  GLN  41          2HE2      GLN  41 -11.206  -5.500  -2.769
  313   1HE2  GLN  41          1HE2      GLN  41 -12.871  -5.618  -2.325
  314    H    ALA  42           H        ALA  42  -6.890  -3.546   0.581
  315    HA   ALA  42           HA       ALA  42  -8.275  -2.477   2.787
  316   1HB   ALA  42          1HB       ALA  42  -5.610  -2.248   1.637
  317   2HB   ALA  42          2HB       ALA  42  -6.122  -2.299   3.324
  318   3HB   ALA  42          3HB       ALA  42  -6.164  -0.776   2.436
  319    H    THR  43           H        THR  43  -9.458  -0.738   3.066
  320    HA   THR  43           HA       THR  43  -9.552   1.312   0.951
  321    HB   THR  43           HB       THR  43 -11.857   1.427   0.987
  322    HG1  THR  43           HG1      THR  43 -13.095   0.601   2.792
  323   1HG2  THR  43          1HG2      THR  43 -11.153  -1.434   1.611
  324   2HG2  THR  43          2HG2      THR  43 -12.779  -0.935   1.147
  325   3HG2  THR  43          3HG2      THR  43 -11.433  -0.699   0.033
  326    H    ASN  44           H        ASN  44  -9.414   3.426   1.676
  327    HA   ASN  44           HA       ASN  44  -9.825   3.962   4.516
  328   1HB   ASN  44          1HB       ASN  44  -7.213   4.212   3.072
  329   2HB   ASN  44          2HB       ASN  44  -7.599   5.347   4.362
  330   2HD2  ASN  44          2HD2      ASN  44  -8.575   4.141   6.350
  331   1HD2  ASN  44          1HD2      ASN  44  -7.655   2.780   6.885
  332    H    ARG  45           H        ARG  45 -11.202   5.602   4.573
  333    HA   ARG  45           HA       ARG  45 -11.395   7.467   2.371
  334   1HB   ARG  45          1HB       ARG  45 -13.283   8.421   3.726
  335   2HB   ARG  45          2HB       ARG  45 -13.467   6.728   3.292
  336   1HG   ARG  45          1HG       ARG  45 -13.390   6.033   5.427
  337   2HG   ARG  45          2HG       ARG  45 -12.175   7.228   5.884
  338   1HD   ARG  45          1HD       ARG  45 -13.719   8.756   6.499
  339   2HD   ARG  45          2HD       ARG  45 -14.832   8.304   5.209
  340    HE   ARG  45           HE       ARG  45 -14.631   6.319   7.266
  341   1HH1  ARG  45          1HH1      ARG  45 -16.180   9.299   6.338
  342   2HH1  ARG  45          2HH1      ARG  45 -17.569   9.039   7.340
  343   1HH2  ARG  45          1HH2      ARG  45 -16.456   5.969   8.587
  344   2HH2  ARG  45          2HH2      ARG  45 -17.726   7.147   8.619
  345    H    ASN  46           H        ASN  46 -10.767   9.552   2.334
  346    HA   ASN  46           HA       ASN  46  -9.247  10.531   4.652
  347   1HB   ASN  46          1HB       ASN  46  -9.119  11.746   1.909
  348   2HB   ASN  46          2HB       ASN  46  -7.911  11.777   3.189
  349   2HD2  ASN  46          2HD2      ASN  46  -8.620  10.500   0.273
  350   1HD2  ASN  46          1HD2      ASN  46  -7.665   9.063   0.334
  351    H    THR  47           H        THR  47  -9.187  13.073   4.601
  352    HA   THR  47           HA       THR  47 -11.929  13.905   5.028
  353    HB   THR  47           HB       THR  47 -10.895  16.012   5.893
  354    HG1  THR  47           HG1      THR  47  -8.534  15.785   6.244
  355   1HG2  THR  47          1HG2      THR  47 -10.443  13.303   6.970
  356   2HG2  THR  47          2HG2      THR  47  -9.476  14.584   7.700
  357   3HG2  THR  47          3HG2      THR  47 -11.236  14.699   7.703
  358    H    ASP  48           H        ASP  48  -9.585  14.186   2.556
  359    HA   ASP  48           HA       ASP  48 -10.322  16.682   1.454
  360   1HB   ASP  48          1HB       ASP  48  -9.263  15.774  -0.642
  361   2HB   ASP  48          2HB       ASP  48  -8.240  15.721   0.788
  362    H    GLY  49           H        GLY  49 -11.975  13.747   1.607
  363   1HA   GLY  49          1HA       GLY  49 -13.950  14.749  -0.326
  364   2HA   GLY  49          2HA       GLY  49 -14.269  13.593   0.958
  365    H    SER  50           H        SER  50 -12.465  11.665   0.624
  366    HA   SER  50           HA       SER  50 -13.448  10.258  -1.643
  367   1HB   SER  50          1HB       SER  50 -10.922   9.915  -2.454
  368   2HB   SER  50          2HB       SER  50 -11.953  11.189  -3.104
  369    HG   SER  50           HG       SER  50  -9.748  11.358  -1.442
  370    H    THR  51           H        THR  51 -11.633   8.298  -1.980
  371    HA   THR  51           HA       THR  51 -10.881   7.308   0.667
  372    HB   THR  51           HB       THR  51 -12.367   5.423  -1.113
  373    HG1  THR  51           HG1      THR  51 -13.950   6.902  -0.947
  374   1HG2  THR  51          1HG2      THR  51 -11.082   4.896   1.096
  375   2HG2  THR  51          2HG2      THR  51 -12.516   5.570   1.871
  376   3HG2  THR  51          3HG2      THR  51 -12.663   4.169   0.810
  377    H    ASP  52           H        ASP  52  -9.692   5.192   0.497
  378    HA   ASP  52           HA       ASP  52  -8.082   5.098  -1.970
  379   1HB   ASP  52          1HB       ASP  52  -7.217   4.670   0.897
  380   2HB   ASP  52          2HB       ASP  52  -6.203   4.332  -0.503
  381    H    TYR  53           H        TYR  53  -9.280   3.484  -2.919
  382    HA   TYR  53           HA       TYR  53  -9.536   0.962  -1.466
  383   1HB   TYR  53          1HB       TYR  53 -10.646   1.665  -4.186
  384   2HB   TYR  53          2HB       TYR  53 -11.054   0.265  -3.206
  385    HD1  TYR  53           HD1      TYR  53 -12.115   0.782  -0.877
  386    HD2  TYR  53           HD2      TYR  53 -12.000   3.541  -4.111
  387    HE1  TYR  53           HE1      TYR  53 -14.004   2.007   0.110
  388    HE2  TYR  53           HE2      TYR  53 -13.892   4.773  -3.137
  389    HH   TYR  53           HH       TYR  53 -15.648   3.554  -0.369
  390    H    GLY  54           H        GLY  54  -7.151   0.544  -1.633
  391   1HA   GLY  54          1HA       GLY  54  -6.005   0.204  -4.216
  392   2HA   GLY  54          2HA       GLY  54  -6.567  -1.332  -3.577
  393    H    ILE  55           H        ILE  55  -4.274  -1.913  -3.742
  394    HA   ILE  55           HA       ILE  55  -2.975  -1.751  -1.217
  395    HB   ILE  55           HB       ILE  55  -2.636  -3.644  -2.843
  396   1HG1  ILE  55          1HG1      ILE  55  -0.137  -2.153  -1.995
  397   2HG1  ILE  55          2HG1      ILE  55  -1.056  -3.281  -1.003
  398   1HG2  ILE  55          1HG2      ILE  55  -1.974  -1.503  -4.583
  399   2HG2  ILE  55          2HG2      ILE  55  -0.542  -2.517  -4.404
  400   3HG2  ILE  55          3HG2      ILE  55  -2.063  -3.227  -4.947
  401   1HD1  ILE  55          1HD1      ILE  55  -0.485  -4.775  -3.221
  402   2HD1  ILE  55          2HD1      ILE  55   0.964  -3.787  -3.032
  403   3HD1  ILE  55          3HD1      ILE  55   0.408  -4.801  -1.701
  404    H    LEU  56           H        LEU  56  -3.002   0.106  -4.103
  405    HA   LEU  56           HA       LEU  56  -0.807   1.799  -3.131
  406   1HB   LEU  56          1HB       LEU  56  -1.377   0.760  -5.725
  407   2HB   LEU  56          2HB       LEU  56  -1.595   2.497  -5.787
  408    HG   LEU  56           HG       LEU  56   0.643   2.172  -6.424
  409   1HD1  LEU  56          1HD1      LEU  56   0.370   3.898  -4.689
  410   2HD1  LEU  56          2HD1      LEU  56   0.762   2.699  -3.457
  411   3HD1  LEU  56          3HD1      LEU  56   1.968   3.152  -4.660
  412   1HD2  LEU  56          1HD2      LEU  56   0.494  -0.071  -4.538
  413   2HD2  LEU  56          2HD2      LEU  56   1.401   0.095  -6.042
  414   3HD2  LEU  56          3HD2      LEU  56   2.037   0.783  -4.547
  415    H    GLN  57           H        GLN  57  -3.956   1.549  -2.799
  416    HA   GLN  57           HA       GLN  57  -5.577   2.968  -2.131
  417   1HB   GLN  57          1HB       GLN  57  -3.555   5.156  -2.632
  418   2HB   GLN  57          2HB       GLN  57  -5.079   5.341  -1.776
  419   1HG   GLN  57          1HG       GLN  57  -4.205   3.571  -0.172
  420   2HG   GLN  57          2HG       GLN  57  -2.633   3.832  -0.926
  421   2HE2  GLN  57          2HE2      GLN  57  -4.180   4.518   1.736
  422   1HE2  GLN  57          1HE2      GLN  57  -3.624   6.120   2.067
  423    H    ILE  58           H        ILE  58  -6.557   2.186  -4.240
  424    HA   ILE  58           HA       ILE  58  -6.432   4.063  -6.424
  425    HB   ILE  58           HB       ILE  58  -8.371   1.777  -6.189
  426   1HG1  ILE  58          1HG1      ILE  58  -6.239   0.784  -5.708
  427   2HG1  ILE  58          2HG1      ILE  58  -6.628   0.414  -7.385
  428   1HG2  ILE  58          1HG2      ILE  58  -8.611   3.457  -8.017
  429   2HG2  ILE  58          2HG2      ILE  58  -7.025   2.963  -8.607
  430   3HG2  ILE  58          3HG2      ILE  58  -8.355   1.805  -8.577
  431   1HD1  ILE  58          1HD1      ILE  58  -5.160   2.833  -7.354
  432   2HD1  ILE  58          2HD1      ILE  58  -4.318   1.667  -6.332
  433   3HD1  ILE  58          3HD1      ILE  58  -4.689   1.265  -8.008
  434    H    ASN  59           H        ASN  59  -7.314   5.979  -5.759
  435    HA   ASN  59           HA       ASN  59  -9.723   6.175  -4.286
  436   1HB   ASN  59          1HB       ASN  59  -8.014   7.965  -4.367
  437   2HB   ASN  59          2HB       ASN  59  -8.382   8.227  -6.069
  438   2HD2  ASN  59          2HD2      ASN  59  -8.603  10.406  -4.793
  439   1HD2  ASN  59          1HD2      ASN  59 -10.226  10.816  -4.366
  440    H    SER  60           H        SER  60 -11.404   5.072  -5.223
  441    HA   SER  60           HA       SER  60 -11.953   5.039  -7.985
  442   1HB   SER  60          1HB       SER  60 -13.904   3.857  -7.435
  443   2HB   SER  60          2HB       SER  60 -12.796   3.461  -6.121
  444    HG   SER  60           HG       SER  60 -13.904   5.481  -5.160
  445    H    ARG  61           H        ARG  61 -12.386   7.520  -5.703
  446    HA   ARG  61           HA       ARG  61 -14.548   8.753  -7.255
  447   1HB   ARG  61          1HB       ARG  61 -14.401   8.557  -4.616
  448   2HB   ARG  61          2HB       ARG  61 -13.426  10.011  -4.791
  449   1HG   ARG  61          1HG       ARG  61 -15.248  11.153  -5.883
  450   2HG   ARG  61          2HG       ARG  61 -16.224   9.683  -5.854
  451   1HD   ARG  61          1HD       ARG  61 -16.018   9.729  -3.346
  452   2HD   ARG  61          2HD       ARG  61 -15.301  11.331  -3.509
  453    HE   ARG  61           HE       ARG  61 -17.782  11.197  -4.873
  454   1HH1  ARG  61          1HH1      ARG  61 -16.403  11.409  -1.680
  455   2HH1  ARG  61          2HH1      ARG  61 -17.779  12.210  -0.999
  456   1HH2  ARG  61          1HH2      ARG  61 -19.598  12.251  -3.985
  457   2HH2  ARG  61          2HH2      ARG  61 -19.595  12.688  -2.309
  458    H    TRP  62           H        TRP  62 -11.678   8.509  -8.041
  459    HA   TRP  62           HA       TRP  62 -11.386  11.189  -9.039
  460   1HB   TRP  62          1HB       TRP  62 -10.223  10.745  -6.593
  461   2HB   TRP  62          2HB       TRP  62  -8.886  10.460  -7.704
  462    HD1  TRP  62           HD1      TRP  62 -11.616  13.209  -7.309
  463    HE1  TRP  62           HE1      TRP  62 -10.489  15.491  -7.696
  464    HE3  TRP  62           HE3      TRP  62  -6.863  11.608  -8.304
  465    HZ2  TRP  62           HZ2      TRP  62  -7.924  16.481  -8.337
  466    HZ3  TRP  62           HZ3      TRP  62  -5.132  13.286  -8.795
  467    HH2  TRP  62           HH2      TRP  62  -5.653  15.672  -8.812
  468    H    TRP  63           H        TRP  63 -10.653   7.861  -9.185
  469    HA   TRP  63           HA       TRP  63  -9.028   8.360 -11.580
  470   1HB   TRP  63          1HB       TRP  63  -8.504   6.330  -9.404
  471   2HB   TRP  63          2HB       TRP  63  -7.738   6.267 -10.987
  472    HD1  TRP  63           HD1      TRP  63  -6.751   7.204  -7.729
  473    HE1  TRP  63           HE1      TRP  63  -5.017   9.113  -7.719
  474    HE3  TRP  63           HE3      TRP  63  -7.425   8.910 -12.473
  475    HZ2  TRP  63           HZ2      TRP  63  -4.071  11.098  -9.514
  476    HZ3  TRP  63           HZ3      TRP  63  -6.117  10.813 -13.261
  477    HH2  TRP  63           HH2      TRP  63  -4.452  11.891 -11.814
  478    H    CYS  64           H        CYS  64 -10.280   5.482  -9.955
  479    HA   CYS  64           HA       CYS  64 -11.235   4.517 -12.532
  480   1HB   CYS  64          1HB       CYS  64 -11.245   2.367 -11.635
  481   2HB   CYS  64          2HB       CYS  64  -9.919   3.129 -10.765
  482    H    ASN  65           H        ASN  65 -13.281   3.608 -12.864
  483    HA   ASN  65           HA       ASN  65 -15.390   5.103 -11.490
  484   1HB   ASN  65          1HB       ASN  65 -15.175   5.044 -14.029
  485   2HB   ASN  65          2HB       ASN  65 -15.698   3.365 -13.940
  486   2HD2  ASN  65          2HD2      ASN  65 -16.622   6.672 -13.200
  487   1HD2  ASN  65          1HD2      ASN  65 -18.328   6.405 -13.261
  488    H    ASP  66           H        ASP  66 -16.071   4.099  -9.706
  489    HA   ASP  66           HA       ASP  66 -16.352   1.189  -9.698
  490   1HB   ASP  66          1HB       ASP  66 -16.530   1.343  -7.307
  491   2HB   ASP  66          2HB       ASP  66 -15.180   2.351  -7.817
  492    H    GLY  67           H        GLY  67 -18.241   4.031  -9.989
  493   1HA   GLY  67          1HA       GLY  67 -20.626   2.508 -10.396
  494   2HA   GLY  67          2HA       GLY  67 -20.489   4.257 -10.441
  495    H    ARG  68           H        ARG  68 -19.284   2.857  -7.578
  496    HA   ARG  68           HA       ARG  68 -21.810   2.892  -6.171
  497   1HB   ARG  68          1HB       ARG  68 -19.000   2.501  -5.125
  498   2HB   ARG  68          2HB       ARG  68 -20.479   2.242  -4.211
  499   1HG   ARG  68          1HG       ARG  68 -19.914   0.748  -6.749
  500   2HG   ARG  68          2HG       ARG  68 -19.307   0.199  -5.186
  501   1HD   ARG  68          1HD       ARG  68 -22.137   0.894  -5.136
  502   2HD   ARG  68          2HD       ARG  68 -21.764  -0.403  -6.272
  503    HE   ARG  68           HE       ARG  68 -20.800  -0.579  -3.507
  504   1HH1  ARG  68          1HH1      ARG  68 -22.827  -1.761  -6.083
  505   2HH1  ARG  68          2HH1      ARG  68 -23.206  -3.246  -5.277
  506   1HH2  ARG  68          1HH2      ARG  68 -21.293  -2.533  -2.439
  507   2HH2  ARG  68          2HH2      ARG  68 -22.334  -3.685  -3.206
  508    H    THR  69           H        THR  69 -19.726   5.237  -7.161
  509    HA   THR  69           HA       THR  69 -20.716   7.087  -5.126
  510    HB   THR  69           HB       THR  69 -17.865   7.414  -5.942
  511    HG1  THR  69           HG1      THR  69 -18.169   6.024  -3.596
  512   1HG2  THR  69          1HG2      THR  69 -19.671   8.288  -3.759
  513   2HG2  THR  69          2HG2      THR  69 -17.973   8.046  -3.348
  514   3HG2  THR  69          3HG2      THR  69 -18.420   9.183  -4.621
  515    HA   PRO  70           HA       PRO  70 -21.445   9.240  -8.996
  516   1HB   PRO  70          1HB       PRO  70 -22.701  11.389  -7.910
  517   2HB   PRO  70          2HB       PRO  70 -23.497   9.828  -8.147
  518   1HG   PRO  70          1HG       PRO  70 -22.284  10.979  -5.664
  519   2HG   PRO  70          2HG       PRO  70 -23.815  10.106  -5.860
  520   1HD   PRO  70          1HD       PRO  70 -21.578   8.918  -4.912
  521   2HD   PRO  70          2HD       PRO  70 -22.782   8.044  -5.880
  522    H    GLY  71           H        GLY  71 -20.497  10.941 -10.083
  523   1HA   GLY  71          1HA       GLY  71 -18.870  12.842  -8.561
  524   2HA   GLY  71          2HA       GLY  71 -19.310  12.981 -10.257
  525    H    SER  72           H        SER  72 -18.470   9.921 -10.189
  526    HA   SER  72           HA       SER  72 -15.694   9.849  -9.805
  527   1HB   SER  72          1HB       SER  72 -17.250   7.865 -10.030
  528   2HB   SER  72          2HB       SER  72 -17.232   8.145 -11.771
  529    HG   SER  72           HG       SER  72 -14.722   8.142 -10.940
  530    H    ARG  73           H        ARG  73 -14.087  10.712 -10.922
  531    HA   ARG  73           HA       ARG  73 -14.566  12.143 -13.352
  532   1HB   ARG  73          1HB       ARG  73 -12.408  11.876 -11.414
  533   2HB   ARG  73          2HB       ARG  73 -11.811  11.946 -13.065
  534   1HG   ARG  73          1HG       ARG  73 -13.769  13.951 -12.841
  535   2HG   ARG  73          2HG       ARG  73 -12.761  14.058 -11.396
  536   1HD   ARG  73          1HD       ARG  73 -10.765  14.189 -12.765
  537   2HD   ARG  73          2HD       ARG  73 -11.726  13.978 -14.227
  538    HE   ARG  73           HE       ARG  73 -11.734  16.358 -12.499
  539   1HH1  ARG  73          1HH1      ARG  73 -12.476  14.785 -15.518
  540   2HH1  ARG  73          2HH1      ARG  73 -12.904  16.255 -16.327
  541   1HH2  ARG  73          1HH2      ARG  73 -12.297  18.298 -13.555
  542   2HH2  ARG  73          2HH2      ARG  73 -12.803  18.252 -15.211
  543    H    ASN  74           H        ASN  74 -12.874   9.156 -12.505
  544    HA   ASN  74           HA       ASN  74 -12.246   7.336 -13.740
  545   1HB   ASN  74          1HB       ASN  74 -14.636   7.915 -14.767
  546   2HB   ASN  74          2HB       ASN  74 -13.671   8.336 -16.178
  547   2HD2  ASN  74          2HD2      ASN  74 -14.520   6.650 -17.381
  548   1HD2  ASN  74          1HD2      ASN  74 -14.082   5.003 -17.099
  549    H    LEU  75           H        LEU  75 -10.738   9.781 -13.667
  550    HA   LEU  75           HA       LEU  75  -9.612  10.678 -16.019
  551   1HB   LEU  75          1HB       LEU  75  -8.833  10.341 -13.198
  552   2HB   LEU  75          2HB       LEU  75  -7.515  10.587 -14.318
  553    HG   LEU  75           HG       LEU  75  -9.900  12.418 -13.908
  554   1HD1  LEU  75          1HD1      LEU  75  -8.246  12.333 -12.033
  555   2HD1  LEU  75          2HD1      LEU  75  -7.024  12.915 -13.163
  556   3HD1  LEU  75          3HD1      LEU  75  -8.425  13.917 -12.788
  557   1HD2  LEU  75          1HD2      LEU  75  -8.225  12.193 -16.133
  558   2HD2  LEU  75          2HD2      LEU  75  -9.332  13.513 -15.757
  559   3HD2  LEU  75          3HD2      LEU  75  -7.644  13.605 -15.252
  560    H    CYS  76           H        CYS  76  -8.670   8.154 -13.912
  561    HA   CYS  76           HA       CYS  76  -6.540   7.108 -15.466
  562   1HB   CYS  76          1HB       CYS  76  -7.412   6.991 -12.900
  563   2HB   CYS  76          2HB       CYS  76  -7.860   5.398 -13.494
  564    H    ASN  77           H        ASN  77  -9.941   6.503 -15.103
  565    HA   ASN  77           HA       ASN  77 -11.434   5.128 -16.154
  566   1HB   ASN  77          1HB       ASN  77 -10.039   6.434 -18.097
  567   2HB   ASN  77          2HB       ASN  77  -9.743   4.758 -18.549
  568   2HD2  ASN  77          2HD2      ASN  77 -11.810   7.331 -18.854
  569   1HD2  ASN  77          1HD2      ASN  77 -13.206   6.495 -19.434
  570    H    ILE  78           H        ILE  78 -10.095   3.755 -14.396
  571    HA   ILE  78           HA       ILE  78  -9.238   1.312 -15.769
  572    HB   ILE  78           HB       ILE  78  -7.536   1.002 -14.347
  573   1HG1  ILE  78          1HG1      ILE  78  -9.553   1.715 -12.317
  574   2HG1  ILE  78          2HG1      ILE  78  -8.332   0.449 -12.292
  575   1HG2  ILE  78          1HG2      ILE  78  -7.448   3.383 -15.172
  576   2HG2  ILE  78          2HG2      ILE  78  -7.990   3.863 -13.564
  577   3HG2  ILE  78          3HG2      ILE  78  -6.457   3.013 -13.761
  578   1HD1  ILE  78          1HD1      ILE  78  -6.648   2.206 -11.740
  579   2HD1  ILE  78          2HD1      ILE  78  -7.984   3.346 -11.576
  580   3HD1  ILE  78          3HD1      ILE  78  -7.882   1.947 -10.508
  581    HA   PRO  79           HA       PRO  79 -12.572  -0.770 -13.716
  582   1HB   PRO  79          1HB       PRO  79 -11.187  -3.299 -13.807
  583   2HB   PRO  79          2HB       PRO  79 -12.493  -2.734 -14.848
  584   1HG   PRO  79          1HG       PRO  79  -9.916  -3.152 -15.699
  585   2HG   PRO  79          2HG       PRO  79 -11.056  -2.043 -16.480
  586   1HD   PRO  79          1HD       PRO  79  -8.824  -1.445 -14.580
  587   2HD   PRO  79          2HD       PRO  79  -9.363  -0.539 -16.012
  588    H    CYS  80           H        CYS  80 -12.779  -0.375 -11.575
  589    HA   CYS  80           HA       CYS  80 -10.724  -0.602  -9.691
  590   1HB   CYS  80          1HB       CYS  80 -13.614  -0.806  -8.916
  591   2HB   CYS  80          2HB       CYS  80 -12.301   0.032  -8.095
  592    H    SER  81           H        SER  81 -13.606  -2.705 -10.011
  593    HA   SER  81           HA       SER  81 -12.846  -4.613  -8.156
  594   1HB   SER  81          1HB       SER  81 -14.509  -6.032  -9.105
  595   2HB   SER  81          2HB       SER  81 -15.088  -4.379  -9.309
  596    HG   SER  81           HG       SER  81 -14.563  -4.459 -11.449
  597    H    ALA  82           H        ALA  82 -11.661  -4.167 -11.405
  598    HA   ALA  82           HA       ALA  82 -10.611  -6.812 -11.712
  599   1HB   ALA  82          1HB       ALA  82 -11.159  -4.991 -13.510
  600   2HB   ALA  82          2HB       ALA  82  -9.844  -6.138 -13.766
  601   3HB   ALA  82          3HB       ALA  82  -9.491  -4.499 -13.219
  602    H    LEU  83           H        LEU  83  -9.675  -4.204  -9.849
  603    HA   LEU  83           HA       LEU  83  -6.852  -5.027  -9.816
  604   1HB   LEU  83          1HB       LEU  83  -6.259  -2.923  -9.131
  605   2HB   LEU  83          2HB       LEU  83  -7.672  -2.554 -10.100
  606    HG   LEU  83           HG       LEU  83  -8.797  -2.877  -7.637
  607   1HD1  LEU  83          1HD1      LEU  83  -6.389  -3.074  -6.777
  608   2HD1  LEU  83          2HD1      LEU  83  -6.281  -1.341  -7.092
  609   3HD1  LEU  83          3HD1      LEU  83  -7.476  -1.958  -5.950
  610   1HD2  LEU  83          1HD2      LEU  83  -9.099  -1.047  -9.312
  611   2HD2  LEU  83          2HD2      LEU  83  -9.060  -0.505  -7.634
  612   3HD2  LEU  83          3HD2      LEU  83  -7.644  -0.290  -8.664
  613    H    LEU  84           H        LEU  84  -9.744  -5.387  -8.165
  614    HA   LEU  84           HA       LEU  84  -8.382  -5.974  -5.628
  615   1HB   LEU  84          1HB       LEU  84 -11.348  -5.820  -5.846
  616   2HB   LEU  84          2HB       LEU  84 -10.303  -5.399  -4.502
  617    HG   LEU  84           HG       LEU  84 -10.112  -3.743  -6.960
  618   1HD1  LEU  84          1HD1      LEU  84 -12.606  -4.239  -6.091
  619   2HD1  LEU  84          2HD1      LEU  84 -12.172  -2.891  -5.039
  620   3HD1  LEU  84          3HD1      LEU  84 -12.098  -2.702  -6.791
  621   1HD2  LEU  84          1HD2      LEU  84  -8.855  -3.606  -4.627
  622   2HD2  LEU  84          2HD2      LEU  84  -9.265  -2.167  -5.561
  623   3HD2  LEU  84          3HD2      LEU  84 -10.281  -2.658  -4.206
  624    H    SER  85           H        SER  85  -8.181  -7.782  -7.744
  625    HA   SER  85           HA       SER  85  -9.699 -10.039  -6.649
  626   1HB   SER  85          1HB       SER  85  -9.897 -11.025  -8.890
  627   2HB   SER  85          2HB       SER  85 -10.647  -9.429  -8.857
  628    HG   SER  85           HG       SER  85  -9.239  -8.763 -10.265
  629    H    SER  86           H        SER  86  -7.211  -9.096  -5.955
  630    HA   SER  86           HA       SER  86  -5.205  -9.949  -5.265
  631   1HB   SER  86          1HB       SER  86  -6.370 -12.200  -5.307
  632   2HB   SER  86          2HB       SER  86  -5.785 -12.393  -6.960
  633    HG   SER  86           HG       SER  86  -4.258 -12.154  -4.585
  634    H    ASP  87           H        ASP  87  -5.996  -8.610  -7.822
  635    HA   ASP  87           HA       ASP  87  -3.536  -9.068  -9.360
  636   1HB   ASP  87          1HB       ASP  87  -5.787  -9.693 -10.356
  637   2HB   ASP  87          2HB       ASP  87  -6.153  -7.975 -10.360
  638    H    ILE  88           H        ILE  88  -2.137  -7.406  -9.111
  639    HA   ILE  88           HA       ILE  88  -3.139  -4.797  -8.316
  640    HB   ILE  88           HB       ILE  88  -0.519  -4.344  -8.537
  641   1HG1  ILE  88          1HG1      ILE  88  -0.445  -7.195  -7.631
  642   2HG1  ILE  88          2HG1      ILE  88  -0.392  -6.845  -9.355
  643   1HG2  ILE  88          1HG2      ILE  88  -2.142  -5.529  -6.340
  644   2HG2  ILE  88          2HG2      ILE  88  -0.410  -5.287  -6.106
  645   3HG2  ILE  88          3HG2      ILE  88  -1.448  -3.914  -6.489
  646   1HD1  ILE  88          1HD1      ILE  88   1.462  -5.205  -7.862
  647   2HD1  ILE  88          2HD1      ILE  88   1.748  -6.929  -7.624
  648   3HD1  ILE  88          3HD1      ILE  88   1.741  -6.253  -9.253
  649    H    THR  89           H        THR  89  -2.569  -6.374 -11.203
  650    HA   THR  89           HA       THR  89  -1.221  -4.676 -12.848
  651    HB   THR  89           HB       THR  89  -3.829  -5.856 -13.764
  652    HG1  THR  89           HG1      THR  89  -1.703  -7.166 -12.638
  653   1HG2  THR  89          1HG2      THR  89  -1.975  -4.494 -15.141
  654   2HG2  THR  89          2HG2      THR  89  -1.293  -6.116 -15.270
  655   3HG2  THR  89          3HG2      THR  89  -2.928  -5.798 -15.849
  656    H    ALA  90           H        ALA  90  -4.743  -4.484 -12.260
  657    HA   ALA  90           HA       ALA  90  -5.142  -2.151 -13.687
  658   1HB   ALA  90          1HB       ALA  90  -6.692  -3.692 -11.710
  659   2HB   ALA  90          2HB       ALA  90  -7.193  -2.027 -12.000
  660   3HB   ALA  90          3HB       ALA  90  -7.125  -3.172 -13.339
  661    H    SER  91           H        SER  91  -4.530  -2.623 -10.221
  662    HA   SER  91           HA       SER  91  -4.815   0.082  -9.466
  663   1HB   SER  91          1HB       SER  91  -2.930  -1.132  -7.743
  664   2HB   SER  91          2HB       SER  91  -4.654  -0.896  -7.459
  665    HG   SER  91           HG       SER  91  -3.796  -3.131  -7.383
  666    H    VAL  92           H        VAL  92  -2.103  -1.757 -10.663
  667    HA   VAL  92           HA       VAL  92  -0.219   0.318 -10.126
  668    HB   VAL  92           HB       VAL  92   0.028  -2.112 -11.894
  669   1HG1  VAL  92          1HG1      VAL  92   1.807   0.252 -11.554
  670   2HG1  VAL  92          2HG1      VAL  92   2.564  -1.337 -11.667
  671   3HG1  VAL  92          3HG1      VAL  92   1.531  -0.757 -12.973
  672   1HG2  VAL  92          1HG2      VAL  92  -0.014  -2.517  -9.468
  673   2HG2  VAL  92          2HG2      VAL  92   1.560  -2.891 -10.168
  674   3HG2  VAL  92          3HG2      VAL  92   1.330  -1.394  -9.265
  675    H    ASN  93           H        ASN  93  -1.735  -0.861 -13.141
  676    HA   ASN  93           HA       ASN  93  -0.654   0.801 -14.926
  677   1HB   ASN  93          1HB       ASN  93  -2.157  -0.212 -16.189
  678   2HB   ASN  93          2HB       ASN  93  -2.977  -0.752 -14.747
  679   2HD2  ASN  93          2HD2      ASN  93  -2.872   1.651 -17.244
  680   1HD2  ASN  93          1HD2      ASN  93  -4.442   2.314 -16.957
  681    H    CYS  94           H        CYS  94  -3.209   1.521 -12.654
  682    HA   CYS  94           HA       CYS  94  -3.759   4.140 -13.509
  683   1HB   CYS  94          1HB       CYS  94  -5.026   2.606 -11.815
  684   2HB   CYS  94          2HB       CYS  94  -3.964   3.352 -10.624
  685    H    ALA  95           H        ALA  95  -1.594   2.925 -10.940
  686    HA   ALA  95           HA       ALA  95  -0.637   5.533 -10.296
  687   1HB   ALA  95          1HB       ALA  95  -0.556   3.733  -8.679
  688   2HB   ALA  95          2HB       ALA  95   0.632   2.889  -9.675
  689   3HB   ALA  95          3HB       ALA  95   1.035   4.445  -8.948
  690    H    LYS  96           H        LYS  96   0.510   2.991 -12.460
  691    HA   LYS  96           HA       LYS  96   3.036   3.888 -13.058
  692   1HB   LYS  96          1HB       LYS  96   1.044   2.227 -14.343
  693   2HB   LYS  96          2HB       LYS  96   1.874   3.214 -15.539
  694   1HG   LYS  96          1HG       LYS  96   4.018   2.359 -14.796
  695   2HG   LYS  96          2HG       LYS  96   3.223   1.419 -13.531
  696   1HD   LYS  96          1HD       LYS  96   3.354  -0.219 -15.091
  697   2HD   LYS  96          2HD       LYS  96   1.859   0.529 -15.658
  698   1HE   LYS  96          1HE       LYS  96   3.193   1.907 -17.223
  699   2HE   LYS  96          2HE       LYS  96   4.641   1.045 -16.702
  700   1HZ   LYS  96          1HZ       LYS  96   3.552  -1.030 -17.456
  701   2HZ   LYS  96          2HZ       LYS  96   2.283  -0.107 -18.089
  702   3HZ   LYS  96          3HZ       LYS  96   3.846   0.066 -18.710
  703    H    LYS  97           H        LYS  97  -0.092   4.959 -13.934
  704    HA   LYS  97           HA       LYS  97   0.764   7.097 -15.700
  705   1HB   LYS  97          1HB       LYS  97  -1.731   5.791 -15.064
  706   2HB   LYS  97          2HB       LYS  97  -1.914   7.535 -14.938
  707   1HG   LYS  97          1HG       LYS  97  -0.890   7.695 -17.233
  708   2HG   LYS  97          2HG       LYS  97  -1.048   5.940 -17.332
  709   1HD   LYS  97          1HD       LYS  97  -3.066   6.411 -18.213
  710   2HD   LYS  97          2HD       LYS  97  -3.542   6.633 -16.528
  711   1HE   LYS  97          1HE       LYS  97  -2.491   9.078 -17.160
  712   2HE   LYS  97          2HE       LYS  97  -3.246   8.596 -18.680
  713   1HZ   LYS  97          1HZ       LYS  97  -5.266   8.068 -17.254
  714   2HZ   LYS  97          2HZ       LYS  97  -4.516   8.970 -16.037
  715   3HZ   LYS  97          3HZ       LYS  97  -4.910   9.702 -17.510
  716    H    ILE  98           H        ILE  98  -0.305   6.683 -12.377
  717    HA   ILE  98           HA       ILE  98  -0.647   9.367 -11.703
  718    HB   ILE  98           HB       ILE  98   0.178   7.062  -9.963
  719   1HG1  ILE  98          1HG1      ILE  98  -2.479   8.502 -10.173
  720   2HG1  ILE  98          2HG1      ILE  98  -2.102   7.034 -11.068
  721   1HG2  ILE  98          1HG2      ILE  98  -0.224   9.940  -9.351
  722   2HG2  ILE  98          2HG2      ILE  98  -0.829   8.756  -8.194
  723   3HG2  ILE  98          3HG2      ILE  98   0.881   8.772  -8.626
  724   1HD1  ILE  98          1HD1      ILE  98  -2.159   7.302  -8.072
  725   2HD1  ILE  98          2HD1      ILE  98  -3.401   6.554  -9.075
  726   3HD1  ILE  98          3HD1      ILE  98  -1.796   5.830  -8.972
  727    H    VAL  99           H        VAL  99   2.188   7.290 -11.380
  728    HA   VAL  99           HA       VAL  99   3.895   9.375 -10.456
  729    HB   VAL  99           HB       VAL  99   4.130   6.825 -10.107
  730   1HG1  VAL  99          1HG1      VAL  99   4.194   6.357 -12.575
  731   2HG1  VAL  99          2HG1      VAL  99   5.801   7.082 -12.596
  732   3HG1  VAL  99          3HG1      VAL  99   5.501   5.631 -11.638
  733   1HG2  VAL  99          1HG2      VAL  99   6.499   8.583 -10.714
  734   2HG2  VAL  99          2HG2      VAL  99   5.653   8.449  -9.174
  735   3HG2  VAL  99          3HG2      VAL  99   6.562   7.075  -9.802
  736    H    SER 100           H        SER 100   2.949   8.203 -13.589
  737    HA   SER 100           HA       SER 100   5.180   9.464 -14.948
  738   1HB   SER 100          1HB       SER 100   4.128   7.391 -15.845
  739   2HB   SER 100          2HB       SER 100   2.637   8.296 -16.111
  740    HG   SER 100           HG       SER 100   3.620   9.471 -17.675
  741    H    ASP 101           H        ASP 101   2.358  10.454 -13.538
  742    HA   ASP 101           HA       ASP 101   1.864  12.655 -15.402
  743   1HB   ASP 101          1HB       ASP 101   0.086  11.122 -14.104
  744   2HB   ASP 101          2HB       ASP 101   0.276  12.398 -12.904
  745    H    GLY 102           H        GLY 102   3.821  12.063 -12.802
  746   1HA   GLY 102          1HA       GLY 102   3.656  14.852 -11.847
  747   2HA   GLY 102          2HA       GLY 102   5.192  14.159 -12.344
  748    H    ASN 103           H        ASN 103   2.503  12.971 -10.324
  749    HA   ASN 103           HA       ASN 103   3.775  13.211  -7.859
  750   1HB   ASN 103          1HB       ASN 103   1.710  11.176  -8.722
  751   2HB   ASN 103          2HB       ASN 103   2.135  11.546  -7.054
  752   2HD2  ASN 103          2HD2      ASN 103   0.059  12.226  -9.552
  753   1HD2  ASN 103          1HD2      ASN 103  -0.603  13.708  -8.959
  754    H    GLY 104           H        GLY 104   5.872  12.506  -7.804
  755   1HA   GLY 104          1HA       GLY 104   7.634  10.982  -8.234
  756   2HA   GLY 104          2HA       GLY 104   6.442   9.737  -8.562
  757    H    MET 105           H        MET 105   5.031   9.224  -6.554
  758    HA   MET 105           HA       MET 105   5.143   7.919  -4.665
  759   1HB   MET 105          1HB       MET 105   7.860   9.118  -4.101
  760   2HB   MET 105          2HB       MET 105   7.127   7.739  -3.296
  761   1HG   MET 105          1HG       MET 105   8.430   7.919  -5.951
  762   2HG   MET 105          2HG       MET 105   8.545   6.670  -4.715
  763   1HE   MET 105          1HE       MET 105   6.451   5.630  -3.887
  764   2HE   MET 105          2HE       MET 105   4.932   5.483  -4.772
  765   3HE   MET 105          3HE       MET 105   6.210   4.291  -5.009
  766    H    ASN 106           H        ASN 106   4.899  11.052  -5.151
  767    HA   ASN 106           HA       ASN 106   4.802  11.922  -2.382
  768   1HB   ASN 106          1HB       ASN 106   4.829  13.212  -5.049
  769   2HB   ASN 106          2HB       ASN 106   3.966  14.054  -3.775
  770   2HD2  ASN 106          2HD2      ASN 106   6.973  13.334  -5.131
  771   1HD2  ASN 106          1HD2      ASN 106   7.970  14.085  -3.936
  772    H    ALA 107           H        ALA 107   2.664  11.133  -5.049
  773    HA   ALA 107           HA       ALA 107   0.287  12.263  -4.069
  774   1HB   ALA 107          1HB       ALA 107   1.038  10.359  -6.138
  775   2HB   ALA 107          2HB       ALA 107  -0.536  10.012  -5.422
  776   3HB   ALA 107          3HB       ALA 107  -0.221  11.594  -6.137
  777    H    TRP 108           H        TRP 108   2.150   9.818  -2.781
  778    HA   TRP 108           HA       TRP 108  -0.142   8.697  -1.315
  779   1HB   TRP 108          1HB       TRP 108   2.541   7.409  -1.862
  780   2HB   TRP 108          2HB       TRP 108   1.194   6.668  -1.001
  781    HD1  TRP 108           HD1      TRP 108  -0.940   5.919  -2.466
  782    HE1  TRP 108           HE1      TRP 108  -1.196   5.405  -4.975
  783    HE3  TRP 108           HE3      TRP 108   3.367   8.071  -4.184
  784    HZ2  TRP 108           HZ2      TRP 108   0.234   5.853  -7.373
  785    HZ3  TRP 108           HZ3      TRP 108   3.848   7.987  -6.595
  786    HH2  TRP 108           HH2      TRP 108   2.314   6.901  -8.153
  787    H    VAL 109           H        VAL 109  -0.304   9.326   0.695
  788    HA   VAL 109           HA       VAL 109   1.701  10.835   2.020
  789    HB   VAL 109           HB       VAL 109  -0.403   9.785   3.676
  790   1HG1  VAL 109          1HG1      VAL 109   0.822  12.428   3.072
  791   2HG1  VAL 109          2HG1      VAL 109  -0.712  12.349   3.940
  792   3HG1  VAL 109          3HG1      VAL 109   0.722  11.567   4.607
  793   1HG2  VAL 109          1HG2      VAL 109  -1.043  11.198   1.125
  794   2HG2  VAL 109          2HG2      VAL 109  -1.828   9.790   1.840
  795   3HG2  VAL 109          3HG2      VAL 109  -2.076  11.389   2.542
  796    H    ALA 110           H        ALA 110   0.887   7.460   2.076
  797    HA   ALA 110           HA       ALA 110   1.989   6.872   4.624
  798   1HB   ALA 110          1HB       ALA 110   2.031   4.825   2.469
  799   2HB   ALA 110          2HB       ALA 110   1.547   4.679   4.159
  800   3HB   ALA 110          3HB       ALA 110   0.468   5.450   2.996
  801    H    TRP 111           H        TRP 111   3.351   7.535   1.565
  802    HA   TRP 111           HA       TRP 111   5.903   6.307   2.203
  803   1HB   TRP 111          1HB       TRP 111   5.177   6.219  -0.114
  804   2HB   TRP 111          2HB       TRP 111   5.047   7.969  -0.175
  805    HD1  TRP 111           HD1      TRP 111   7.573   5.147  -0.384
  806    HE1  TRP 111           HE1      TRP 111   9.849   6.103  -1.115
  807    HE3  TRP 111           HE3      TRP 111   6.514  10.138  -0.031
  808    HZ2  TRP 111           HZ2      TRP 111  11.037   8.634  -1.492
  809    HZ3  TRP 111           HZ3      TRP 111   8.276  11.759  -0.595
  810    HH2  TRP 111           HH2      TRP 111  10.491  11.021  -1.309
  811    H    ARG 112           H        ARG 112   4.443   9.537   2.068
  812    HA   ARG 112           HA       ARG 112   6.965  10.763   2.870
  813   1HB   ARG 112          1HB       ARG 112   4.540  11.623   1.553
  814   2HB   ARG 112          2HB       ARG 112   4.949  12.681   2.895
  815   1HG   ARG 112          1HG       ARG 112   7.299  12.746   1.872
  816   2HG   ARG 112          2HG       ARG 112   6.534  12.086   0.425
  817   1HD   ARG 112          1HD       ARG 112   6.296  14.288  -0.059
  818   2HD   ARG 112          2HD       ARG 112   4.837  14.084   0.911
  819    HE   ARG 112           HE       ARG 112   7.123  14.832   2.468
  820   1HH1  ARG 112          1HH1      ARG 112   4.543  16.030   0.458
  821   2HH1  ARG 112          2HH1      ARG 112   4.544  17.607   1.174
  822   1HH2  ARG 112          1HH2      ARG 112   7.132  16.905   3.417
  823   2HH2  ARG 112          2HH2      ARG 112   6.016  18.105   2.856
  824    H    ASN 113           H        ASN 113   6.026   9.027   4.756
  825    HA   ASN 113           HA       ASN 113   5.590  10.817   6.987
  826   1HB   ASN 113          1HB       ASN 113   3.323   9.826   5.876
  827   2HB   ASN 113          2HB       ASN 113   3.684   8.560   7.046
  828   2HD2  ASN 113          2HD2      ASN 113   2.331   8.876   8.670
  829   1HD2  ASN 113          1HD2      ASN 113   2.092  10.368   9.506
  830    H    ARG 114           H        ARG 114   5.240   7.343   6.322
  831    HA   ARG 114           HA       ARG 114   6.969   6.783   8.616
  832   1HB   ARG 114          1HB       ARG 114   4.841   5.311   7.166
  833   2HB   ARG 114          2HB       ARG 114   6.136   4.357   7.865
  834   1HG   ARG 114          1HG       ARG 114   4.732   6.402   9.524
  835   2HG   ARG 114          2HG       ARG 114   3.987   4.828   9.238
  836   1HD   ARG 114          1HD       ARG 114   5.235   3.967  10.859
  837   2HD   ARG 114          2HD       ARG 114   6.682   4.353   9.928
  838    HE   ARG 114           HE       ARG 114   5.794   6.648  11.303
  839   1HH1  ARG 114          1HH1      ARG 114   7.301   3.559  11.876
  840   2HH1  ARG 114          2HH1      ARG 114   8.144   4.088  13.294
  841   1HH2  ARG 114          1HH2      ARG 114   6.900   7.354  13.167
  842   2HH2  ARG 114          2HH2      ARG 114   7.915   6.245  14.028
  843    H    CYS 115           H        CYS 115   7.292   7.202   5.362
  844    HA   CYS 115           HA       CYS 115   9.457   5.216   5.179
  845   1HB   CYS 115          1HB       CYS 115   7.586   4.998   3.535
  846   2HB   CYS 115          2HB       CYS 115   8.043   6.570   2.885
  847    H    LYS 116           H        LYS 116   8.611   8.563   4.298
  848    HA   LYS 116           HA       LYS 116  11.038   9.328   3.209
  849   1HB   LYS 116          1HB       LYS 116   8.781  10.606   3.426
  850   2HB   LYS 116          2HB       LYS 116   9.457  11.207   4.934
  851   1HG   LYS 116          1HG       LYS 116  11.471  11.574   3.046
  852   2HG   LYS 116          2HG       LYS 116   9.977  12.036   2.229
  853   1HD   LYS 116          1HD       LYS 116   9.674  13.194   4.690
  854   2HD   LYS 116          2HD       LYS 116  11.411  13.348   4.417
  855   1HE   LYS 116          1HE       LYS 116   9.315  14.181   2.420
  856   2HE   LYS 116          2HE       LYS 116  10.037  15.277   3.598
  857   1HZ   LYS 116          1HZ       LYS 116  12.154  14.030   2.364
  858   2HZ   LYS 116          2HZ       LYS 116  11.074  14.381   1.109
  859   3HZ   LYS 116          3HZ       LYS 116  11.631  15.619   2.116
  860    H    GLY 117           H        GLY 117  12.837   8.570   4.281
  861   1HA   GLY 117          1HA       GLY 117  13.237   9.596   7.020
  862   2HA   GLY 117          2HA       GLY 117  14.481   9.751   5.791
  863    H    THR 118           H        THR 118  13.197   6.857   5.072
  864    HA   THR 118           HA       THR 118  14.927   5.429   6.981
  865    HB   THR 118           HB       THR 118  13.519   3.446   6.614
  866    HG1  THR 118           HG1      THR 118  12.754   4.077   4.499
  867   1HG2  THR 118          1HG2      THR 118  12.818   5.775   8.040
  868   2HG2  THR 118          2HG2      THR 118  11.332   5.159   7.320
  869   3HG2  THR 118          3HG2      THR 118  12.306   4.118   8.358
  870    H    ASP 119           H        ASP 119  14.609   2.945   5.423
  871    HA   ASP 119           HA       ASP 119  16.154   3.602   3.027
  872   1HB   ASP 119          1HB       ASP 119  17.440   2.749   5.122
  873   2HB   ASP 119          2HB       ASP 119  16.872   1.205   4.530
  874    H    VAL 120           H        VAL 120  14.783   3.063   1.449
  875    HA   VAL 120           HA       VAL 120  13.005   0.836   1.609
  876    HB   VAL 120           HB       VAL 120  12.375   1.393  -0.677
  877   1HG1  VAL 120          1HG1      VAL 120  11.468   2.711   1.213
  878   2HG1  VAL 120          2HG1      VAL 120  12.736   3.907   0.947
  879   3HG1  VAL 120          3HG1      VAL 120  11.524   3.616  -0.300
  880   1HG2  VAL 120          1HG2      VAL 120  15.003   2.512  -0.768
  881   2HG2  VAL 120          2HG2      VAL 120  13.864   2.247  -2.087
  882   3HG2  VAL 120          3HG2      VAL 120  13.826   3.759  -1.180
  883    H    GLN 121           H        GLN 121  16.166   1.454   0.249
  884    HA   GLN 121           HA       GLN 121  16.359  -0.728  -1.499
  885   1HB   GLN 121          1HB       GLN 121  18.002   1.303  -0.923
  886   2HB   GLN 121          2HB       GLN 121  18.760   0.070   0.075
  887   1HG   GLN 121          1HG       GLN 121  19.832  -0.672  -1.705
  888   2HG   GLN 121          2HG       GLN 121  18.285  -1.114  -2.427
  889   2HE2  GLN 121          2HE2      GLN 121  18.760  -0.608  -4.506
  890   1HE2  GLN 121          1HE2      GLN 121  19.088   0.997  -5.058
  891    H    ALA 122           H        ALA 122  16.384  -0.488   1.924
  892    HA   ALA 122           HA       ALA 122  17.460  -3.162   2.316
  893   1HB   ALA 122          1HB       ALA 122  16.744  -0.892   4.115
  894   2HB   ALA 122          2HB       ALA 122  16.836  -2.524   4.777
  895   3HB   ALA 122          3HB       ALA 122  18.247  -1.806   4.001
  896    H    TRP 123           H        TRP 123  14.429  -1.545   2.003
  897    HA   TRP 123           HA       TRP 123  12.781  -3.295   3.477
  898   1HB   TRP 123          1HB       TRP 123  12.359  -1.328   1.289
  899   2HB   TRP 123          2HB       TRP 123  11.084  -2.510   1.564
  900    HD1  TRP 123           HD1      TRP 123  11.454   0.838   2.318
  901    HE1  TRP 123           HE1      TRP 123  10.511   1.522   4.613
  902    HE3  TRP 123           HE3      TRP 123  11.189  -3.748   4.527
  903    HZ2  TRP 123           HZ2      TRP 123   9.766   0.249   7.009
  904    HZ3  TRP 123           HZ3      TRP 123  10.354  -3.937   6.813
  905    HH2  TRP 123           HH2      TRP 123   9.649  -1.956   8.042
  906    H    ILE 124           H        ILE 124  14.480  -3.751   0.553
  907    HA   ILE 124           HA       ILE 124  13.014  -6.265   0.088
  908    HB   ILE 124           HB       ILE 124  13.704  -6.018  -2.335
  909   1HG1  ILE 124          1HG1      ILE 124  13.740  -3.080  -2.023
  910   2HG1  ILE 124          2HG1      ILE 124  15.184  -3.915  -1.460
  911   1HG2  ILE 124          1HG2      ILE 124  11.417  -5.483  -1.180
  912   2HG2  ILE 124          2HG2      ILE 124  11.818  -3.824  -1.625
  913   3HG2  ILE 124          3HG2      ILE 124  11.686  -5.064  -2.872
  914   1HD1  ILE 124          1HD1      ILE 124  13.991  -4.155  -4.212
  915   2HD1  ILE 124          2HD1      ILE 124  15.387  -3.169  -3.775
  916   3HD1  ILE 124          3HD1      ILE 124  15.472  -4.926  -3.643
  917    H    ARG 125           H        ARG 125  15.660  -5.250   1.408
  918    HA   ARG 125           HA       ARG 125  17.778  -6.478  -0.017
  919   1HB   ARG 125          1HB       ARG 125  17.588  -4.846   2.192
  920   2HB   ARG 125          2HB       ARG 125  18.109  -6.374   2.892
  921   1HG   ARG 125          1HG       ARG 125  19.719  -6.033   0.648
  922   2HG   ARG 125          2HG       ARG 125  19.612  -4.434   1.386
  923   1HD   ARG 125          1HD       ARG 125  20.054  -6.690   3.235
  924   2HD   ARG 125          2HD       ARG 125  21.383  -6.319   2.138
  925    HE   ARG 125           HE       ARG 125  20.484  -3.937   3.316
  926   1HH1  ARG 125          1HH1      ARG 125  22.140  -6.882   4.167
  927   2HH1  ARG 125          2HH1      ARG 125  23.036  -6.156   5.460
  928   1HH2  ARG 125          1HH2      ARG 125  21.659  -2.974   5.017
  929   2HH2  ARG 125          2HH2      ARG 125  22.761  -3.936   5.943
  930    H    GLY 126           H        GLY 126  17.334  -8.574  -0.588
  931   1HA   GLY 126          1HA       GLY 126  16.984 -10.472   1.651
  932   2HA   GLY 126          2HA       GLY 126  18.036 -10.796   0.282
  933    H    CYS 127           H        CYS 127  15.366  -9.192  -0.846
  934    HA   CYS 127           HA       CYS 127  13.441 -11.238  -0.929
  935   1HB   CYS 127          1HB       CYS 127  13.819  -8.644  -2.192
  936   2HB   CYS 127          2HB       CYS 127  12.714  -9.735  -3.003
  937    H    ARG 128           H        ARG 128  12.577 -11.629  -3.420
  938    HA   ARG 128           HA       ARG 128  14.854 -12.666  -4.957
  939   1HB   ARG 128          1HB       ARG 128  12.425 -14.197  -4.052
  940   2HB   ARG 128          2HB       ARG 128  13.373 -14.705  -5.442
  941   1HG   ARG 128          1HG       ARG 128  14.668 -15.828  -4.042
  942   2HG   ARG 128          2HG       ARG 128  15.242 -14.277  -3.424
  943   1HD   ARG 128          1HD       ARG 128  14.465 -15.687  -1.604
  944   2HD   ARG 128          2HD       ARG 128  13.430 -14.270  -1.776
  945    HE   ARG 128           HE       ARG 128  11.830 -15.759  -2.928
  946   1HH1  ARG 128          1HH1      ARG 128  14.262 -17.151  -0.856
  947   2HH1  ARG 128          2HH1      ARG 128  13.348 -18.587  -0.533
  948   1HH2  ARG 128          1HH2      ARG 128  10.621 -17.644  -2.507
  949   2HH2  ARG 128          2HH2      ARG 128  11.279 -18.868  -1.472
  950    H    LEU 129           H        LEU 129  14.533 -10.916  -6.389
  951    HA   LEU 129           HA       LEU 129  12.618 -11.468  -8.459
  952   1HB   LEU 129          1HB       LEU 129  11.772  -9.034  -8.366
  953   2HB   LEU 129          2HB       LEU 129  11.069 -10.215  -7.276
  954    HG   LEU 129           HG       LEU 129  13.344  -8.878  -6.069
  955   1HD1  LEU 129          1HD1      LEU 129  12.346  -7.125  -7.688
  956   2HD1  LEU 129          2HD1      LEU 129  11.003  -7.079  -6.545
  957   3HD1  LEU 129          3HD1      LEU 129  12.634  -6.676  -6.007
  958   1HD2  LEU 129          1HD2      LEU 129  11.648 -10.216  -4.887
  959   2HD2  LEU 129          2HD2      LEU 129  11.775  -8.576  -4.252
  960   3HD2  LEU 129          3HD2      LEU 129  10.429  -9.012  -5.306

  No H/Q in entry =         960
  Start of MODEL    7
    1    H1   LYS   1           H1       LYS   1  -7.549  -8.621   0.387
    2    H2   LYS   1           H2       LYS   1  -8.230 -10.124   0.763
    3    H3   LYS   1           H3       LYS   1  -7.411  -9.244   1.953
    4    HA   LYS   1           HA       LYS   1  -5.974 -10.972   1.256
    5   1HB   LYS   1          1HB       LYS   1  -7.355 -10.781  -1.093
    6   2HB   LYS   1          2HB       LYS   1  -5.813 -10.066  -1.544
    7   1HG   LYS   1          1HG       LYS   1  -5.150 -12.153  -1.936
    8   2HG   LYS   1          2HG       LYS   1  -5.047 -12.317  -0.181
    9   1HD   LYS   1          1HD       LYS   1  -6.425 -14.071  -0.547
   10   2HD   LYS   1          2HD       LYS   1  -7.667 -12.816  -0.541
   11   1HE   LYS   1          1HE       LYS   1  -8.001 -14.233  -2.455
   12   2HE   LYS   1          2HE       LYS   1  -7.445 -12.651  -3.003
   13   1HZ   LYS   1          1HZ       LYS   1  -5.158 -13.656  -3.057
   14   2HZ   LYS   1          2HZ       LYS   1  -5.888 -15.167  -2.843
   15   3HZ   LYS   1          3HZ       LYS   1  -6.239 -14.246  -4.217
   16    H    VAL   2           H        VAL   2  -4.086 -10.304   2.018
   17    HA   VAL   2           HA       VAL   2  -2.986  -7.750   1.044
   18    HB   VAL   2           HB       VAL   2  -2.576  -9.138   3.696
   19   1HG1  VAL   2          1HG1      VAL   2  -0.633  -7.740   2.441
   20   2HG1  VAL   2          2HG1      VAL   2  -1.474  -6.438   3.279
   21   3HG1  VAL   2          3HG1      VAL   2  -0.824  -7.797   4.193
   22   1HG2  VAL   2          1HG2      VAL   2  -4.610  -7.507   2.947
   23   2HG2  VAL   2          2HG2      VAL   2  -4.016  -7.669   4.600
   24   3HG2  VAL   2          3HG2      VAL   2  -3.452  -6.341   3.586
   25    H    PHE   3           H        PHE   3  -1.132  -7.813  -0.096
   26    HA   PHE   3           HA       PHE   3   0.181 -10.295  -0.622
   27   1HB   PHE   3          1HB       PHE   3   1.020  -7.455  -1.252
   28   2HB   PHE   3          2HB       PHE   3   1.806  -8.896  -1.875
   29    HD1  PHE   3           HD1      PHE   3  -1.364  -9.993  -1.965
   30    HD2  PHE   3           HD2      PHE   3   1.021  -6.951  -3.738
   31    HE1  PHE   3           HE1      PHE   3  -2.861  -9.956  -3.918
   32    HE2  PHE   3           HE2      PHE   3  -0.464  -6.908  -5.687
   33    HZ   PHE   3           HZ       PHE   3  -2.406  -8.413  -5.786
   34    H    GLY   4           H        GLY   4   2.757 -10.094  -0.560
   35   1HA   GLY   4          1HA       GLY   4   4.285 -10.698   1.180
   36   2HA   GLY   4          2HA       GLY   4   3.418  -9.615   2.264
   37    H    ARG   5           H        ARG   5   6.296  -9.716   1.591
   38    HA   ARG   5           HA       ARG   5   6.576  -6.890   0.939
   39   1HB   ARG   5          1HB       ARG   5   8.627  -8.888   1.913
   40   2HB   ARG   5          2HB       ARG   5   8.907  -7.166   1.699
   41   1HG   ARG   5          1HG       ARG   5   7.424  -6.613   3.464
   42   2HG   ARG   5          2HG       ARG   5   6.817  -8.268   3.556
   43   1HD   ARG   5          1HD       ARG   5   9.454  -8.692   3.942
   44   2HD   ARG   5          2HD       ARG   5   9.288  -7.085   4.645
   45    HE   ARG   5           HE       ARG   5   7.363  -9.081   5.514
   46   1HH1  ARG   5          1HH1      ARG   5  10.336  -7.379   6.152
   47   2HH1  ARG   5          2HH1      ARG   5  10.323  -7.730   7.848
   48   1HH2  ARG   5          1HH2      ARG   5   7.338  -9.547   7.745
   49   2HH2  ARG   5          2HH2      ARG   5   8.618  -8.963   8.753
   50    H    CYS   6           H        CYS   6   8.199  -9.914  -0.063
   51    HA   CYS   6           HA       CYS   6   9.185  -8.569  -2.419
   52   1HB   CYS   6          1HB       CYS   6   9.409 -11.518  -1.897
   53   2HB   CYS   6          2HB       CYS   6  10.449 -10.475  -2.864
   54    H    GLU   7           H        GLU   7   6.752 -11.027  -1.656
   55    HA   GLU   7           HA       GLU   7   6.098 -11.961  -4.149
   56   1HB   GLU   7          1HB       GLU   7   4.970 -12.475  -1.899
   57   2HB   GLU   7          2HB       GLU   7   3.971 -11.061  -2.206
   58   1HG   GLU   7          1HG       GLU   7   2.700 -12.878  -2.936
   59   2HG   GLU   7          2HG       GLU   7   3.351 -12.158  -4.407
   60    H    LEU   8           H        LEU   8   4.915  -9.005  -2.619
   61    HA   LEU   8           HA       LEU   8   3.515  -8.038  -4.876
   62   1HB   LEU   8          1HB       LEU   8   3.057  -7.267  -2.593
   63   2HB   LEU   8          2HB       LEU   8   4.651  -6.545  -2.508
   64    HG   LEU   8           HG       LEU   8   2.531  -5.077  -2.995
   65   1HD1  LEU   8          1HD1      LEU   8   4.966  -4.413  -2.942
   66   2HD1  LEU   8          2HD1      LEU   8   4.969  -4.635  -4.692
   67   3HD1  LEU   8          3HD1      LEU   8   3.910  -3.432  -3.958
   68   1HD2  LEU   8          1HD2      LEU   8   2.155  -6.654  -5.089
   69   2HD2  LEU   8          2HD2      LEU   8   1.746  -4.940  -5.129
   70   3HD2  LEU   8          3HD2      LEU   8   3.257  -5.500  -5.843
   71    H    ALA   9           H        ALA   9   6.835  -7.553  -3.676
   72    HA   ALA   9           HA       ALA   9   7.549  -5.510  -5.474
   73   1HB   ALA   9          1HB       ALA   9   9.375  -7.590  -4.298
   74   2HB   ALA   9          2HB       ALA   9   8.862  -6.112  -3.484
   75   3HB   ALA   9          3HB       ALA   9   9.837  -6.018  -4.951
   76    H    ALA  10           H        ALA  10   8.083  -9.038  -5.735
   77    HA   ALA  10           HA       ALA  10   9.333  -9.102  -8.185
   78   1HB   ALA  10          1HB       ALA  10   7.646 -11.308  -8.230
   79   2HB   ALA  10          2HB       ALA  10   9.279 -11.247  -7.567
   80   3HB   ALA  10          3HB       ALA  10   7.889 -10.982  -6.514
   81    H    ALA  11           H        ALA  11   5.906  -8.833  -7.395
   82    HA   ALA  11           HA       ALA  11   4.944  -9.038 -10.028
   83   1HB   ALA  11          1HB       ALA  11   3.594  -7.432  -7.898
   84   2HB   ALA  11          2HB       ALA  11   3.612  -9.194  -7.857
   85   3HB   ALA  11          3HB       ALA  11   2.858  -8.351  -9.210
   86    H    MET  12           H        MET  12   6.117  -6.452  -8.129
   87    HA   MET  12           HA       MET  12   5.385  -4.283  -9.790
   88   1HB   MET  12          1HB       MET  12   7.912  -4.344  -8.165
   89   2HB   MET  12          2HB       MET  12   6.924  -2.960  -8.563
   90   1HG   MET  12          1HG       MET  12   5.981  -5.191  -6.806
   91   2HG   MET  12          2HG       MET  12   6.778  -3.744  -6.199
   92   1HE   MET  12          1HE       MET  12   5.880  -1.679  -8.182
   93   2HE   MET  12          2HE       MET  12   4.288  -1.047  -7.760
   94   3HE   MET  12          3HE       MET  12   5.547  -1.153  -6.533
   95    H    LYS  13           H        LYS  13   8.401  -6.148  -9.578
   96    HA   LYS  13           HA       LYS  13   9.887  -4.879 -11.523
   97   1HB   LYS  13          1HB       LYS  13  10.341  -7.003  -9.962
   98   2HB   LYS  13          2HB       LYS  13   9.994  -7.853 -11.460
   99   1HG   LYS  13          1HG       LYS  13  11.727  -6.057 -12.398
  100   2HG   LYS  13          2HG       LYS  13  12.296  -6.153 -10.730
  101   1HD   LYS  13          1HD       LYS  13  13.097  -8.243 -10.993
  102   2HD   LYS  13          2HD       LYS  13  11.735  -8.744 -11.996
  103   1HE   LYS  13          1HE       LYS  13  13.988  -6.985 -12.951
  104   2HE   LYS  13          2HE       LYS  13  13.934  -8.733 -13.176
  105   1HZ   LYS  13          1HZ       LYS  13  11.550  -7.989 -14.140
  106   2HZ   LYS  13          2HZ       LYS  13  12.489  -6.648 -14.564
  107   3HZ   LYS  13          3HZ       LYS  13  12.935  -8.194 -15.090
  108    H    ARG  14           H        ARG  14   7.626  -7.587 -11.927
  109    HA   ARG  14           HA       ARG  14   7.871  -7.775 -14.724
  110   1HB   ARG  14          1HB       ARG  14   5.980  -8.771 -12.668
  111   2HB   ARG  14          2HB       ARG  14   5.370  -8.700 -14.315
  112   1HG   ARG  14          1HG       ARG  14   6.309 -10.681 -14.639
  113   2HG   ARG  14          2HG       ARG  14   7.874  -9.869 -14.561
  114   1HD   ARG  14          1HD       ARG  14   7.924 -10.231 -12.133
  115   2HD   ARG  14          2HD       ARG  14   6.376 -11.070 -12.234
  116    HE   ARG  14           HE       ARG  14   8.161 -12.317 -13.985
  117   1HH1  ARG  14          1HH1      ARG  14   7.716 -11.837 -10.563
  118   2HH1  ARG  14          2HH1      ARG  14   8.499 -13.318 -10.123
  119   1HH2  ARG  14          1HH2      ARG  14   9.193 -14.268 -13.415
  120   2HH2  ARG  14          2HH2      ARG  14   9.339 -14.700 -11.744
  121    H    HIS  15           H        HIS  15   5.784  -5.855 -12.615
  122    HA   HIS  15           HA       HIS  15   4.167  -4.859 -14.734
  123   1HB   HIS  15          1HB       HIS  15   4.453  -4.347 -11.817
  124   2HB   HIS  15          2HB       HIS  15   3.669  -3.108 -12.790
  125    HD1  HIS  15           HD1      HIS  15   2.316  -5.015 -10.589
  126    HD2  HIS  15           HD2      HIS  15   2.039  -5.375 -14.719
  127    HE1  HIS  15           HE1      HIS  15   0.197  -6.301 -11.011
  128    HE2  HIS  15           HE2      HIS  15   0.005  -6.429 -13.520
  129    H    GLY  16           H        GLY  16   7.365  -4.192 -13.988
  130   1HA   GLY  16          1HA       GLY  16   7.345  -1.947 -15.722
  131   2HA   GLY  16          2HA       GLY  16   8.738  -2.659 -14.940
  132    H    LEU  17           H        LEU  17   7.351  -2.156 -12.185
  133    HA   LEU  17           HA       LEU  17   7.460   0.746 -12.208
  134   1HB   LEU  17          1HB       LEU  17   7.098  -0.872  -9.723
  135   2HB   LEU  17          2HB       LEU  17   6.530   0.747 -10.069
  136    HG   LEU  17           HG       LEU  17   5.287  -1.862 -10.637
  137   1HD1  LEU  17          1HD1      LEU  17   4.682   0.488  -9.252
  138   2HD1  LEU  17          2HD1      LEU  17   3.569   0.449 -10.619
  139   3HD1  LEU  17          3HD1      LEU  17   3.635  -0.910  -9.496
  140   1HD2  LEU  17          1HD2      LEU  17   5.481   0.273 -12.690
  141   2HD2  LEU  17          2HD2      LEU  17   5.277  -1.468 -12.881
  142   3HD2  LEU  17          3HD2      LEU  17   3.898  -0.462 -12.439
  143    H    ASP  18           H        ASP  18   9.618  -1.658 -11.990
  144    HA   ASP  18           HA       ASP  18  11.302  -0.660  -9.909
  145   1HB   ASP  18          1HB       ASP  18  11.765  -2.877 -10.251
  146   2HB   ASP  18          2HB       ASP  18  11.534  -2.774 -11.987
  147    H    ASN  19           H        ASN  19  11.831   1.400 -10.165
  148    HA   ASN  19           HA       ASN  19  12.936   3.248 -10.860
  149   1HB   ASN  19          1HB       ASN  19  14.716   1.282 -11.244
  150   2HB   ASN  19          2HB       ASN  19  14.506   1.779 -12.920
  151   2HD2  ASN  19          2HD2      ASN  19  14.828   3.352  -9.751
  152   1HD2  ASN  19          1HD2      ASN  19  16.006   4.510 -10.259
  153    H    TYR  20           H        TYR  20  10.519   2.471 -12.107
  154    HA   TYR  20           HA       TYR  20  10.626   2.992 -14.907
  155   1HB   TYR  20          1HB       TYR  20   8.690   1.897 -13.737
  156   2HB   TYR  20          2HB       TYR  20   8.305   3.451 -13.009
  157    HD1  TYR  20           HD1      TYR  20   8.826   1.894 -16.365
  158    HD2  TYR  20           HD2      TYR  20   6.774   4.826 -14.066
  159    HE1  TYR  20           HE1      TYR  20   7.456   2.464 -18.326
  160    HE2  TYR  20           HE2      TYR  20   5.399   5.405 -16.020
  161    HH   TYR  20           HH       TYR  20   6.148   4.547 -19.115
  162    H    ARG  21           H        ARG  21   9.495   5.060 -15.793
  163    HA   ARG  21           HA       ARG  21  10.875   7.254 -15.650
  164   1HB   ARG  21          1HB       ARG  21   8.264   6.759 -16.409
  165   2HB   ARG  21          2HB       ARG  21   8.096   8.051 -15.229
  166   1HG   ARG  21          1HG       ARG  21  10.004   9.174 -16.607
  167   2HG   ARG  21          2HG       ARG  21   9.466   8.068 -17.872
  168   1HD   ARG  21          1HD       ARG  21   7.370   9.045 -18.015
  169   2HD   ARG  21          2HD       ARG  21   7.474   9.739 -16.397
  170    HE   ARG  21           HE       ARG  21   8.767  11.496 -17.255
  171   1HH1  ARG  21          1HH1      ARG  21   7.860   9.208 -19.722
  172   2HH1  ARG  21          2HH1      ARG  21   8.243  10.275 -21.032
  173   1HH2  ARG  21          1HH2      ARG  21   9.274  12.905 -18.974
  174   2HH2  ARG  21          2HH2      ARG  21   9.048  12.376 -20.606
  175    H    GLY  22           H        GLY  22   8.658   6.276 -13.122
  176   1HA   GLY  22          1HA       GLY  22   8.228   7.150 -11.028
  177   2HA   GLY  22          2HA       GLY  22   9.156   8.575 -11.466
  178    H    TYR  23           H        TYR  23   9.169   5.572  -9.809
  179    HA   TYR  23           HA       TYR  23  12.039   5.897  -9.266
  180   1HB   TYR  23          1HB       TYR  23   9.812   5.601  -7.270
  181   2HB   TYR  23          2HB       TYR  23  11.496   5.299  -6.855
  182    HD1  TYR  23           HD1      TYR  23   9.217   7.905  -8.210
  183    HD2  TYR  23           HD2      TYR  23  12.896   7.078  -6.240
  184    HE1  TYR  23           HE1      TYR  23   9.532  10.307  -7.808
  185    HE2  TYR  23           HE2      TYR  23  13.221   9.480  -5.832
  186    HH   TYR  23           HH       TYR  23  12.133  11.508  -5.794
  187    H    SER  24           H        SER  24  12.767   4.073  -7.678
  188    HA   SER  24           HA       SER  24  12.493   1.638  -9.185
  189   1HB   SER  24          1HB       SER  24  14.389   0.854  -7.972
  190   2HB   SER  24          2HB       SER  24  14.690   2.548  -8.356
  191    HG   SER  24           HG       SER  24  14.811   2.927  -6.304
  192    H    LEU  25           H        LEU  25  12.389  -0.437  -8.046
  193    HA   LEU  25           HA       LEU  25  10.003  -0.990  -6.937
  194   1HB   LEU  25          1HB       LEU  25  12.594  -2.294  -7.109
  195   2HB   LEU  25          2HB       LEU  25  11.662  -2.832  -5.722
  196    HG   LEU  25           HG       LEU  25  10.305  -2.721  -8.357
  197   1HD1  LEU  25          1HD1      LEU  25  12.737  -3.966  -8.210
  198   2HD1  LEU  25          2HD1      LEU  25  11.615  -5.272  -7.830
  199   3HD1  LEU  25          3HD1      LEU  25  11.443  -4.372  -9.337
  200   1HD2  LEU  25          1HD2      LEU  25  10.120  -4.250  -5.803
  201   2HD2  LEU  25          2HD2      LEU  25   8.861  -3.403  -6.701
  202   3HD2  LEU  25          3HD2      LEU  25   9.467  -4.953  -7.283
  203    H    GLY  26           H        GLY  26  12.976  -0.652  -4.968
  204   1HA   GLY  26          1HA       GLY  26  13.245   0.195  -2.837
  205   2HA   GLY  26          2HA       GLY  26  11.995  -0.979  -2.465
  206    H    ASN  27           H        ASN  27  11.538   1.885  -4.451
  207    HA   ASN  27           HA       ASN  27  10.432   3.475  -2.352
  208   1HB   ASN  27          1HB       ASN  27  10.019   3.916  -5.303
  209   2HB   ASN  27          2HB       ASN  27  10.038   5.116  -4.014
  210   2HD2  ASN  27          2HD2      ASN  27  12.083   5.451  -2.898
  211   1HD2  ASN  27          1HD2      ASN  27  13.554   5.282  -3.788
  212    H    TRP  28           H        TRP  28   9.107   1.412  -4.857
  213    HA   TRP  28           HA       TRP  28   6.370   2.077  -4.494
  214   1HB   TRP  28          1HB       TRP  28   7.692  -0.363  -5.669
  215   2HB   TRP  28          2HB       TRP  28   5.959  -0.039  -5.733
  216    HD1  TRP  28           HD1      TRP  28   9.224   0.909  -7.335
  217    HE1  TRP  28           HE1      TRP  28   8.790   2.543  -9.265
  218    HE3  TRP  28           HE3      TRP  28   4.270   1.801  -6.516
  219    HZ2  TRP  28           HZ2      TRP  28   6.611   4.002 -10.336
  220    HZ3  TRP  28           HZ3      TRP  28   3.059   3.309  -8.032
  221    HH2  TRP  28           HH2      TRP  28   4.211   4.394  -9.910
  222    H    VAL  29           H        VAL  29   8.388  -0.597  -3.311
  223    HA   VAL  29           HA       VAL  29   6.386  -1.933  -1.893
  224    HB   VAL  29           HB       VAL  29   9.345  -1.831  -1.298
  225   1HG1  VAL  29          1HG1      VAL  29   7.901  -2.726   0.532
  226   2HG1  VAL  29          2HG1      VAL  29   7.370  -3.988  -0.580
  227   3HG1  VAL  29          3HG1      VAL  29   9.067  -3.884  -0.111
  228   1HG2  VAL  29          1HG2      VAL  29   7.786  -3.118  -3.410
  229   2HG2  VAL  29          2HG2      VAL  29   9.513  -2.771  -3.323
  230   3HG2  VAL  29          3HG2      VAL  29   8.863  -4.214  -2.545
  231    H    CYS  30           H        CYS  30   8.748   0.464  -0.822
  232    HA   CYS  30           HA       CYS  30   8.063   0.537   1.869
  233   1HB   CYS  30          1HB       CYS  30  10.019   1.643   0.639
  234   2HB   CYS  30          2HB       CYS  30   8.904   2.957   0.285
  235    H    ALA  31           H        ALA  31   6.840   2.554  -0.801
  236    HA   ALA  31           HA       ALA  31   5.057   4.084   0.739
  237   1HB   ALA  31          1HB       ALA  31   5.942   4.193  -1.811
  238   2HB   ALA  31          2HB       ALA  31   4.574   5.118  -1.194
  239   3HB   ALA  31          3HB       ALA  31   4.297   3.606  -2.057
  240    H    ALA  32           H        ALA  32   4.511   1.158  -1.207
  241    HA   ALA  32           HA       ALA  32   1.726   1.028  -0.715
  242   1HB   ALA  32          1HB       ALA  32   2.259  -0.196  -2.560
  243   2HB   ALA  32          2HB       ALA  32   2.226  -1.488  -1.361
  244   3HB   ALA  32          3HB       ALA  32   3.766  -0.794  -1.867
  245    H    LYS  33           H        LYS  33   4.455  -0.773   0.702
  246    HA   LYS  33           HA       LYS  33   3.193  -2.460   2.401
  247   1HB   LYS  33          1HB       LYS  33   5.595  -2.456   2.182
  248   2HB   LYS  33          2HB       LYS  33   5.699  -0.855   2.897
  249   1HG   LYS  33          1HG       LYS  33   5.222  -1.642   5.035
  250   2HG   LYS  33          2HG       LYS  33   4.541  -3.153   4.426
  251   1HD   LYS  33          1HD       LYS  33   6.741  -3.900   3.736
  252   2HD   LYS  33          2HD       LYS  33   7.446  -2.362   4.232
  253   1HE   LYS  33          1HE       LYS  33   7.589  -3.012   6.360
  254   2HE   LYS  33          2HE       LYS  33   5.923  -3.592   6.367
  255   1HZ   LYS  33          1HZ       LYS  33   7.400  -5.391   4.856
  256   2HZ   LYS  33          2HZ       LYS  33   8.309  -5.087   6.249
  257   3HZ   LYS  33          3HZ       LYS  33   6.717  -5.643   6.383
  258    H    PHE  34           H        PHE  34   4.226   0.833   3.284
  259    HA   PHE  34           HA       PHE  34   2.769   0.704   5.728
  260   1HB   PHE  34          1HB       PHE  34   4.513   2.633   4.437
  261   2HB   PHE  34          2HB       PHE  34   3.367   3.300   5.580
  262    HD1  PHE  34           HD1      PHE  34   3.334   2.269   7.922
  263    HD2  PHE  34           HD2      PHE  34   6.507   1.686   5.146
  264    HE1  PHE  34           HE1      PHE  34   4.826   1.623   9.769
  265    HE2  PHE  34           HE2      PHE  34   8.005   1.039   6.989
  266    HZ   PHE  34           HZ       PHE  34   7.165   1.007   9.304
  267    H    GLU  35           H        GLU  35   1.909   1.585   2.544
  268    HA   GLU  35           HA       GLU  35  -0.033   3.532   3.086
  269   1HB   GLU  35          1HB       GLU  35   1.015   2.156   0.859
  270   2HB   GLU  35          2HB       GLU  35  -0.720   1.879   0.834
  271   1HG   GLU  35          1HG       GLU  35  -1.208   4.130   0.582
  272   2HG   GLU  35          2HG       GLU  35   0.360   4.640   1.207
  273    H    SER  36           H        SER  36  -0.430   0.079   2.358
  274    HA   SER  36           HA       SER  36  -2.963   0.112   3.876
  275   1HB   SER  36          1HB       SER  36  -3.725  -1.607   2.107
  276   2HB   SER  36          2HB       SER  36  -3.646   0.081   1.608
  277    HG   SER  36           HG       SER  36  -1.573  -0.387   0.723
  278    H    ASN  37           H        ASN  37  -0.051  -0.940   4.264
  279    HA   ASN  37           HA       ASN  37   0.948  -2.741   5.258
  280   1HB   ASN  37          1HB       ASN  37  -1.929  -3.234   6.037
  281   2HB   ASN  37          2HB       ASN  37  -0.621  -4.288   6.565
  282   2HD2  ASN  37          2HD2      ASN  37  -1.393  -0.827   6.405
  283   1HD2  ASN  37          1HD2      ASN  37  -0.775  -0.443   7.972
  284    H    PHE  38           H        PHE  38   0.034  -2.768   2.523
  285    HA   PHE  38           HA       PHE  38   0.224  -4.056   0.726
  286   1HB   PHE  38          1HB       PHE  38   0.874  -6.123   2.800
  287   2HB   PHE  38          2HB       PHE  38   0.696  -6.565   1.103
  288    HD1  PHE  38           HD1      PHE  38   1.907  -4.568  -0.428
  289    HD2  PHE  38           HD2      PHE  38   3.086  -5.974   3.409
  290    HE1  PHE  38           HE1      PHE  38   4.202  -3.818  -0.872
  291    HE2  PHE  38           HE2      PHE  38   5.388  -5.223   2.975
  292    HZ   PHE  38           HZ       PHE  38   5.952  -4.153   0.831
  293    H    ASN  39           H        ASN  39  -2.306  -3.567   2.221
  294    HA   ASN  39           HA       ASN  39  -3.924  -5.880   1.503
  295   1HB   ASN  39          1HB       ASN  39  -4.213  -4.220   3.554
  296   2HB   ASN  39          2HB       ASN  39  -5.145  -3.299   2.378
  297   2HD2  ASN  39          2HD2      ASN  39  -6.205  -5.457   0.928
  298   1HD2  ASN  39          1HD2      ASN  39  -7.341  -6.278   1.937
  299    H    THR  40           H        THR  40  -4.280  -6.097  -0.594
  300    HA   THR  40           HA       THR  40  -4.516  -3.774  -2.319
  301    HB   THR  40           HB       THR  40  -4.057  -5.171  -4.079
  302    HG1  THR  40           HG1      THR  40  -5.169  -7.374  -2.652
  303   1HG2  THR  40          1HG2      THR  40  -2.608  -5.697  -1.772
  304   2HG2  THR  40          2HG2      THR  40  -2.983  -7.291  -2.427
  305   3HG2  THR  40          3HG2      THR  40  -2.141  -6.105  -3.423
  306    H    GLN  41           H        GLN  41  -6.541  -6.152  -0.839
  307    HA   GLN  41           HA       GLN  41  -8.796  -5.538  -2.567
  308   1HB   GLN  41          1HB       GLN  41  -8.114  -7.623  -0.577
  309   2HB   GLN  41          2HB       GLN  41  -9.810  -7.224  -0.752
  310   1HG   GLN  41          1HG       GLN  41  -9.667  -7.699  -3.152
  311   2HG   GLN  41          2HG       GLN  41  -7.968  -8.122  -2.952
  312   2HE2  GLN  41          2HE2      GLN  41  -8.250 -10.220  -3.651
  313   1HE2  GLN  41          1HE2      GLN  41  -9.075 -11.414  -2.714
  314    H    ALA  42           H        ALA  42  -7.450  -4.043   0.000
  315    HA   ALA  42           HA       ALA  42  -9.920  -3.503   1.439
  316   1HB   ALA  42          1HB       ALA  42  -8.375  -2.094   2.882
  317   2HB   ALA  42          2HB       ALA  42  -7.054  -2.789   1.942
  318   3HB   ALA  42          3HB       ALA  42  -8.114  -3.838   2.884
  319    H    THR  43           H        THR  43 -10.342  -1.272   2.115
  320    HA   THR  43           HA       THR  43  -9.796   0.737   0.026
  321    HB   THR  43           HB       THR  43 -12.004   1.325  -0.258
  322    HG1  THR  43           HG1      THR  43 -13.388   1.435   1.365
  323   1HG2  THR  43          1HG2      THR  43 -11.493  -1.341  -0.515
  324   2HG2  THR  43          2HG2      THR  43 -12.919  -1.352   0.525
  325   3HG2  THR  43          3HG2      THR  43 -12.978  -0.548  -1.044
  326    H    ASN  44           H        ASN  44  -9.799   2.933   0.825
  327    HA   ASN  44           HA       ASN  44  -9.909   3.171   3.756
  328   1HB   ASN  44          1HB       ASN  44  -7.549   3.138   2.439
  329   2HB   ASN  44          2HB       ASN  44  -7.917   4.858   2.364
  330   2HD2  ASN  44          2HD2      ASN  44  -6.025   2.987   3.937
  331   1HD2  ASN  44          1HD2      ASN  44  -6.146   3.588   5.553
  332    H    ARG  45           H        ARG  45 -11.900   4.189   3.726
  333    HA   ARG  45           HA       ARG  45 -12.507   6.387   2.025
  334   1HB   ARG  45          1HB       ARG  45 -14.181   4.867   3.147
  335   2HB   ARG  45          2HB       ARG  45 -13.831   5.705   4.651
  336   1HG   ARG  45          1HG       ARG  45 -14.953   7.575   4.038
  337   2HG   ARG  45          2HG       ARG  45 -14.577   7.373   2.325
  338   1HD   ARG  45          1HD       ARG  45 -16.630   6.576   2.033
  339   2HD   ARG  45          2HD       ARG  45 -16.171   5.179   3.007
  340    HE   ARG  45           HE       ARG  45 -16.942   6.576   4.961
  341   1HH1  ARG  45          1HH1      ARG  45 -18.232   6.996   1.752
  342   2HH1  ARG  45          2HH1      ARG  45 -19.755   7.608   2.304
  343   1HH2  ARG  45          1HH2      ARG  45 -18.944   7.380   5.698
  344   2HH2  ARG  45          2HH2      ARG  45 -20.159   7.827   4.547
  345    H    ASN  46           H        ASN  46 -12.199   8.513   2.281
  346    HA   ASN  46           HA       ASN  46 -10.843   9.403   4.738
  347   1HB   ASN  46          1HB       ASN  46 -10.848  10.925   2.146
  348   2HB   ASN  46          2HB       ASN  46  -9.709  11.035   3.483
  349   2HD2  ASN  46          2HD2      ASN  46 -10.158   9.880   0.436
  350   1HD2  ASN  46          1HD2      ASN  46  -8.937   8.659   0.409
  351    H    THR  47           H        THR  47 -11.154  11.915   4.977
  352    HA   THR  47           HA       THR  47 -13.995  12.288   5.413
  353    HB   THR  47           HB       THR  47 -13.351  14.327   6.621
  354    HG1  THR  47           HG1      THR  47 -10.646  13.635   6.088
  355   1HG2  THR  47          1HG2      THR  47 -13.319  12.157   7.787
  356   2HG2  THR  47          2HG2      THR  47 -11.619  11.966   7.360
  357   3HG2  THR  47          3HG2      THR  47 -12.116  13.273   8.434
  358    H    ASP  48           H        ASP  48 -11.530  13.418   3.239
  359    HA   ASP  48           HA       ASP  48 -12.859  15.761   2.342
  360   1HB   ASP  48          1HB       ASP  48 -11.303  15.543   0.364
  361   2HB   ASP  48          2HB       ASP  48 -10.518  15.606   1.939
  362    H    GLY  49           H        GLY  49 -13.547  12.501   1.917
  363   1HA   GLY  49          1HA       GLY  49 -15.276  13.150  -0.389
  364   2HA   GLY  49          2HA       GLY  49 -15.687  11.988   0.861
  365    H    SER  50           H        SER  50 -12.478  12.138  -0.512
  366    HA   SER  50           HA       SER  50 -12.942  10.128  -2.492
  367   1HB   SER  50          1HB       SER  50 -10.278  10.058  -2.274
  368   2HB   SER  50          2HB       SER  50 -11.116  11.353  -3.128
  369    HG   SER  50           HG       SER  50 -10.594  12.717  -1.593
  370    H    THR  51           H        THR  51 -11.046   8.278  -2.342
  371    HA   THR  51           HA       THR  51 -10.867   7.048   0.250
  372    HB   THR  51           HB       THR  51 -12.566   5.703  -1.859
  373    HG1  THR  51           HG1      THR  51 -14.149   6.707  -0.897
  374   1HG2  THR  51          1HG2      THR  51 -11.079   4.637   0.328
  375   2HG2  THR  51          2HG2      THR  51 -12.798   4.481   0.686
  376   3HG2  THR  51          3HG2      THR  51 -12.141   3.792  -0.799
  377    H    ASP  52           H        ASP  52  -9.527   5.107   0.209
  378    HA   ASP  52           HA       ASP  52  -7.830   4.985  -2.190
  379   1HB   ASP  52          1HB       ASP  52  -7.207   4.130   0.644
  380   2HB   ASP  52          2HB       ASP  52  -6.090   4.091  -0.715
  381    H    TYR  53           H        TYR  53  -8.874   3.533  -3.424
  382    HA   TYR  53           HA       TYR  53  -9.651   1.004  -2.237
  383   1HB   TYR  53          1HB       TYR  53 -10.065   2.141  -4.998
  384   2HB   TYR  53          2HB       TYR  53 -10.538   0.511  -4.527
  385    HD1  TYR  53           HD1      TYR  53 -12.352   0.152  -2.917
  386    HD2  TYR  53           HD2      TYR  53 -11.331   4.055  -4.266
  387    HE1  TYR  53           HE1      TYR  53 -14.501   0.999  -2.075
  388    HE2  TYR  53           HE2      TYR  53 -13.477   4.912  -3.428
  389    HH   TYR  53           HH       TYR  53 -15.650   4.164  -2.824
  390    H    GLY  54           H        GLY  54  -7.614   0.238  -1.770
  391   1HA   GLY  54          1HA       GLY  54  -5.950  -0.511  -4.094
  392   2HA   GLY  54          2HA       GLY  54  -6.590  -1.797  -3.099
  393    H    ILE  55           H        ILE  55  -4.109  -1.960  -3.462
  394    HA   ILE  55           HA       ILE  55  -2.912  -1.578  -0.869
  395    HB   ILE  55           HB       ILE  55  -2.591  -3.637  -2.308
  396   1HG1  ILE  55          1HG1      ILE  55  -0.064  -2.169  -1.517
  397   2HG1  ILE  55          2HG1      ILE  55  -1.087  -3.095  -0.422
  398   1HG2  ILE  55          1HG2      ILE  55  -2.316  -2.403  -4.436
  399   2HG2  ILE  55          2HG2      ILE  55  -0.739  -1.848  -3.876
  400   3HG2  ILE  55          3HG2      ILE  55  -1.027  -3.568  -4.136
  401   1HD1  ILE  55          1HD1      ILE  55  -0.594  -4.959  -2.293
  402   2HD1  ILE  55          2HD1      ILE  55   0.886  -4.007  -2.398
  403   3HD1  ILE  55          3HD1      ILE  55   0.402  -4.716  -0.858
  404    H    LEU  56           H        LEU  56  -2.978   0.054  -3.886
  405    HA   LEU  56           HA       LEU  56  -0.696   1.734  -3.089
  406   1HB   LEU  56          1HB       LEU  56  -1.225   0.495  -5.561
  407   2HB   LEU  56          2HB       LEU  56  -1.587   2.193  -5.805
  408    HG   LEU  56           HG       LEU  56   0.660   2.044  -6.432
  409   1HD1  LEU  56          1HD1      LEU  56   0.150   3.741  -4.579
  410   2HD1  LEU  56          2HD1      LEU  56   1.040   2.648  -3.519
  411   3HD1  LEU  56          3HD1      LEU  56   1.839   3.365  -4.919
  412   1HD2  LEU  56          1HD2      LEU  56   0.728  -0.333  -5.277
  413   2HD2  LEU  56          2HD2      LEU  56   2.205   0.559  -5.647
  414   3HD2  LEU  56          3HD2      LEU  56   1.555   0.571  -4.007
  415    H    GLN  57           H        GLN  57  -3.846   1.584  -2.740
  416    HA   GLN  57           HA       GLN  57  -5.475   3.061  -2.237
  417   1HB   GLN  57          1HB       GLN  57  -3.322   5.160  -2.528
  418   2HB   GLN  57          2HB       GLN  57  -4.872   5.364  -1.723
  419   1HG   GLN  57          1HG       GLN  57  -4.115   3.451  -0.199
  420   2HG   GLN  57          2HG       GLN  57  -2.506   3.751  -0.854
  421   2HE2  GLN  57          2HE2      GLN  57  -2.159   6.317  -0.966
  422   1HE2  GLN  57          1HE2      GLN  57  -2.396   7.095   0.558
  423    H    ILE  58           H        ILE  58  -6.252   2.378  -4.496
  424    HA   ILE  58           HA       ILE  58  -5.921   4.391  -6.541
  425    HB   ILE  58           HB       ILE  58  -7.921   2.149  -6.637
  426   1HG1  ILE  58          1HG1      ILE  58  -5.918   1.014  -6.003
  427   2HG1  ILE  58          2HG1      ILE  58  -6.086   0.801  -7.742
  428   1HG2  ILE  58          1HG2      ILE  58  -6.362   3.675  -8.711
  429   2HG2  ILE  58          2HG2      ILE  58  -7.347   2.256  -9.066
  430   3HG2  ILE  58          3HG2      ILE  58  -8.101   3.715  -8.426
  431   1HD1  ILE  58          1HD1      ILE  58  -4.563   3.106  -7.463
  432   2HD1  ILE  58          2HD1      ILE  58  -3.951   2.002  -6.230
  433   3HD1  ILE  58          3HD1      ILE  58  -3.993   1.500  -7.921
  434    H    ASN  59           H        ASN  59  -6.869   6.280  -5.923
  435    HA   ASN  59           HA       ASN  59  -9.287   6.439  -4.495
  436   1HB   ASN  59          1HB       ASN  59  -7.591   8.239  -4.557
  437   2HB   ASN  59          2HB       ASN  59  -7.970   8.524  -6.253
  438   2HD2  ASN  59          2HD2      ASN  59  -8.252  10.704  -5.119
  439   1HD2  ASN  59          1HD2      ASN  59  -9.859  11.083  -4.609
  440    H    SER  60           H        SER  60 -11.009   5.402  -5.409
  441    HA   SER  60           HA       SER  60 -11.587   5.423  -8.180
  442   1HB   SER  60          1HB       SER  60 -13.417   4.125  -7.654
  443   2HB   SER  60          2HB       SER  60 -12.436   3.869  -6.211
  444    HG   SER  60           HG       SER  60 -14.732   5.453  -6.547
  445    H    ARG  61           H        ARG  61 -11.958   7.828  -5.816
  446    HA   ARG  61           HA       ARG  61 -14.180   9.117  -7.221
  447   1HB   ARG  61          1HB       ARG  61 -13.809   8.927  -4.599
  448   2HB   ARG  61          2HB       ARG  61 -12.830  10.363  -4.866
  449   1HG   ARG  61          1HG       ARG  61 -15.031  11.087  -6.203
  450   2HG   ARG  61          2HG       ARG  61 -15.754  10.004  -5.011
  451   1HD   ARG  61          1HD       ARG  61 -15.002  11.297  -3.212
  452   2HD   ARG  61          2HD       ARG  61 -13.816  12.146  -4.203
  453    HE   ARG  61           HE       ARG  61 -16.589  12.808  -3.872
  454   1HH1  ARG  61          1HH1      ARG  61 -13.833  13.054  -5.988
  455   2HH1  ARG  61          2HH1      ARG  61 -14.416  14.472  -6.794
  456   1HH2  ARG  61          1HH2      ARG  61 -17.365  14.674  -4.928
  457   2HH2  ARG  61          2HH2      ARG  61 -16.424  15.392  -6.191
  458    H    TRP  62           H        TRP  62 -11.370   8.794  -8.186
  459    HA   TRP  62           HA       TRP  62 -11.090  11.431  -9.286
  460   1HB   TRP  62          1HB       TRP  62  -9.688  10.888  -6.908
  461   2HB   TRP  62          2HB       TRP  62  -8.493  10.853  -8.200
  462    HD1  TRP  62           HD1      TRP  62  -8.512  13.149  -9.831
  463    HE1  TRP  62           HE1      TRP  62  -8.813  15.600  -9.105
  464    HE3  TRP  62           HE3      TRP  62 -10.712  12.383  -5.281
  465    HZ2  TRP  62           HZ2      TRP  62  -9.846  17.020  -6.894
  466    HZ3  TRP  62           HZ3      TRP  62 -11.326  14.340  -3.923
  467    HH2  TRP  62           HH2      TRP  62 -10.901  16.610  -4.713
  468    H    TRP  63           H        TRP  63 -10.448   8.091  -9.371
  469    HA   TRP  63           HA       TRP  63  -8.911   8.475 -11.843
  470   1HB   TRP  63          1HB       TRP  63  -8.372   6.487  -9.633
  471   2HB   TRP  63          2HB       TRP  63  -7.661   6.364 -11.241
  472    HD1  TRP  63           HD1      TRP  63  -6.555   7.386  -8.034
  473    HE1  TRP  63           HE1      TRP  63  -4.779   9.254  -8.145
  474    HE3  TRP  63           HE3      TRP  63  -7.322   8.923 -12.818
  475    HZ2  TRP  63           HZ2      TRP  63  -3.843  11.150 -10.041
  476    HZ3  TRP  63           HZ3      TRP  63  -5.998  10.763 -13.717
  477    HH2  TRP  63           HH2      TRP  63  -4.270  11.860 -12.361
  478    H    CYS  64           H        CYS  64 -10.174   5.657 -10.122
  479    HA   CYS  64           HA       CYS  64 -11.274   4.696 -12.642
  480   1HB   CYS  64          1HB       CYS  64 -11.339   2.549 -11.701
  481   2HB   CYS  64          2HB       CYS  64  -9.898   3.267 -10.993
  482    H    ASN  65           H        ASN  65 -13.359   3.780 -12.824
  483    HA   ASN  65           HA       ASN  65 -15.356   5.377 -11.403
  484   1HB   ASN  65          1HB       ASN  65 -15.196   5.044 -13.995
  485   2HB   ASN  65          2HB       ASN  65 -16.004   3.515 -13.664
  486   2HD2  ASN  65          2HD2      ASN  65 -16.500   6.629 -14.507
  487   1HD2  ASN  65          1HD2      ASN  65 -18.131   6.826 -13.973
  488    H    ASP  66           H        ASP  66 -15.951   4.474  -9.535
  489    HA   ASP  66           HA       ASP  66 -16.300   1.576  -9.371
  490   1HB   ASP  66          1HB       ASP  66 -16.332   1.842  -6.988
  491   2HB   ASP  66          2HB       ASP  66 -15.001   2.808  -7.616
  492    H    GLY  67           H        GLY  67 -18.128   4.475  -9.626
  493   1HA   GLY  67          1HA       GLY  67 -20.573   2.999  -9.858
  494   2HA   GLY  67          2HA       GLY  67 -20.391   4.741  -9.988
  495    H    ARG  68           H        ARG  68 -19.062   3.410  -7.144
  496    HA   ARG  68           HA       ARG  68 -21.509   3.649  -5.602
  497   1HB   ARG  68          1HB       ARG  68 -18.688   3.011  -4.719
  498   2HB   ARG  68          2HB       ARG  68 -20.121   2.919  -3.704
  499   1HG   ARG  68          1HG       ARG  68 -21.028   1.216  -5.308
  500   2HG   ARG  68          2HG       ARG  68 -19.443   1.213  -6.085
  501   1HD   ARG  68          1HD       ARG  68 -19.172  -0.520  -4.619
  502   2HD   ARG  68          2HD       ARG  68 -18.608   0.819  -3.620
  503    HE   ARG  68           HE       ARG  68 -21.411   0.321  -3.326
  504   1HH1  ARG  68          1HH1      ARG  68 -18.237  -0.677  -2.295
  505   2HH1  ARG  68          2HH1      ARG  68 -18.787  -1.315  -0.782
  506   1HH2  ARG  68          1HH2      ARG  68 -22.146  -0.516  -1.336
  507   2HH2  ARG  68          2HH2      ARG  68 -21.010  -1.223  -0.237
  508    H    THR  69           H        THR  69 -19.252   5.768  -6.741
  509    HA   THR  69           HA       THR  69 -19.912   7.712  -4.645
  510    HB   THR  69           HB       THR  69 -17.170   7.829  -5.816
  511    HG1  THR  69           HG1      THR  69 -16.732   5.935  -4.976
  512   1HG2  THR  69          1HG2      THR  69 -18.330   8.512  -3.112
  513   2HG2  THR  69          2HG2      THR  69 -16.659   8.782  -3.605
  514   3HG2  THR  69          3HG2      THR  69 -17.966   9.651  -4.408
  515    HA   PRO  70           HA       PRO  70 -21.139   9.561  -8.643
  516   1HB   PRO  70          1HB       PRO  70 -22.131  11.584  -6.700
  517   2HB   PRO  70          2HB       PRO  70 -22.962  10.836  -8.068
  518   1HG   PRO  70          1HG       PRO  70 -23.531  10.107  -5.572
  519   2HG   PRO  70          2HG       PRO  70 -23.467   8.910  -6.879
  520   1HD   PRO  70          1HD       PRO  70 -21.476   9.477  -4.725
  521   2HD   PRO  70          2HD       PRO  70 -21.952   7.924  -5.442
  522    H    GLY  71           H        GLY  71 -20.155  11.119  -9.835
  523   1HA   GLY  71          1HA       GLY  71 -18.562  13.162  -8.455
  524   2HA   GLY  71          2HA       GLY  71 -19.048  13.203 -10.142
  525    H    SER  72           H        SER  72 -18.180  10.221 -10.144
  526    HA   SER  72           HA       SER  72 -15.381  10.184  -9.762
  527   1HB   SER  72          1HB       SER  72 -15.637   8.157 -11.435
  528   2HB   SER  72          2HB       SER  72 -16.268   8.049  -9.792
  529    HG   SER  72           HG       SER  72 -18.311   8.441 -10.559
  530    H    ARG  73           H        ARG  73 -13.793  10.961 -10.967
  531    HA   ARG  73           HA       ARG  73 -14.329  12.402 -13.371
  532   1HB   ARG  73          1HB       ARG  73 -11.984  11.890 -11.645
  533   2HB   ARG  73          2HB       ARG  73 -11.625  12.221 -13.334
  534   1HG   ARG  73          1HG       ARG  73 -12.379  14.376 -13.219
  535   2HG   ARG  73          2HG       ARG  73 -13.500  14.030 -11.901
  536   1HD   ARG  73          1HD       ARG  73 -11.007  13.494 -10.821
  537   2HD   ARG  73          2HD       ARG  73 -10.743  14.930 -11.810
  538    HE   ARG  73           HE       ARG  73 -12.300  14.743  -9.390
  539   1HH1  ARG  73          1HH1      ARG  73 -11.690  16.559 -12.300
  540   2HH1  ARG  73          2HH1      ARG  73 -12.322  18.039 -11.663
  541   1HH2  ARG  73          1HH2      ARG  73 -13.135  16.688  -8.542
  542   2HH2  ARG  73          2HH2      ARG  73 -13.144  18.113  -9.527
  543    H    ASN  74           H        ASN  74 -12.761   9.328 -12.621
  544    HA   ASN  74           HA       ASN  74 -12.295   7.482 -13.886
  545   1HB   ASN  74          1HB       ASN  74 -14.699   8.190 -14.787
  546   2HB   ASN  74          2HB       ASN  74 -13.787   8.564 -16.247
  547   2HD2  ASN  74          2HD2      ASN  74 -14.717   6.938 -17.442
  548   1HD2  ASN  74          1HD2      ASN  74 -14.381   5.266 -17.170
  549    H    LEU  75           H        LEU  75 -10.669   9.864 -13.907
  550    HA   LEU  75           HA       LEU  75  -9.615  10.666 -16.327
  551   1HB   LEU  75          1HB       LEU  75  -8.736  10.355 -13.532
  552   2HB   LEU  75          2HB       LEU  75  -7.456  10.523 -14.709
  553    HG   LEU  75           HG       LEU  75  -9.751  12.456 -14.265
  554   1HD1  LEU  75          1HD1      LEU  75  -8.184  12.455 -12.399
  555   2HD1  LEU  75          2HD1      LEU  75  -6.840  12.706 -13.513
  556   3HD1  LEU  75          3HD1      LEU  75  -8.072  13.955 -13.319
  557   1HD2  LEU  75          1HD2      LEU  75  -8.839  12.356 -16.598
  558   2HD2  LEU  75          2HD2      LEU  75  -8.681  13.926 -15.811
  559   3HD2  LEU  75          3HD2      LEU  75  -7.281  12.862 -15.947
  560    H    CYS  76           H        CYS  76  -8.715   8.138 -14.206
  561    HA   CYS  76           HA       CYS  76  -6.691   6.961 -15.804
  562   1HB   CYS  76          1HB       CYS  76  -7.502   6.945 -13.211
  563   2HB   CYS  76          2HB       CYS  76  -8.029   5.361 -13.758
  564    H    ASN  77           H        ASN  77 -10.106   6.502 -15.303
  565    HA   ASN  77           HA       ASN  77 -11.684   5.154 -16.259
  566   1HB   ASN  77          1HB       ASN  77 -10.393   6.400 -18.280
  567   2HB   ASN  77          2HB       ASN  77 -10.061   4.724 -18.707
  568   2HD2  ASN  77          2HD2      ASN  77 -12.176   3.328 -18.302
  569   1HD2  ASN  77          1HD2      ASN  77 -13.575   3.953 -19.100
  570    H    ILE  78           H        ILE  78 -10.326   3.770 -14.530
  571    HA   ILE  78           HA       ILE  78  -9.626   1.267 -15.886
  572    HB   ILE  78           HB       ILE  78  -7.844   0.924 -14.571
  573   1HG1  ILE  78          1HG1      ILE  78  -9.677   1.813 -12.434
  574   2HG1  ILE  78          2HG1      ILE  78  -8.529   0.481 -12.448
  575   1HG2  ILE  78          1HG2      ILE  78  -7.754   3.292 -15.486
  576   2HG2  ILE  78          2HG2      ILE  78  -8.091   3.821 -13.837
  577   3HG2  ILE  78          3HG2      ILE  78  -6.633   2.891 -14.185
  578   1HD1  ILE  78          1HD1      ILE  78  -6.715   2.158 -12.087
  579   2HD1  ILE  78          2HD1      ILE  78  -7.972   3.375 -11.866
  580   3HD1  ILE  78          3HD1      ILE  78  -7.865   2.007 -10.758
  581    HA   PRO  79           HA       PRO  79 -12.850  -0.652 -13.524
  582   1HB   PRO  79          1HB       PRO  79 -11.538  -3.217 -13.573
  583   2HB   PRO  79          2HB       PRO  79 -12.878  -2.662 -14.575
  584   1HG   PRO  79          1HG       PRO  79 -10.353  -3.191 -15.524
  585   2HG   PRO  79          2HG       PRO  79 -11.507  -2.098 -16.307
  586   1HD   PRO  79          1HD       PRO  79  -9.171  -1.453 -14.553
  587   2HD   PRO  79          2HD       PRO  79  -9.765  -0.609 -16.001
  588    H    CYS  80           H        CYS  80 -12.910  -0.135 -11.401
  589    HA   CYS  80           HA       CYS  80 -10.765  -0.329  -9.624
  590   1HB   CYS  80          1HB       CYS  80 -13.626  -0.433  -8.714
  591   2HB   CYS  80          2HB       CYS  80 -12.254   0.367  -7.954
  592    H    SER  81           H        SER  81 -13.690  -2.388  -9.700
  593    HA   SER  81           HA       SER  81 -12.887  -4.228  -7.801
  594   1HB   SER  81          1HB       SER  81 -14.574  -5.700  -8.681
  595   2HB   SER  81          2HB       SER  81 -15.167  -4.045  -8.827
  596    HG   SER  81           HG       SER  81 -13.867  -4.559 -11.046
  597    H    ALA  82           H        ALA  82 -11.787  -3.921 -11.085
  598    HA   ALA  82           HA       ALA  82 -10.798  -6.592 -11.347
  599   1HB   ALA  82          1HB       ALA  82 -11.344  -5.268 -13.309
  600   2HB   ALA  82          2HB       ALA  82  -9.649  -5.755 -13.341
  601   3HB   ALA  82          3HB       ALA  82 -10.084  -4.105 -12.894
  602    H    LEU  83           H        LEU  83  -9.772  -4.014  -9.515
  603    HA   LEU  83           HA       LEU  83  -6.972  -4.922  -9.535
  604   1HB   LEU  83          1HB       LEU  83  -6.271  -2.811  -8.938
  605   2HB   LEU  83          2HB       LEU  83  -7.638  -2.448  -9.971
  606    HG   LEU  83           HG       LEU  83  -8.839  -2.540  -7.523
  607   1HD1  LEU  83          1HD1      LEU  83  -6.036  -2.299  -7.027
  608   2HD1  LEU  83          2HD1      LEU  83  -6.843  -0.800  -6.566
  609   3HD1  LEU  83          3HD1      LEU  83  -7.370  -2.335  -5.876
  610   1HD2  LEU  83          1HD2      LEU  83  -7.887  -0.474  -9.371
  611   2HD2  LEU  83          2HD2      LEU  83  -9.471  -0.694  -8.629
  612   3HD2  LEU  83          3HD2      LEU  83  -8.176   0.090  -7.724
  613    H    LEU  84           H        LEU  84  -9.839  -4.994  -7.764
  614    HA   LEU  84           HA       LEU  84  -8.431  -5.448  -5.233
  615   1HB   LEU  84          1HB       LEU  84 -11.399  -5.337  -5.407
  616   2HB   LEU  84          2HB       LEU  84 -10.331  -4.788  -4.127
  617    HG   LEU  84           HG       LEU  84 -10.232  -3.357  -6.732
  618   1HD1  LEU  84          1HD1      LEU  84 -12.679  -3.763  -5.512
  619   2HD1  LEU  84          2HD1      LEU  84 -12.166  -2.180  -4.931
  620   3HD1  LEU  84          3HD1      LEU  84 -12.274  -2.492  -6.664
  621   1HD2  LEU  84          1HD2      LEU  84  -8.727  -2.883  -4.779
  622   2HD2  LEU  84          2HD2      LEU  84  -9.636  -1.499  -5.382
  623   3HD2  LEU  84          3HD2      LEU  84 -10.153  -2.318  -3.909
  624    H    SER  85           H        SER  85  -8.237  -7.418  -7.191
  625    HA   SER  85           HA       SER  85  -9.700  -9.597  -5.882
  626   1HB   SER  85          1HB       SER  85 -10.002 -10.749  -8.019
  627   2HB   SER  85          2HB       SER  85 -10.730  -9.145  -8.102
  628    HG   SER  85           HG       SER  85  -9.032 -10.108  -9.774
  629    H    SER  86           H        SER  86  -7.214  -8.631  -5.301
  630    HA   SER  86           HA       SER  86  -5.158  -9.404  -4.670
  631   1HB   SER  86          1HB       SER  86  -6.235 -11.635  -4.389
  632   2HB   SER  86          2HB       SER  86  -5.930 -11.972  -6.093
  633    HG   SER  86           HG       SER  86  -4.306 -12.369  -4.059
  634    H    ASP  87           H        ASP  87  -6.077  -8.274  -7.262
  635    HA   ASP  87           HA       ASP  87  -3.726  -8.869  -8.920
  636   1HB   ASP  87          1HB       ASP  87  -6.054  -9.474  -9.738
  637   2HB   ASP  87          2HB       ASP  87  -6.374  -7.747  -9.802
  638    H    ILE  88           H        ILE  88  -2.267  -7.241  -8.706
  639    HA   ILE  88           HA       ILE  88  -3.185  -4.571  -8.045
  640    HB   ILE  88           HB       ILE  88  -0.568  -4.186  -8.321
  641   1HG1  ILE  88          1HG1      ILE  88  -0.492  -6.987  -7.293
  642   2HG1  ILE  88          2HG1      ILE  88  -0.537  -6.743  -9.036
  643   1HG2  ILE  88          1HG2      ILE  88  -1.857  -3.818  -6.296
  644   2HG2  ILE  88          2HG2      ILE  88  -1.859  -5.550  -5.965
  645   3HG2  ILE  88          3HG2      ILE  88  -0.345  -4.648  -5.927
  646   1HD1  ILE  88          1HD1      ILE  88   1.415  -5.024  -7.800
  647   2HD1  ILE  88          2HD1      ILE  88   1.697  -6.717  -7.397
  648   3HD1  ILE  88          3HD1      ILE  88   1.611  -6.216  -9.086
  649    H    THR  89           H        THR  89  -2.709  -6.307 -10.860
  650    HA   THR  89           HA       THR  89  -1.360  -4.729 -12.616
  651    HB   THR  89           HB       THR  89  -4.006  -5.834 -13.480
  652    HG1  THR  89           HG1      THR  89  -2.440  -7.844 -13.644
  653   1HG2  THR  89          1HG2      THR  89  -1.234  -5.779 -14.677
  654   2HG2  THR  89          2HG2      THR  89  -2.627  -6.569 -15.417
  655   3HG2  THR  89          3HG2      THR  89  -2.627  -4.821 -15.181
  656    H    ALA  90           H        ALA  90  -4.884  -4.445 -12.063
  657    HA   ALA  90           HA       ALA  90  -5.219  -2.152 -13.564
  658   1HB   ALA  90          1HB       ALA  90  -6.816  -3.655 -11.625
  659   2HB   ALA  90          2HB       ALA  90  -7.253  -1.956 -11.801
  660   3HB   ALA  90          3HB       ALA  90  -7.255  -3.017 -13.209
  661    H    SER  91           H        SER  91  -4.616  -2.532 -10.092
  662    HA   SER  91           HA       SER  91  -4.852   0.192  -9.401
  663   1HB   SER  91          1HB       SER  91  -2.955  -1.018  -7.679
  664   2HB   SER  91          2HB       SER  91  -4.667  -0.729  -7.369
  665    HG   SER  91           HG       SER  91  -3.790  -2.970  -8.846
  666    H    VAL  92           H        VAL  92  -2.210  -1.697 -10.648
  667    HA   VAL  92           HA       VAL  92  -0.277   0.355 -10.165
  668    HB   VAL  92           HB       VAL  92  -0.083  -2.103 -11.900
  669   1HG1  VAL  92          1HG1      VAL  92   1.966   0.044 -11.330
  670   2HG1  VAL  92          2HG1      VAL  92   2.358  -1.531 -12.017
  671   3HG1  VAL  92          3HG1      VAL  92   1.312  -0.419 -12.900
  672   1HG2  VAL  92          1HG2      VAL  92  -0.038  -1.989  -9.220
  673   2HG2  VAL  92          2HG2      VAL  92   0.923  -3.140 -10.148
  674   3HG2  VAL  92          3HG2      VAL  92   1.661  -1.654  -9.553
  675    H    ASN  93           H        ASN  93  -1.873  -0.856 -13.126
  676    HA   ASN  93           HA       ASN  93  -0.780   0.736 -14.967
  677   1HB   ASN  93          1HB       ASN  93  -2.331  -0.265 -16.177
  678   2HB   ASN  93          2HB       ASN  93  -3.144  -0.745 -14.710
  679   2HD2  ASN  93          2HD2      ASN  93  -2.981   1.642 -17.233
  680   1HD2  ASN  93          1HD2      ASN  93  -4.536   2.339 -16.951
  681    H    CYS  94           H        CYS  94  -3.331   1.574 -12.720
  682    HA   CYS  94           HA       CYS  94  -3.772   4.197 -13.614
  683   1HB   CYS  94          1HB       CYS  94  -5.063   2.681 -11.870
  684   2HB   CYS  94          2HB       CYS  94  -4.051   3.546 -10.716
  685    H    ALA  95           H        ALA  95  -1.673   2.935 -11.013
  686    HA   ALA  95           HA       ALA  95  -0.659   5.511 -10.355
  687   1HB   ALA  95          1HB       ALA  95  -0.584   3.191  -9.067
  688   2HB   ALA  95          2HB       ALA  95   1.040   3.193  -9.758
  689   3HB   ALA  95          3HB       ALA  95   0.515   4.528  -8.731
  690    H    LYS  96           H        LYS  96   0.451   2.970 -12.546
  691    HA   LYS  96           HA       LYS  96   2.982   3.850 -13.147
  692   1HB   LYS  96          1HB       LYS  96   1.767   1.835 -14.124
  693   2HB   LYS  96          2HB       LYS  96   0.988   2.951 -15.237
  694   1HG   LYS  96          1HG       LYS  96   3.763   3.456 -15.358
  695   2HG   LYS  96          2HG       LYS  96   3.537   1.707 -15.440
  696   1HD   LYS  96          1HD       LYS  96   1.690   3.311 -17.083
  697   2HD   LYS  96          2HD       LYS  96   3.385   3.355 -17.577
  698   1HE   LYS  96          1HE       LYS  96   3.252   0.773 -17.320
  699   2HE   LYS  96          2HE       LYS  96   1.511   1.026 -17.431
  700   1HZ   LYS  96          1HZ       LYS  96   2.648   2.500 -19.477
  701   2HZ   LYS  96          2HZ       LYS  96   3.436   1.003 -19.499
  702   3HZ   LYS  96          3HZ       LYS  96   1.751   1.074 -19.618
  703    H    LYS  97           H        LYS  97  -0.137   4.965 -13.981
  704    HA   LYS  97           HA       LYS  97   0.728   7.113 -15.731
  705   1HB   LYS  97          1HB       LYS  97  -1.491   5.845 -15.933
  706   2HB   LYS  97          2HB       LYS  97  -2.028   6.792 -14.552
  707   1HG   LYS  97          1HG       LYS  97  -2.506   8.522 -15.848
  708   2HG   LYS  97          2HG       LYS  97  -0.887   8.508 -16.552
  709   1HD   LYS  97          1HD       LYS  97  -2.629   6.354 -17.503
  710   2HD   LYS  97          2HD       LYS  97  -3.197   7.976 -17.908
  711   1HE   LYS  97          1HE       LYS  97  -0.334   7.591 -18.339
  712   2HE   LYS  97          2HE       LYS  97  -1.343   6.532 -19.321
  713   1HZ   LYS  97          1HZ       LYS  97  -2.189   9.299 -19.225
  714   2HZ   LYS  97          2HZ       LYS  97  -0.705   9.036 -19.992
  715   3HZ   LYS  97          3HZ       LYS  97  -2.095   8.241 -20.540
  716    H    ILE  98           H        ILE  98  -0.320   6.675 -12.409
  717    HA   ILE  98           HA       ILE  98  -0.615   9.364 -11.710
  718    HB   ILE  98           HB       ILE  98   0.154   7.020  -9.997
  719   1HG1  ILE  98          1HG1      ILE  98  -2.473   8.515 -10.188
  720   2HG1  ILE  98          2HG1      ILE  98  -2.123   7.059 -11.112
  721   1HG2  ILE  98          1HG2      ILE  98  -0.276   9.895  -9.325
  722   2HG2  ILE  98          2HG2      ILE  98  -0.760   8.651  -8.172
  723   3HG2  ILE  98          3HG2      ILE  98   0.920   8.761  -8.698
  724   1HD1  ILE  98          1HD1      ILE  98  -1.574   6.093  -8.723
  725   2HD1  ILE  98          2HD1      ILE  98  -2.657   7.389  -8.216
  726   3HD1  ILE  98          3HD1      ILE  98  -3.225   6.156  -9.342
  727    H    VAL  99           H        VAL  99   2.153   7.206 -11.379
  728    HA   VAL  99           HA       VAL  99   3.933   9.187 -10.411
  729    HB   VAL  99           HB       VAL  99   4.147   6.673 -10.110
  730   1HG1  VAL  99          1HG1      VAL  99   3.892   6.124 -12.518
  731   2HG1  VAL  99          2HG1      VAL  99   5.476   6.843 -12.808
  732   3HG1  VAL  99          3HG1      VAL  99   5.331   5.418 -11.781
  733   1HG2  VAL  99          1HG2      VAL  99   6.306   8.607 -10.707
  734   2HG2  VAL  99          2HG2      VAL  99   5.944   7.732  -9.219
  735   3HG2  VAL  99          3HG2      VAL  99   6.763   6.910 -10.547
  736    H    SER 100           H        SER 100   2.967   8.150 -13.598
  737    HA   SER 100           HA       SER 100   5.213   9.436 -14.903
  738   1HB   SER 100          1HB       SER 100   4.326   8.630 -16.930
  739   2HB   SER 100          2HB       SER 100   3.900   7.377 -15.765
  740    HG   SER 100           HG       SER 100   2.161   8.064 -17.179
  741    H    ASP 101           H        ASP 101   2.364  10.406 -13.489
  742    HA   ASP 101           HA       ASP 101   1.709  12.560 -15.290
  743   1HB   ASP 101          1HB       ASP 101   0.075  11.287 -13.777
  744   2HB   ASP 101          2HB       ASP 101   0.716  12.268 -12.461
  745    H    GLY 102           H        GLY 102   4.154  12.124 -13.095
  746   1HA   GLY 102          1HA       GLY 102   4.294  15.027 -12.550
  747   2HA   GLY 102          2HA       GLY 102   5.694  14.083 -13.032
  748    H    ASN 103           H        ASN 103   3.151  13.383 -10.639
  749    HA   ASN 103           HA       ASN 103   5.043  13.745  -8.464
  750   1HB   ASN 103          1HB       ASN 103   2.201  12.757  -8.233
  751   2HB   ASN 103          2HB       ASN 103   3.185  13.533  -6.994
  752   2HD2  ASN 103          2HD2      ASN 103   0.747  13.995  -9.148
  753   1HD2  ASN 103          1HD2      ASN 103   0.814  15.715  -9.294
  754    H    GLY 104           H        GLY 104   6.470  12.129  -8.204
  755   1HA   GLY 104          1HA       GLY 104   7.125   9.842  -8.671
  756   2HA   GLY 104          2HA       GLY 104   5.459   9.367  -8.400
  757    H    MET 105           H        MET 105   4.730   8.987  -6.366
  758    HA   MET 105           HA       MET 105   5.154   7.847  -4.370
  759   1HB   MET 105          1HB       MET 105   7.684   9.486  -4.176
  760   2HB   MET 105          2HB       MET 105   7.142   8.294  -3.007
  761   1HG   MET 105          1HG       MET 105   7.363   7.296  -5.744
  762   2HG   MET 105          2HG       MET 105   8.884   7.818  -5.019
  763   1HE   MET 105          1HE       MET 105   5.673   5.908  -4.490
  764   2HE   MET 105          2HE       MET 105   6.616   4.732  -5.406
  765   3HE   MET 105          3HE       MET 105   6.176   4.398  -3.731
  766    H    ASN 106           H        ASN 106   5.163  11.156  -5.137
  767    HA   ASN 106           HA       ASN 106   4.682  12.198  -2.533
  768   1HB   ASN 106          1HB       ASN 106   4.656  13.197  -5.324
  769   2HB   ASN 106          2HB       ASN 106   3.705  14.095  -4.156
  770   2HD2  ASN 106          2HD2      ASN 106   4.734  15.228  -2.533
  771   1HD2  ASN 106          1HD2      ASN 106   6.440  15.504  -2.524
  772    H    ALA 107           H        ALA 107   2.632  11.212  -5.243
  773    HA   ALA 107           HA       ALA 107   0.183  12.165  -4.346
  774   1HB   ALA 107          1HB       ALA 107   0.714  11.121  -6.584
  775   2HB   ALA 107          2HB       ALA 107   0.529   9.553  -5.797
  776   3HB   ALA 107          3HB       ALA 107  -0.834  10.671  -5.870
  777    H    TRP 108           H        TRP 108   2.145   9.775  -2.971
  778    HA   TRP 108           HA       TRP 108  -0.117   8.743  -1.393
  779   1HB   TRP 108          1HB       TRP 108   2.521   7.371  -1.956
  780   2HB   TRP 108          2HB       TRP 108   1.157   6.690  -1.070
  781    HD1  TRP 108           HD1      TRP 108  -1.016   5.989  -2.513
  782    HE1  TRP 108           HE1      TRP 108  -1.292   5.414  -5.006
  783    HE3  TRP 108           HE3      TRP 108   3.372   7.916  -4.285
  784    HZ2  TRP 108           HZ2      TRP 108   0.156   5.735  -7.414
  785    HZ3  TRP 108           HZ3      TRP 108   3.852   7.743  -6.691
  786    HH2  TRP 108           HH2      TRP 108   2.278   6.675  -8.220
  787    H    VAL 109           H        VAL 109  -0.188   9.459   0.597
  788    HA   VAL 109           HA       VAL 109   1.915  10.947   1.790
  789    HB   VAL 109           HB       VAL 109  -0.163  10.053   3.563
  790   1HG1  VAL 109          1HG1      VAL 109   1.458  12.365   3.069
  791   2HG1  VAL 109          2HG1      VAL 109  -0.235  12.819   3.256
  792   3HG1  VAL 109          3HG1      VAL 109   0.578  11.908   4.528
  793   1HG2  VAL 109          1HG2      VAL 109  -0.856  11.394   0.983
  794   2HG2  VAL 109          2HG2      VAL 109  -1.635  10.011   1.752
  795   3HG2  VAL 109          3HG2      VAL 109  -1.840  11.627   2.428
  796    H    ALA 110           H        ALA 110   0.957   7.612   2.038
  797    HA   ALA 110           HA       ALA 110   2.115   7.082   4.567
  798   1HB   ALA 110          1HB       ALA 110   1.614   5.211   2.253
  799   2HB   ALA 110          2HB       ALA 110   2.009   4.719   3.900
  800   3HB   ALA 110          3HB       ALA 110   0.497   5.566   3.571
  801    H    TRP 111           H        TRP 111   3.462   7.693   1.526
  802    HA   TRP 111           HA       TRP 111   5.973   6.351   2.163
  803   1HB   TRP 111          1HB       TRP 111   5.306   6.138  -0.131
  804   2HB   TRP 111          2HB       TRP 111   5.091   7.872  -0.294
  805    HD1  TRP 111           HD1      TRP 111   7.734   5.165  -0.401
  806    HE1  TRP 111           HE1      TRP 111   9.962   6.181  -1.192
  807    HE3  TRP 111           HE3      TRP 111   6.476  10.119  -0.228
  808    HZ2  TRP 111           HZ2      TRP 111  11.043   8.741  -1.680
  809    HZ3  TRP 111           HZ3      TRP 111   8.166  11.786  -0.876
  810    HH2  TRP 111           HH2      TRP 111  10.402  11.110  -1.584
  811    H    ARG 112           H        ARG 112   4.615   9.616   1.939
  812    HA   ARG 112           HA       ARG 112   7.190  10.789   2.631
  813   1HB   ARG 112          1HB       ARG 112   4.878  11.648   1.224
  814   2HB   ARG 112          2HB       ARG 112   5.073  12.683   2.631
  815   1HG   ARG 112          1HG       ARG 112   7.619  12.355   1.419
  816   2HG   ARG 112          2HG       ARG 112   6.455  12.780   0.162
  817   1HD   ARG 112          1HD       ARG 112   6.184  14.331   2.633
  818   2HD   ARG 112          2HD       ARG 112   7.723  14.557   1.803
  819    HE   ARG 112           HE       ARG 112   5.500  14.741   0.022
  820   1HH1  ARG 112          1HH1      ARG 112   7.356  16.500   2.391
  821   2HH1  ARG 112          2HH1      ARG 112   6.968  18.053   1.729
  822   1HH2  ARG 112          1HH2      ARG 112   4.985  16.782  -0.854
  823   2HH2  ARG 112          2HH2      ARG 112   5.620  18.214  -0.114
  824    H    ASN 113           H        ASN 113   6.214   9.125   4.576
  825    HA   ASN 113           HA       ASN 113   5.958  10.953   6.791
  826   1HB   ASN 113          1HB       ASN 113   3.601   9.761   5.692
  827   2HB   ASN 113          2HB       ASN 113   3.882   9.083   7.293
  828   2HD2  ASN 113          2HD2      ASN 113   4.743  10.967   8.832
  829   1HD2  ASN 113          1HD2      ASN 113   3.695  12.340   8.874
  830    H    ARG 114           H        ARG 114   5.275   7.520   6.142
  831    HA   ARG 114           HA       ARG 114   6.889   6.794   8.463
  832   1HB   ARG 114          1HB       ARG 114   4.772   5.478   6.848
  833   2HB   ARG 114          2HB       ARG 114   5.973   4.438   7.593
  834   1HG   ARG 114          1HG       ARG 114   4.470   6.502   9.166
  835   2HG   ARG 114          2HG       ARG 114   3.831   4.880   8.890
  836   1HD   ARG 114          1HD       ARG 114   5.202   3.971  10.405
  837   2HD   ARG 114          2HD       ARG 114   6.596   4.866   9.800
  838    HE   ARG 114           HE       ARG 114   6.165   6.551  11.345
  839   1HH1  ARG 114          1HH1      ARG 114   3.699   4.092  11.448
  840   2HH1  ARG 114          2HH1      ARG 114   3.040   4.635  12.954
  841   1HH2  ARG 114          1HH2      ARG 114   5.304   7.272  13.329
  842   2HH2  ARG 114          2HH2      ARG 114   3.951   6.443  14.023
  843    H    CYS 115           H        CYS 115   7.253   7.140   5.150
  844    HA   CYS 115           HA       CYS 115   9.406   5.141   5.052
  845   1HB   CYS 115          1HB       CYS 115   7.610   4.941   3.349
  846   2HB   CYS 115          2HB       CYS 115   8.051   6.533   2.740
  847    H    LYS 116           H        LYS 116   8.666   8.524   4.280
  848    HA   LYS 116           HA       LYS 116  11.175   9.221   3.257
  849   1HB   LYS 116          1HB       LYS 116   9.085  10.593   3.108
  850   2HB   LYS 116          2HB       LYS 116   9.302  11.021   4.800
  851   1HG   LYS 116          1HG       LYS 116  11.100  12.376   4.373
  852   2HG   LYS 116          2HG       LYS 116  11.536  11.515   2.895
  853   1HD   LYS 116          1HD       LYS 116  10.335  12.917   1.648
  854   2HD   LYS 116          2HD       LYS 116   8.910  12.682   2.663
  855   1HE   LYS 116          1HE       LYS 116   9.361  14.969   2.828
  856   2HE   LYS 116          2HE       LYS 116  10.042  14.286   4.304
  857   1HZ   LYS 116          1HZ       LYS 116  12.149  14.150   2.698
  858   2HZ   LYS 116          2HZ       LYS 116  11.384  15.502   2.030
  859   3HZ   LYS 116          3HZ       LYS 116  11.815  15.496   3.666
  860    H    GLY 117           H        GLY 117  12.801   8.296   4.538
  861   1HA   GLY 117          1HA       GLY 117  13.019   9.276   7.297
  862   2HA   GLY 117          2HA       GLY 117  14.322   9.625   6.175
  863    H    THR 118           H        THR 118  13.141   6.669   5.279
  864    HA   THR 118           HA       THR 118  15.001   5.256   7.074
  865    HB   THR 118           HB       THR 118  13.676   3.217   6.652
  866    HG1  THR 118           HG1      THR 118  12.786   3.916   4.612
  867   1HG2  THR 118          1HG2      THR 118  13.187   4.887   8.538
  868   2HG2  THR 118          2HG2      THR 118  11.790   5.367   7.575
  869   3HG2  THR 118          3HG2      THR 118  11.936   3.705   8.150
  870    H    ASP 119           H        ASP 119  14.843   2.817   5.500
  871    HA   ASP 119           HA       ASP 119  16.267   3.633   3.072
  872   1HB   ASP 119          1HB       ASP 119  17.620   2.732   5.109
  873   2HB   ASP 119          2HB       ASP 119  17.092   1.197   4.456
  874    H    VAL 120           H        VAL 120  15.045   3.042   1.408
  875    HA   VAL 120           HA       VAL 120  13.245   0.823   1.517
  876    HB   VAL 120           HB       VAL 120  12.726   1.375  -0.814
  877   1HG1  VAL 120          1HG1      VAL 120  12.060   2.808   1.350
  878   2HG1  VAL 120          2HG1      VAL 120  12.853   4.065   0.401
  879   3HG1  VAL 120          3HG1      VAL 120  11.482   3.185  -0.272
  880   1HG2  VAL 120          1HG2      VAL 120  15.326   2.522  -0.767
  881   2HG2  VAL 120          2HG2      VAL 120  14.229   2.338  -2.135
  882   3HG2  VAL 120          3HG2      VAL 120  14.169   3.797  -1.147
  883    H    GLN 121           H        GLN 121  16.443   1.445   0.243
  884    HA   GLN 121           HA       GLN 121  16.694  -0.734  -1.495
  885   1HB   GLN 121          1HB       GLN 121  18.409   1.249  -0.367
  886   2HB   GLN 121          2HB       GLN 121  19.180  -0.317  -0.157
  887   1HG   GLN 121          1HG       GLN 121  18.526  -0.611  -2.684
  888   2HG   GLN 121          2HG       GLN 121  18.511   1.152  -2.651
  889   2HE2  GLN 121          2HE2      GLN 121  20.480  -1.698  -2.102
  890   1HE2  GLN 121          1HE2      GLN 121  22.006  -0.919  -2.320
  891    H    ALA 122           H        ALA 122  16.661  -0.500   1.939
  892    HA   ALA 122           HA       ALA 122  17.705  -3.188   2.329
  893   1HB   ALA 122          1HB       ALA 122  17.101  -0.875   4.080
  894   2HB   ALA 122          2HB       ALA 122  16.961  -2.482   4.791
  895   3HB   ALA 122          3HB       ALA 122  18.488  -1.964   4.076
  896    H    TRP 123           H        TRP 123  14.699  -1.559   1.950
  897    HA   TRP 123           HA       TRP 123  13.020  -3.299   3.418
  898   1HB   TRP 123          1HB       TRP 123  12.630  -1.303   1.249
  899   2HB   TRP 123          2HB       TRP 123  11.343  -2.476   1.502
  900    HD1  TRP 123           HD1      TRP 123  11.589   0.836   2.230
  901    HE1  TRP 123           HE1      TRP 123  10.686   1.525   4.540
  902    HE3  TRP 123           HE3      TRP 123  11.610  -3.709   4.539
  903    HZ2  TRP 123           HZ2      TRP 123  10.077   0.271   6.983
  904    HZ3  TRP 123           HZ3      TRP 123  10.854  -3.886   6.854
  905    HH2  TRP 123           HH2      TRP 123  10.095  -1.914   8.063
  906    H    ILE 124           H        ILE 124  14.723  -3.721   0.485
  907    HA   ILE 124           HA       ILE 124  13.255  -6.228  -0.003
  908    HB   ILE 124           HB       ILE 124  13.886  -5.939  -2.435
  909   1HG1  ILE 124          1HG1      ILE 124  13.891  -3.030  -2.240
  910   2HG1  ILE 124          2HG1      ILE 124  15.296  -3.752  -1.462
  911   1HG2  ILE 124          1HG2      ILE 124  11.809  -4.476  -0.937
  912   2HG2  ILE 124          2HG2      ILE 124  12.047  -3.995  -2.616
  913   3HG2  ILE 124          3HG2      ILE 124  11.654  -5.670  -2.226
  914   1HD1  ILE 124          1HD1      ILE 124  14.761  -4.933  -4.049
  915   2HD1  ILE 124          2HD1      ILE 124  15.005  -3.189  -4.143
  916   3HD1  ILE 124          3HD1      ILE 124  16.241  -4.214  -3.414
  917    H    ARG 125           H        ARG 125  15.919  -5.240   1.294
  918    HA   ARG 125           HA       ARG 125  18.019  -6.410  -0.199
  919   1HB   ARG 125          1HB       ARG 125  18.222  -4.729   1.697
  920   2HB   ARG 125          2HB       ARG 125  17.968  -6.076   2.798
  921   1HG   ARG 125          1HG       ARG 125  19.964  -7.169   1.970
  922   2HG   ARG 125          2HG       ARG 125  20.201  -5.881   0.787
  923   1HD   ARG 125          1HD       ARG 125  21.635  -5.247   2.483
  924   2HD   ARG 125          2HD       ARG 125  20.183  -4.324   2.866
  925    HE   ARG 125           HE       ARG 125  20.351  -6.890   4.171
  926   1HH1  ARG 125          1HH1      ARG 125  21.127  -3.498   4.352
  927   2HH1  ARG 125          2HH1      ARG 125  21.254  -3.488   6.080
  928   1HH2  ARG 125          1HH2      ARG 125  20.515  -6.885   6.445
  929   2HH2  ARG 125          2HH2      ARG 125  20.907  -5.413   7.269
  930    H    GLY 126           H        GLY 126  17.438  -8.478  -0.853
  931   1HA   GLY 126          1HA       GLY 126  17.240 -10.467   1.325
  932   2HA   GLY 126          2HA       GLY 126  18.175 -10.742  -0.137
  933    H    CYS 127           H        CYS 127  15.496  -9.075  -1.064
  934    HA   CYS 127           HA       CYS 127  13.471 -11.003  -1.019
  935   1HB   CYS 127          1HB       CYS 127  13.952  -8.490  -2.404
  936   2HB   CYS 127          2HB       CYS 127  12.749  -9.541  -3.124
  937    H    ARG 128           H        ARG 128  12.475 -11.414  -3.460
  938    HA   ARG 128           HA       ARG 128  14.609 -12.789  -4.953
  939   1HB   ARG 128          1HB       ARG 128  11.916 -13.818  -4.104
  940   2HB   ARG 128          2HB       ARG 128  12.742 -14.494  -5.500
  941   1HG   ARG 128          1HG       ARG 128  13.890 -15.822  -4.158
  942   2HG   ARG 128          2HG       ARG 128  14.614 -14.408  -3.389
  943   1HD   ARG 128          1HD       ARG 128  13.480 -14.808  -1.523
  944   2HD   ARG 128          2HD       ARG 128  11.956 -14.735  -2.408
  945    HE   ARG 128           HE       ARG 128  13.520 -17.160  -1.858
  946   1HH1  ARG 128          1HH1      ARG 128  10.590 -15.621  -2.949
  947   2HH1  ARG 128          2HH1      ARG 128   9.671 -17.089  -2.958
  948   1HH2  ARG 128          1HH2      ARG 128  12.317 -19.097  -1.867
  949   2HH2  ARG 128          2HH2      ARG 128  10.652 -19.064  -2.342
  950    H    LEU 129           H        LEU 129  14.564 -10.798  -6.232
  951    HA   LEU 129           HA       LEU 129  12.328 -10.788  -8.153
  952   1HB   LEU 129          1HB       LEU 129  14.003  -8.361  -7.862
  953   2HB   LEU 129          2HB       LEU 129  12.292  -8.509  -8.215
  954    HG   LEU 129           HG       LEU 129  13.418  -9.051  -5.476
  955   1HD1  LEU 129          1HD1      LEU 129  13.901  -6.712  -6.355
  956   2HD1  LEU 129          2HD1      LEU 129  12.155  -6.465  -6.328
  957   3HD1  LEU 129          3HD1      LEU 129  13.017  -6.831  -4.834
  958   1HD2  LEU 129          1HD2      LEU 129  11.040  -9.754  -6.401
  959   2HD2  LEU 129          2HD2      LEU 129  11.257  -9.155  -4.758
  960   3HD2  LEU 129          3HD2      LEU 129  10.667  -8.073  -6.019

  No H/Q in entry =         960
  Start of MODEL    8
    1    H1   LYS   1           H1       LYS   1  -6.879  -9.513   2.597
    2    H2   LYS   1           H2       LYS   1  -7.804 -10.272   1.403
    3    H3   LYS   1           H3       LYS   1  -7.499 -11.062   2.868
    4    HA   LYS   1           HA       LYS   1  -5.443 -11.706   2.293
    5   1HB   LYS   1          1HB       LYS   1  -7.264 -12.130   0.396
    6   2HB   LYS   1          2HB       LYS   1  -6.167 -11.126  -0.541
    7   1HG   LYS   1          1HG       LYS   1  -4.434 -12.883   0.586
    8   2HG   LYS   1          2HG       LYS   1  -5.870 -13.887   0.387
    9   1HD   LYS   1          1HD       LYS   1  -5.037 -14.201  -1.688
   10   2HD   LYS   1          2HD       LYS   1  -5.815 -12.649  -2.009
   11   1HE   LYS   1          1HE       LYS   1  -3.580 -12.555  -2.859
   12   2HE   LYS   1          2HE       LYS   1  -3.669 -11.528  -1.429
   13   1HZ   LYS   1          1HZ       LYS   1  -2.933 -13.937  -0.426
   14   2HZ   LYS   1          2HZ       LYS   1  -2.093 -13.880  -1.893
   15   3HZ   LYS   1          3HZ       LYS   1  -1.886 -12.649  -0.750
   16    H    VAL   2           H        VAL   2  -3.710 -10.510   2.803
   17    HA   VAL   2           HA       VAL   2  -3.106  -8.100   1.244
   18    HB   VAL   2           HB       VAL   2  -2.071  -9.115   3.893
   19   1HG1  VAL   2          1HG1      VAL   2  -0.478  -7.783   2.148
   20   2HG1  VAL   2          2HG1      VAL   2  -1.226  -6.442   3.012
   21   3HG1  VAL   2          3HG1      VAL   2  -0.336  -7.676   3.901
   22   1HG2  VAL   2          1HG2      VAL   2  -4.126  -7.262   3.065
   23   2HG2  VAL   2          2HG2      VAL   2  -3.787  -7.928   4.663
   24   3HG2  VAL   2          3HG2      VAL   2  -2.938  -6.484   4.110
   25    H    PHE   3           H        PHE   3  -1.072  -7.801   0.244
   26    HA   PHE   3           HA       PHE   3   0.163 -10.177  -0.767
   27   1HB   PHE   3          1HB       PHE   3   0.763  -7.231  -1.078
   28   2HB   PHE   3          2HB       PHE   3   1.762  -8.479  -1.805
   29    HD1  PHE   3           HD1      PHE   3   0.001 -10.368  -2.945
   30    HD2  PHE   3           HD2      PHE   3  -0.478  -6.155  -2.637
   31    HE1  PHE   3           HE1      PHE   3  -1.462 -10.394  -4.918
   32    HE2  PHE   3           HE2      PHE   3  -1.938  -6.169  -4.606
   33    HZ   PHE   3           HZ       PHE   3  -2.436  -8.292  -5.755
   34    H    GLY   4           H        GLY   4   2.515 -10.504  -0.647
   35   1HA   GLY   4          1HA       GLY   4   4.212 -11.149   0.822
   36   2HA   GLY   4          2HA       GLY   4   3.440 -10.201   2.088
   37    H    ARG   5           H        ARG   5   6.248 -10.205   1.441
   38    HA   ARG   5           HA       ARG   5   6.549  -7.346   0.969
   39   1HB   ARG   5          1HB       ARG   5   8.426  -9.470   1.998
   40   2HB   ARG   5          2HB       ARG   5   8.967  -7.840   1.621
   41   1HG   ARG   5          1HG       ARG   5   8.055  -6.971   3.477
   42   2HG   ARG   5          2HG       ARG   5   6.618  -7.988   3.374
   43   1HD   ARG   5          1HD       ARG   5   9.076  -9.451   3.987
   44   2HD   ARG   5          2HD       ARG   5   8.626  -8.264   5.210
   45    HE   ARG   5           HE       ARG   5   6.440  -9.413   5.308
   46   1HH1  ARG   5          1HH1      ARG   5   9.199 -11.102   4.015
   47   2HH1  ARG   5          2HH1      ARG   5   8.568 -12.675   4.377
   48   1HH2  ARG   5          1HH2      ARG   5   5.602 -11.478   5.788
   49   2HH2  ARG   5          2HH2      ARG   5   6.523 -12.888   5.383
   50    H    CYS   6           H        CYS   6   8.170 -10.313  -0.184
   51    HA   CYS   6           HA       CYS   6   9.171  -8.845  -2.460
   52   1HB   CYS   6          1HB       CYS   6   9.401 -11.815  -2.134
   53   2HB   CYS   6          2HB       CYS   6  10.467 -10.693  -2.973
   54    H    GLU   7           H        GLU   7   6.705 -11.286  -1.803
   55    HA   GLU   7           HA       GLU   7   6.056 -12.118  -4.340
   56   1HB   GLU   7          1HB       GLU   7   4.341 -11.499  -1.948
   57   2HB   GLU   7          2HB       GLU   7   3.602 -12.006  -3.461
   58   1HG   GLU   7          1HG       GLU   7   4.738 -14.098  -3.401
   59   2HG   GLU   7          2HG       GLU   7   5.729 -13.582  -2.038
   60    H    LEU   8           H        LEU   8   4.899  -9.230  -2.674
   61    HA   LEU   8           HA       LEU   8   3.506  -8.116  -4.853
   62   1HB   LEU   8          1HB       LEU   8   3.135  -7.459  -2.512
   63   2HB   LEU   8          2HB       LEU   8   4.742  -6.766  -2.448
   64    HG   LEU   8           HG       LEU   8   2.658  -5.231  -2.773
   65   1HD1  LEU   8          1HD1      LEU   8   5.020  -4.522  -2.792
   66   2HD1  LEU   8          2HD1      LEU   8   5.086  -4.873  -4.519
   67   3HD1  LEU   8          3HD1      LEU   8   4.016  -3.607  -3.917
   68   1HD2  LEU   8          1HD2      LEU   8   1.870  -6.583  -4.755
   69   2HD2  LEU   8          2HD2      LEU   8   1.952  -4.838  -4.991
   70   3HD2  LEU   8          3HD2      LEU   8   3.211  -5.877  -5.656
   71    H    ALA   9           H        ALA   9   6.850  -7.728  -3.677
   72    HA   ALA   9           HA       ALA   9   7.567  -5.639  -5.428
   73   1HB   ALA   9          1HB       ALA   9   9.109  -7.634  -3.852
   74   2HB   ALA   9          2HB       ALA   9   9.075  -5.875  -3.731
   75   3HB   ALA   9          3HB       ALA   9   9.940  -6.650  -5.057
   76    H    ALA  10           H        ALA  10   8.125  -9.156  -5.762
   77    HA   ALA  10           HA       ALA  10   9.392  -9.166  -8.200
   78   1HB   ALA  10          1HB       ALA  10   9.187 -11.389  -8.037
   79   2HB   ALA  10          2HB       ALA  10   7.426 -11.303  -7.987
   80   3HB   ALA  10          3HB       ALA  10   8.361 -11.089  -6.508
   81    H    ALA  11           H        ALA  11   5.968  -8.863  -7.437
   82    HA   ALA  11           HA       ALA  11   5.035  -9.030 -10.088
   83   1HB   ALA  11          1HB       ALA  11   3.718  -7.561  -7.826
   84   2HB   ALA  11          2HB       ALA  11   3.608  -9.306  -8.062
   85   3HB   ALA  11          3HB       ALA  11   2.941  -8.209  -9.271
   86    H    MET  12           H        MET  12   6.192  -6.489  -8.119
   87    HA   MET  12           HA       MET  12   5.474  -4.285  -9.739
   88   1HB   MET  12          1HB       MET  12   8.004  -4.343  -8.130
   89   2HB   MET  12          2HB       MET  12   6.956  -2.984  -8.451
   90   1HG   MET  12          1HG       MET  12   6.162  -5.321  -6.756
   91   2HG   MET  12          2HG       MET  12   6.872  -3.839  -6.123
   92   1HE   MET  12          1HE       MET  12   5.924  -1.844  -8.002
   93   2HE   MET  12          2HE       MET  12   4.221  -1.398  -7.906
   94   3HE   MET  12          3HE       MET  12   5.256  -1.233  -6.490
   95    H    LYS  13           H        LYS  13   8.493  -6.145  -9.528
   96    HA   LYS  13           HA       LYS  13   9.992  -4.832 -11.436
   97   1HB   LYS  13          1HB       LYS  13  10.752  -6.710  -9.936
   98   2HB   LYS  13          2HB       LYS  13   9.967  -7.828 -11.043
   99   1HG   LYS  13          1HG       LYS  13  12.083  -7.915 -11.860
  100   2HG   LYS  13          2HG       LYS  13  11.466  -6.565 -12.815
  101   1HD   LYS  13          1HD       LYS  13  12.701  -5.018 -11.679
  102   2HD   LYS  13          2HD       LYS  13  12.678  -5.945 -10.177
  103   1HE   LYS  13          1HE       LYS  13  14.202  -6.893 -12.583
  104   2HE   LYS  13          2HE       LYS  13  14.903  -5.742 -11.447
  105   1HZ   LYS  13          1HZ       LYS  13  13.750  -8.292 -10.508
  106   2HZ   LYS  13          2HZ       LYS  13  15.340  -8.215 -11.077
  107   3HZ   LYS  13          3HZ       LYS  13  14.874  -7.293  -9.738
  108    H    ARG  14           H        ARG  14   7.781  -7.572 -11.904
  109    HA   ARG  14           HA       ARG  14   8.075  -7.720 -14.699
  110   1HB   ARG  14          1HB       ARG  14   6.409  -8.935 -12.661
  111   2HB   ARG  14          2HB       ARG  14   5.478  -8.582 -14.110
  112   1HG   ARG  14          1HG       ARG  14   7.017  -9.866 -15.458
  113   2HG   ARG  14          2HG       ARG  14   8.049 -10.148 -14.054
  114   1HD   ARG  14          1HD       ARG  14   6.279 -11.402 -12.970
  115   2HD   ARG  14          2HD       ARG  14   5.184 -11.057 -14.308
  116    HE   ARG  14           HE       ARG  14   7.079 -12.304 -15.624
  117   1HH1  ARG  14          1HH1      ARG  14   5.765 -13.074 -12.489
  118   2HH1  ARG  14          2HH1      ARG  14   6.065 -14.774 -12.639
  119   1HH2  ARG  14          1HH2      ARG  14   7.477 -14.540 -15.829
  120   2HH2  ARG  14          2HH2      ARG  14   7.039 -15.606 -14.537
  121    H    HIS  15           H        HIS  15   5.945  -5.855 -12.597
  122    HA   HIS  15           HA       HIS  15   4.318  -4.873 -14.711
  123   1HB   HIS  15          1HB       HIS  15   4.624  -4.297 -11.794
  124   2HB   HIS  15          2HB       HIS  15   3.717  -3.169 -12.799
  125    HD1  HIS  15           HD1      HIS  15   1.498  -3.756 -11.621
  126    HD2  HIS  15           HD2      HIS  15   3.335  -6.992 -13.469
  127    HE1  HIS  15           HE1      HIS  15  -0.232  -5.579 -11.657
  128    HE2  HIS  15           HE2      HIS  15   0.931  -7.555 -12.703
  129    H    GLY  16           H        GLY  16   7.507  -4.159 -13.974
  130   1HA   GLY  16          1HA       GLY  16   7.449  -1.908 -15.692
  131   2HA   GLY  16          2HA       GLY  16   8.853  -2.596 -14.908
  132    H    LEU  17           H        LEU  17   7.464  -2.128 -12.155
  133    HA   LEU  17           HA       LEU  17   7.480   0.771 -12.162
  134   1HB   LEU  17          1HB       LEU  17   7.215  -0.917  -9.707
  135   2HB   LEU  17          2HB       LEU  17   6.632   0.710  -9.976
  136    HG   LEU  17           HG       LEU  17   5.386  -1.877 -10.612
  137   1HD1  LEU  17          1HD1      LEU  17   4.795   0.256  -9.034
  138   2HD1  LEU  17          2HD1      LEU  17   3.806   0.591 -10.454
  139   3HD1  LEU  17          3HD1      LEU  17   3.619  -0.934  -9.590
  140   1HD2  LEU  17          1HD2      LEU  17   5.495   0.350 -12.588
  141   2HD2  LEU  17          2HD2      LEU  17   5.406  -1.392 -12.852
  142   3HD2  LEU  17          3HD2      LEU  17   3.965  -0.498 -12.366
  143    H    ASP  18           H        ASP  18   9.723  -1.563 -11.973
  144    HA   ASP  18           HA       ASP  18  11.411  -0.511  -9.930
  145   1HB   ASP  18          1HB       ASP  18  11.974  -2.694 -10.298
  146   2HB   ASP  18          2HB       ASP  18  11.672  -2.602 -12.022
  147    H    ASN  19           H        ASN  19  11.789   1.586 -10.194
  148    HA   ASN  19           HA       ASN  19  12.796   3.493 -10.873
  149   1HB   ASN  19          1HB       ASN  19  14.688   1.645 -11.246
  150   2HB   ASN  19          2HB       ASN  19  14.449   2.103 -12.929
  151   2HD2  ASN  19          2HD2      ASN  19  14.749   3.686  -9.764
  152   1HD2  ASN  19          1HD2      ASN  19  15.828   4.924 -10.299
  153    H    TYR  20           H        TYR  20  10.418   2.650 -12.114
  154    HA   TYR  20           HA       TYR  20  10.505   3.160 -14.918
  155   1HB   TYR  20          1HB       TYR  20   8.597   2.021 -13.747
  156   2HB   TYR  20          2HB       TYR  20   8.179   3.563 -13.010
  157    HD1  TYR  20           HD1      TYR  20   8.693   2.000 -16.362
  158    HD2  TYR  20           HD2      TYR  20   6.640   4.937 -14.068
  159    HE1  TYR  20           HE1      TYR  20   7.302   2.545 -18.315
  160    HE2  TYR  20           HE2      TYR  20   5.243   5.490 -16.014
  161    HH   TYR  20           HH       TYR  20   5.935   4.290 -19.173
  162    H    ARG  21           H        ARG  21   9.329   5.198 -15.812
  163    HA   ARG  21           HA       ARG  21  10.657   7.425 -15.678
  164   1HB   ARG  21          1HB       ARG  21   7.836   6.895 -16.075
  165   2HB   ARG  21          2HB       ARG  21   8.086   8.489 -15.376
  166   1HG   ARG  21          1HG       ARG  21   9.683   8.988 -17.202
  167   2HG   ARG  21          2HG       ARG  21   9.282   7.430 -17.927
  168   1HD   ARG  21          1HD       ARG  21   7.316   8.169 -18.722
  169   2HD   ARG  21          2HD       ARG  21   6.957   9.081 -17.256
  170    HE   ARG  21           HE       ARG  21   8.931  10.511 -18.486
  171   1HH1  ARG  21          1HH1      ARG  21   5.782   9.350 -19.424
  172   2HH1  ARG  21          2HH1      ARG  21   5.485  10.658 -20.519
  173   1HH2  ARG  21          1HH2      ARG  21   8.548  12.236 -19.927
  174   2HH2  ARG  21          2HH2      ARG  21   7.057  12.297 -20.807
  175    H    GLY  22           H        GLY  22   8.448   6.420 -13.149
  176   1HA   GLY  22          1HA       GLY  22   8.007   7.290 -11.056
  177   2HA   GLY  22          2HA       GLY  22   8.905   8.732 -11.501
  178    H    TYR  23           H        TYR  23   8.980   5.741  -9.824
  179    HA   TYR  23           HA       TYR  23  11.842   6.125  -9.286
  180   1HB   TYR  23          1HB       TYR  23   9.584   5.940  -7.343
  181   2HB   TYR  23          2HB       TYR  23  11.183   5.377  -6.870
  182    HD1  TYR  23           HD1      TYR  23   9.516   8.348  -8.400
  183    HD2  TYR  23           HD2      TYR  23  12.655   6.898  -5.922
  184    HE1  TYR  23           HE1      TYR  23  10.156  10.660  -7.872
  185    HE2  TYR  23           HE2      TYR  23  13.305   9.208  -5.385
  186    HH   TYR  23           HH       TYR  23  13.082  11.466  -6.394
  187    H    SER  24           H        SER  24  12.582   4.301  -7.678
  188    HA   SER  24           HA       SER  24  12.384   1.877  -9.216
  189   1HB   SER  24          1HB       SER  24  14.270   1.113  -7.937
  190   2HB   SER  24          2HB       SER  24  14.558   2.793  -8.389
  191    HG   SER  24           HG       SER  24  14.748   3.185  -6.346
  192    H    LEU  25           H        LEU  25  12.326  -0.211  -8.106
  193    HA   LEU  25           HA       LEU  25   9.957  -0.878  -7.043
  194   1HB   LEU  25          1HB       LEU  25  12.625  -2.044  -7.103
  195   2HB   LEU  25          2HB       LEU  25  11.666  -2.619  -5.753
  196    HG   LEU  25           HG       LEU  25  10.381  -2.615  -8.417
  197   1HD1  LEU  25          1HD1      LEU  25  12.874  -3.556  -8.418
  198   2HD1  LEU  25          2HD1      LEU  25  12.046  -4.978  -7.784
  199   3HD1  LEU  25          3HD1      LEU  25  11.575  -4.305  -9.345
  200   1HD2  LEU  25          1HD2      LEU  25  10.399  -4.441  -6.021
  201   2HD2  LEU  25          2HD2      LEU  25   9.106  -3.357  -6.535
  202   3HD2  LEU  25          3HD2      LEU  25   9.510  -4.772  -7.508
  203    H    GLY  26           H        GLY  26  12.854  -0.319  -5.020
  204   1HA   GLY  26          1HA       GLY  26  13.033   0.583  -2.908
  205   2HA   GLY  26          2HA       GLY  26  11.878  -0.682  -2.530
  206    H    ASN  27           H        ASN  27  11.268   2.189  -4.504
  207    HA   ASN  27           HA       ASN  27  10.004   3.646  -2.403
  208   1HB   ASN  27          1HB       ASN  27   9.739   4.047  -5.386
  209   2HB   ASN  27          2HB       ASN  27   9.334   5.216  -4.133
  210   2HD2  ASN  27          2HD2      ASN  27  11.900   3.612  -5.838
  211   1HD2  ASN  27          1HD2      ASN  27  13.172   4.662  -5.322
  212    H    TRP  28           H        TRP  28   8.866   1.490  -4.926
  213    HA   TRP  28           HA       TRP  28   6.090   1.995  -4.577
  214   1HB   TRP  28          1HB       TRP  28   7.536  -0.370  -5.763
  215   2HB   TRP  28          2HB       TRP  28   5.797  -0.095  -5.867
  216    HD1  TRP  28           HD1      TRP  28   9.042   0.872  -7.452
  217    HE1  TRP  28           HE1      TRP  28   8.623   2.558  -9.341
  218    HE3  TRP  28           HE3      TRP  28   4.122   1.866  -6.550
  219    HZ2  TRP  28           HZ2      TRP  28   6.472   4.098 -10.347
  220    HZ3  TRP  28           HZ3      TRP  28   2.934   3.443  -8.013
  221    HH2  TRP  28           HH2      TRP  28   4.091   4.542  -9.880
  222    H    VAL  29           H        VAL  29   8.257  -0.558  -3.371
  223    HA   VAL  29           HA       VAL  29   6.279  -1.969  -1.957
  224    HB   VAL  29           HB       VAL  29   9.254  -1.813  -1.444
  225   1HG1  VAL  29          1HG1      VAL  29   7.877  -2.704   0.447
  226   2HG1  VAL  29          2HG1      VAL  29   7.353  -4.001  -0.627
  227   3HG1  VAL  29          3HG1      VAL  29   9.058  -3.838  -0.207
  228   1HG2  VAL  29          1HG2      VAL  29   7.628  -3.201  -3.455
  229   2HG2  VAL  29          2HG2      VAL  29   9.333  -2.754  -3.481
  230   3HG2  VAL  29          3HG2      VAL  29   8.816  -4.212  -2.634
  231    H    CYS  30           H        CYS  30   8.639   0.450  -0.932
  232    HA   CYS  30           HA       CYS  30   7.975   0.529   1.770
  233   1HB   CYS  30          1HB       CYS  30   9.935   1.605   0.464
  234   2HB   CYS  30          2HB       CYS  30   8.841   2.964   0.242
  235    H    ALA  31           H        ALA  31   6.739   2.513  -0.925
  236    HA   ALA  31           HA       ALA  31   5.034   4.114   0.647
  237   1HB   ALA  31          1HB       ALA  31   5.849   4.577  -1.698
  238   2HB   ALA  31          2HB       ALA  31   4.150   4.930  -1.380
  239   3HB   ALA  31          3HB       ALA  31   4.597   3.464  -2.254
  240    H    ALA  32           H        ALA  32   4.389   1.180  -1.255
  241    HA   ALA  32           HA       ALA  32   1.613   1.108  -0.707
  242   1HB   ALA  32          1HB       ALA  32   2.422  -0.075  -2.604
  243   2HB   ALA  32          2HB       ALA  32   1.791  -1.272  -1.473
  244   3HB   ALA  32          3HB       ALA  32   3.532  -1.026  -1.615
  245    H    LYS  33           H        LYS  33   4.365  -0.615   0.735
  246    HA   LYS  33           HA       LYS  33   3.092  -2.267   2.497
  247   1HB   LYS  33          1HB       LYS  33   5.570  -2.086   2.086
  248   2HB   LYS  33          2HB       LYS  33   5.582  -0.707   3.176
  249   1HG   LYS  33          1HG       LYS  33   4.995  -2.038   5.030
  250   2HG   LYS  33          2HG       LYS  33   4.559  -3.405   4.002
  251   1HD   LYS  33          1HD       LYS  33   6.932  -3.564   3.294
  252   2HD   LYS  33          2HD       LYS  33   7.325  -2.284   4.443
  253   1HE   LYS  33          1HE       LYS  33   6.966  -3.630   6.273
  254   2HE   LYS  33          2HE       LYS  33   5.854  -4.690   5.408
  255   1HZ   LYS  33          1HZ       LYS  33   8.107  -5.133   4.065
  256   2HZ   LYS  33          2HZ       LYS  33   8.748  -4.797   5.596
  257   3HZ   LYS  33          3HZ       LYS  33   7.627  -6.049   5.403
  258    H    PHE  34           H        PHE  34   4.185   1.049   3.239
  259    HA   PHE  34           HA       PHE  34   2.805   0.999   5.731
  260   1HB   PHE  34          1HB       PHE  34   4.542   2.867   4.346
  261   2HB   PHE  34          2HB       PHE  34   3.438   3.582   5.502
  262    HD1  PHE  34           HD1      PHE  34   3.409   2.445   7.851
  263    HD2  PHE  34           HD2      PHE  34   6.586   2.073   5.044
  264    HE1  PHE  34           HE1      PHE  34   4.942   1.823   9.673
  265    HE2  PHE  34           HE2      PHE  34   8.124   1.449   6.860
  266    HZ   PHE  34           HZ       PHE  34   7.302   1.324   9.179
  267    H    GLU  35           H        GLU  35   1.828   1.763   2.568
  268    HA   GLU  35           HA       GLU  35  -0.115   3.729   3.244
  269   1HB   GLU  35          1HB       GLU  35   0.913   2.477   0.888
  270   2HB   GLU  35          2HB       GLU  35  -0.841   2.370   0.860
  271   1HG   GLU  35          1HG       GLU  35   0.911   4.784   0.827
  272   2HG   GLU  35          2HG       GLU  35  -0.445   4.366  -0.219
  273    H    SER  36           H        SER  36  -0.365   0.307   2.326
  274    HA   SER  36           HA       SER  36  -2.915   0.170   3.805
  275   1HB   SER  36          1HB       SER  36  -3.691  -1.413   1.977
  276   2HB   SER  36          2HB       SER  36  -3.522   0.273   1.491
  277    HG   SER  36           HG       SER  36  -1.759  -1.879   0.972
  278    H    ASN  37           H        ASN  37   0.084  -0.862   3.983
  279    HA   ASN  37           HA       ASN  37   1.142  -2.682   4.876
  280   1HB   ASN  37          1HB       ASN  37  -1.377  -2.513   6.190
  281   2HB   ASN  37          2HB       ASN  37  -1.066  -4.216   5.869
  282   2HD2  ASN  37          2HD2      ASN  37   0.535  -5.259   6.956
  283   1HD2  ASN  37          1HD2      ASN  37   1.436  -4.546   8.246
  284    H    PHE  38           H        PHE  38   0.042  -2.680   2.194
  285    HA   PHE  38           HA       PHE  38   0.027  -3.951   0.370
  286   1HB   PHE  38          1HB       PHE  38   0.962  -6.070   2.302
  287   2HB   PHE  38          2HB       PHE  38   0.781  -6.353   0.574
  288    HD1  PHE  38           HD1      PHE  38   1.721  -3.750  -0.487
  289    HD2  PHE  38           HD2      PHE  38   3.275  -6.211   2.615
  290    HE1  PHE  38           HE1      PHE  38   3.958  -2.818  -0.884
  291    HE2  PHE  38           HE2      PHE  38   5.520  -5.280   2.226
  292    HZ   PHE  38           HZ       PHE  38   5.865  -3.588   0.473
  293    H    ASN  39           H        ASN  39  -2.334  -3.625   2.150
  294    HA   ASN  39           HA       ASN  39  -3.842  -6.059   1.821
  295   1HB   ASN  39          1HB       ASN  39  -4.234  -4.508   3.725
  296   2HB   ASN  39          2HB       ASN  39  -4.814  -3.296   2.586
  297   2HD2  ASN  39          2HD2      ASN  39  -6.665  -3.559   4.159
  298   1HD2  ASN  39          1HD2      ASN  39  -7.882  -4.710   3.733
  299    H    THR  40           H        THR  40  -4.424  -6.648  -0.145
  300    HA   THR  40           HA       THR  40  -4.672  -4.882  -2.344
  301    HB   THR  40           HB       THR  40  -4.997  -6.754  -3.631
  302    HG1  THR  40           HG1      THR  40  -6.439  -8.324  -3.149
  303   1HG2  THR  40          1HG2      THR  40  -3.018  -7.193  -2.259
  304   2HG2  THR  40          2HG2      THR  40  -4.028  -8.004  -1.063
  305   3HG2  THR  40          3HG2      THR  40  -3.852  -8.689  -2.678
  306    H    GLN  41           H        GLN  41  -6.798  -6.173   0.020
  307    HA   GLN  41           HA       GLN  41  -9.196  -5.214  -1.311
  308   1HB   GLN  41          1HB       GLN  41  -8.532  -7.033   0.926
  309   2HB   GLN  41          2HB       GLN  41 -10.047  -6.173   1.045
  310   1HG   GLN  41          1HG       GLN  41  -9.646  -7.352  -1.573
  311   2HG   GLN  41          2HG       GLN  41  -9.610  -8.544  -0.275
  312   2HE2  GLN  41          2HE2      GLN  41 -11.520  -9.517  -0.387
  313   1HE2  GLN  41          1HE2      GLN  41 -13.053  -8.722  -0.361
  314    H    ALA  42           H        ALA  42  -6.882  -3.704   0.289
  315    HA   ALA  42           HA       ALA  42  -8.094  -2.400   2.448
  316   1HB   ALA  42          1HB       ALA  42  -5.835  -2.115   2.477
  317   2HB   ALA  42          2HB       ALA  42  -6.320  -0.570   1.780
  318   3HB   ALA  42          3HB       ALA  42  -5.731  -1.863   0.735
  319    H    THR  43           H        THR  43  -9.798  -1.134   2.459
  320    HA   THR  43           HA       THR  43 -10.106   0.918   0.380
  321    HB   THR  43           HB       THR  43 -12.463   0.537   0.176
  322    HG1  THR  43           HG1      THR  43 -12.054  -1.158   2.385
  323   1HG2  THR  43          1HG2      THR  43 -10.725  -1.085  -0.949
  324   2HG2  THR  43          2HG2      THR  43 -11.490  -2.283   0.094
  325   3HG2  THR  43          3HG2      THR  43 -12.457  -1.393  -1.081
  326    H    ASN  44           H        ASN  44 -10.217   2.879   1.397
  327    HA   ASN  44           HA       ASN  44 -11.539   3.009   4.011
  328   1HB   ASN  44          1HB       ASN  44  -9.096   2.802   4.391
  329   2HB   ASN  44          2HB       ASN  44  -8.848   4.263   3.440
  330   2HD2  ASN  44          2HD2      ASN  44 -10.759   3.105   6.194
  331   1HD2  ASN  44          1HD2      ASN  44 -10.592   4.544   7.134
  332    H    ARG  45           H        ARG  45 -13.069   4.480   3.938
  333    HA   ARG  45           HA       ARG  45 -13.131   6.492   1.875
  334   1HB   ARG  45          1HB       ARG  45 -15.133   5.199   2.829
  335   2HB   ARG  45          2HB       ARG  45 -15.034   6.296   4.200
  336   1HG   ARG  45          1HG       ARG  45 -16.035   7.936   3.082
  337   2HG   ARG  45          2HG       ARG  45 -15.014   7.702   1.662
  338   1HD   ARG  45          1HD       ARG  45 -17.039   7.137   0.774
  339   2HD   ARG  45          2HD       ARG  45 -16.527   5.558   1.367
  340    HE   ARG  45           HE       ARG  45 -17.900   6.642   3.454
  341   1HH1  ARG  45          1HH1      ARG  45 -18.625   6.039   0.099
  342   2HH1  ARG  45          2HH1      ARG  45 -20.319   5.802   0.375
  343   1HH2  ARG  45          1HH2      ARG  45 -20.128   6.333   3.826
  344   2HH2  ARG  45          2HH2      ARG  45 -21.173   5.970   2.493
  345    H    ASN  46           H        ASN  46 -13.126   8.726   2.162
  346    HA   ASN  46           HA       ASN  46 -11.854   9.633   4.658
  347   1HB   ASN  46          1HB       ASN  46 -11.760  11.137   2.056
  348   2HB   ASN  46          2HB       ASN  46 -10.685  11.275   3.443
  349   2HD2  ASN  46          2HD2      ASN  46  -9.302   9.425   3.906
  350   1HD2  ASN  46          1HD2      ASN  46  -8.713   8.475   2.589
  351    H    THR  47           H        THR  47 -12.196  12.146   4.864
  352    HA   THR  47           HA       THR  47 -15.050  12.495   5.196
  353    HB   THR  47           HB       THR  47 -14.433  14.613   6.336
  354    HG1  THR  47           HG1      THR  47 -12.464  15.379   6.158
  355   1HG2  THR  47          1HG2      THR  47 -14.556  12.457   7.559
  356   2HG2  THR  47          2HG2      THR  47 -12.823  12.249   7.303
  357   3HG2  THR  47          3HG2      THR  47 -13.415  13.595   8.277
  358    H    ASP  48           H        ASP  48 -12.530  13.625   3.082
  359    HA   ASP  48           HA       ASP  48 -13.867  15.924   2.091
  360   1HB   ASP  48          1HB       ASP  48 -12.246  15.676   0.162
  361   2HB   ASP  48          2HB       ASP  48 -11.519  15.813   1.758
  362    H    GLY  49           H        GLY  49 -14.422  12.620   1.665
  363   1HA   GLY  49          1HA       GLY  49 -16.129  13.203  -0.675
  364   2HA   GLY  49          2HA       GLY  49 -16.529  12.032   0.571
  365    H    SER  50           H        SER  50 -13.282  12.259  -0.674
  366    HA   SER  50           HA       SER  50 -13.633  10.229  -2.669
  367   1HB   SER  50          1HB       SER  50 -10.972  10.272  -2.395
  368   2HB   SER  50          2HB       SER  50 -11.846  11.518  -3.285
  369    HG   SER  50           HG       SER  50 -11.527  12.913  -1.684
  370    H    THR  51           H        THR  51 -11.661   8.470  -2.463
  371    HA   THR  51           HA       THR  51 -11.494   7.265   0.145
  372    HB   THR  51           HB       THR  51 -13.014   5.767  -1.996
  373    HG1  THR  51           HG1      THR  51 -14.440   6.203   0.233
  374   1HG2  THR  51          1HG2      THR  51 -11.613   4.875   0.278
  375   2HG2  THR  51          2HG2      THR  51 -13.329   4.763   0.669
  376   3HG2  THR  51          3HG2      THR  51 -12.695   3.945  -0.759
  377    H    ASP  52           H        ASP  52 -10.081   5.373   0.161
  378    HA   ASP  52           HA       ASP  52  -8.329   5.273  -2.204
  379   1HB   ASP  52          1HB       ASP  52  -7.738   4.702   0.708
  380   2HB   ASP  52          2HB       ASP  52  -6.595   4.454  -0.609
  381    H    TYR  53           H        TYR  53  -9.179   3.658  -3.391
  382    HA   TYR  53           HA       TYR  53  -9.754   1.132  -2.036
  383   1HB   TYR  53          1HB       TYR  53 -10.479   2.055  -4.818
  384   2HB   TYR  53          2HB       TYR  53 -10.867   0.478  -4.141
  385    HD1  TYR  53           HD1      TYR  53 -12.234   0.516  -1.907
  386    HD2  TYR  53           HD2      TYR  53 -12.036   3.760  -4.651
  387    HE1  TYR  53           HE1      TYR  53 -14.345   1.398  -1.005
  388    HE2  TYR  53           HE2      TYR  53 -14.144   4.654  -3.755
  389    HH   TYR  53           HH       TYR  53 -15.461   4.519  -1.662
  390    H    GLY  54           H        GLY  54  -7.463   0.699  -1.803
  391   1HA   GLY  54          1HA       GLY  54  -5.962   0.169  -4.231
  392   2HA   GLY  54          2HA       GLY  54  -6.535  -1.284  -3.445
  393    H    ILE  55           H        ILE  55  -4.219  -1.694  -3.567
  394    HA   ILE  55           HA       ILE  55  -2.994  -1.396  -1.009
  395    HB   ILE  55           HB       ILE  55  -2.608  -3.355  -2.556
  396   1HG1  ILE  55          1HG1      ILE  55  -0.134  -1.821  -1.716
  397   2HG1  ILE  55          2HG1      ILE  55  -1.076  -2.897  -0.689
  398   1HG2  ILE  55          1HG2      ILE  55  -1.830  -1.232  -4.320
  399   2HG2  ILE  55          2HG2      ILE  55  -0.493  -2.364  -4.119
  400   3HG2  ILE  55          3HG2      ILE  55  -2.065  -2.945  -4.670
  401   1HD1  ILE  55          1HD1      ILE  55  -0.431  -4.437  -2.904
  402   2HD1  ILE  55          2HD1      ILE  55   1.027  -3.507  -2.560
  403   3HD1  ILE  55          3HD1      ILE  55   0.306  -4.513  -1.304
  404    H    LEU  56           H        LEU  56  -3.104   0.385  -3.910
  405    HA   LEU  56           HA       LEU  56  -0.905   2.126  -3.036
  406   1HB   LEU  56          1HB       LEU  56  -1.668   1.107  -5.664
  407   2HB   LEU  56          2HB       LEU  56  -1.541   2.853  -5.646
  408    HG   LEU  56           HG       LEU  56   0.602   2.279  -6.276
  409   1HD1  LEU  56          1HD1      LEU  56   0.385   3.348  -3.810
  410   2HD1  LEU  56          2HD1      LEU  56   1.338   1.908  -3.448
  411   3HD1  LEU  56          3HD1      LEU  56   1.920   3.074  -4.637
  412   1HD2  LEU  56          1HD2      LEU  56   0.024  -0.201  -5.901
  413   2HD2  LEU  56          2HD2      LEU  56   1.714   0.293  -5.798
  414   3HD2  LEU  56          3HD2      LEU  56   0.786   0.009  -4.325
  415    H    GLN  57           H        GLN  57  -4.094   1.802  -2.787
  416    HA   GLN  57           HA       GLN  57  -5.780   3.180  -2.228
  417   1HB   GLN  57          1HB       GLN  57  -3.884   5.505  -2.509
  418   2HB   GLN  57          2HB       GLN  57  -5.339   5.409  -1.528
  419   1HG   GLN  57          1HG       GLN  57  -2.922   3.689  -1.053
  420   2HG   GLN  57          2HG       GLN  57  -3.158   5.261  -0.291
  421   2HE2  GLN  57          2HE2      GLN  57  -4.513   5.443   1.414
  422   1HE2  GLN  57          1HE2      GLN  57  -5.361   4.116   2.125
  423    H    ILE  58           H        ILE  58  -6.581   2.520  -4.455
  424    HA   ILE  58           HA       ILE  58  -6.287   4.520  -6.513
  425    HB   ILE  58           HB       ILE  58  -8.249   2.233  -6.529
  426   1HG1  ILE  58          1HG1      ILE  58  -6.190   1.157  -6.030
  427   2HG1  ILE  58          2HG1      ILE  58  -6.405   0.990  -7.769
  428   1HG2  ILE  58          1HG2      ILE  58  -8.428   3.997  -8.263
  429   2HG2  ILE  58          2HG2      ILE  58  -6.789   3.602  -8.783
  430   3HG2  ILE  58          3HG2      ILE  58  -8.071   2.399  -8.919
  431   1HD1  ILE  58          1HD1      ILE  58  -4.949   3.158  -7.854
  432   2HD1  ILE  58          2HD1      ILE  58  -4.448   2.633  -6.247
  433   3HD1  ILE  58          3HD1      ILE  58  -4.198   1.577  -7.637
  434    H    ASN  59           H        ASN  59  -7.253   6.415  -6.012
  435    HA   ASN  59           HA       ASN  59  -9.679   6.600  -4.564
  436   1HB   ASN  59          1HB       ASN  59  -7.989   8.398  -4.617
  437   2HB   ASN  59          2HB       ASN  59  -8.318   8.650  -6.329
  438   2HD2  ASN  59          2HD2      ASN  59  -8.627  10.853  -5.244
  439   1HD2  ASN  59          1HD2      ASN  59 -10.246  11.245  -4.789
  440    H    SER  60           H        SER  60 -11.338   5.483  -5.512
  441    HA   SER  60           HA       SER  60 -11.886   5.451  -8.275
  442   1HB   SER  60          1HB       SER  60 -13.782   4.222  -7.736
  443   2HB   SER  60          2HB       SER  60 -12.761   3.929  -6.328
  444    HG   SER  60           HG       SER  60 -13.916   5.556  -5.235
  445    H    ARG  61           H        ARG  61 -12.237   7.962  -6.049
  446    HA   ARG  61           HA       ARG  61 -14.430   9.205  -7.550
  447   1HB   ARG  61          1HB       ARG  61 -14.189   9.070  -4.912
  448   2HB   ARG  61          2HB       ARG  61 -13.190  10.496  -5.159
  449   1HG   ARG  61          1HG       ARG  61 -15.111  11.518  -6.397
  450   2HG   ARG  61          2HG       ARG  61 -16.088  10.142  -5.881
  451   1HD   ARG  61          1HD       ARG  61 -15.532  10.710  -3.525
  452   2HD   ARG  61          2HD       ARG  61 -14.707  12.154  -4.110
  453    HE   ARG  61           HE       ARG  61 -17.598  11.655  -4.187
  454   1HH1  ARG  61          1HH1      ARG  61 -14.886  13.795  -4.641
  455   2HH1  ARG  61          2HH1      ARG  61 -15.864  15.220  -4.752
  456   1HH2  ARG  61          1HH2      ARG  61 -18.893  13.526  -4.331
  457   2HH2  ARG  61          2HH2      ARG  61 -18.141  15.067  -4.575
  458    H    TRP  62           H        TRP  62 -11.548   8.875  -8.357
  459    HA   TRP  62           HA       TRP  62 -11.241  11.487  -9.507
  460   1HB   TRP  62          1HB       TRP  62 -10.086  11.211  -7.045
  461   2HB   TRP  62          2HB       TRP  62  -8.751  10.802  -8.117
  462    HD1  TRP  62           HD1      TRP  62  -8.202  12.748 -10.063
  463    HE1  TRP  62           HE1      TRP  62  -8.254  15.309  -9.808
  464    HE3  TRP  62           HE3      TRP  62 -11.130  13.088  -5.886
  465    HZ2  TRP  62           HZ2      TRP  62  -9.386  17.220  -8.065
  466    HZ3  TRP  62           HZ3      TRP  62 -11.650  15.319  -4.988
  467    HH2  TRP  62           HH2      TRP  62 -10.795  17.341  -6.056
  468    H    TRP  63           H        TRP  63 -10.445   8.153  -9.370
  469    HA   TRP  63           HA       TRP  63  -8.831   8.468 -11.804
  470   1HB   TRP  63          1HB       TRP  63  -8.407   6.554  -9.506
  471   2HB   TRP  63          2HB       TRP  63  -7.622   6.369 -11.072
  472    HD1  TRP  63           HD1      TRP  63  -6.646   7.487  -7.860
  473    HE1  TRP  63           HE1      TRP  63  -4.858   9.344  -7.954
  474    HE3  TRP  63           HE3      TRP  63  -7.214   8.884 -12.712
  475    HZ2  TRP  63           HZ2      TRP  63  -3.836  11.180  -9.867
  476    HZ3  TRP  63           HZ3      TRP  63  -5.851  10.691 -13.613
  477    HH2  TRP  63           HH2      TRP  63  -4.170  11.823 -12.222
  478    H    CYS  64           H        CYS  64 -10.085   5.652 -10.094
  479    HA   CYS  64           HA       CYS  64 -11.126   4.654 -12.622
  480   1HB   CYS  64          1HB       CYS  64 -11.197   2.516 -11.647
  481   2HB   CYS  64          2HB       CYS  64  -9.772   3.257 -10.932
  482    H    ASN  65           H        ASN  65 -13.194   3.783 -12.895
  483    HA   ASN  65           HA       ASN  65 -15.241   5.343 -11.509
  484   1HB   ASN  65          1HB       ASN  65 -15.032   5.076 -14.082
  485   2HB   ASN  65          2HB       ASN  65 -15.760   3.494 -13.822
  486   2HD2  ASN  65          2HD2      ASN  65 -16.229   6.946 -13.492
  487   1HD2  ASN  65          1HD2      ASN  65 -17.955   6.898 -13.429
  488    H    ASP  66           H        ASP  66 -15.911   4.433  -9.673
  489    HA   ASP  66           HA       ASP  66 -16.203   1.533  -9.505
  490   1HB   ASP  66          1HB       ASP  66 -16.393   1.823  -7.131
  491   2HB   ASP  66          2HB       ASP  66 -15.055   2.824  -7.688
  492    H    GLY  67           H        GLY  67 -18.099   4.341  -9.981
  493   1HA   GLY  67          1HA       GLY  67 -20.479   2.785 -10.300
  494   2HA   GLY  67          2HA       GLY  67 -20.345   4.527 -10.469
  495    H    ARG  68           H        ARG  68 -19.111   3.457  -7.515
  496    HA   ARG  68           HA       ARG  68 -21.673   3.650  -6.132
  497   1HB   ARG  68          1HB       ARG  68 -18.923   3.038  -5.035
  498   2HB   ARG  68          2HB       ARG  68 -20.438   2.924  -4.149
  499   1HG   ARG  68          1HG       ARG  68 -20.122   1.352  -6.656
  500   2HG   ARG  68          2HG       ARG  68 -19.315   0.799  -5.186
  501   1HD   ARG  68          1HD       ARG  68 -21.560   1.014  -4.037
  502   2HD   ARG  68          2HD       ARG  68 -22.259   1.226  -5.642
  503    HE   ARG  68           HE       ARG  68 -21.178  -1.027  -6.117
  504   1HH1  ARG  68          1HH1      ARG  68 -22.324  -0.068  -2.969
  505   2HH1  ARG  68          2HH1      ARG  68 -22.643  -1.689  -2.450
  506   1HH2  ARG  68          1HH2      ARG  68 -21.596  -3.165  -5.441
  507   2HH2  ARG  68          2HH2      ARG  68 -22.229  -3.450  -3.854
  508    H    THR  69           H        THR  69 -19.477   5.781  -7.241
  509    HA   THR  69           HA       THR  69 -20.166   7.732  -5.164
  510    HB   THR  69           HB       THR  69 -17.423   7.885  -6.327
  511    HG1  THR  69           HG1      THR  69 -18.317   6.003  -4.426
  512   1HG2  THR  69          1HG2      THR  69 -18.481   9.650  -4.854
  513   2HG2  THR  69          2HG2      THR  69 -18.401   8.478  -3.538
  514   3HG2  THR  69          3HG2      THR  69 -16.918   9.038  -4.312
  515    HA   PRO  70           HA       PRO  70 -21.243   9.763  -9.045
  516   1HB   PRO  70          1HB       PRO  70 -22.488  11.889  -7.895
  517   2HB   PRO  70          2HB       PRO  70 -23.259  10.310  -8.088
  518   1HG   PRO  70          1HG       PRO  70 -21.941  11.493  -5.674
  519   2HG   PRO  70          2HG       PRO  70 -23.458  10.582  -5.787
  520   1HD   PRO  70          1HD       PRO  70 -21.149   9.448  -4.958
  521   2HD   PRO  70          2HD       PRO  70 -22.378   8.546  -5.869
  522    H    GLY  71           H        GLY  71 -20.167  11.248 -10.221
  523   1HA   GLY  71          1HA       GLY  71 -18.644  13.336  -8.824
  524   2HA   GLY  71          2HA       GLY  71 -19.077  13.349 -10.527
  525    H    SER  72           H        SER  72 -18.182  10.347 -10.363
  526    HA   SER  72           HA       SER  72 -15.400  10.359  -9.930
  527   1HB   SER  72          1HB       SER  72 -15.675   8.288 -11.623
  528   2HB   SER  72          2HB       SER  72 -16.145   8.199  -9.925
  529    HG   SER  72           HG       SER  72 -17.788   7.462 -11.378
  530    H    ARG  73           H        ARG  73 -13.757  10.998 -11.152
  531    HA   ARG  73           HA       ARG  73 -14.250  12.376 -13.616
  532   1HB   ARG  73          1HB       ARG  73 -12.110  12.177 -11.692
  533   2HB   ARG  73          2HB       ARG  73 -11.478  11.994 -13.323
  534   1HG   ARG  73          1HG       ARG  73 -11.367  14.243 -13.184
  535   2HG   ARG  73          2HG       ARG  73 -13.040  14.113 -13.731
  536   1HD   ARG  73          1HD       ARG  73 -13.896  14.680 -11.695
  537   2HD   ARG  73          2HD       ARG  73 -12.531  13.999 -10.809
  538    HE   ARG  73           HE       ARG  73 -11.262  15.992 -11.500
  539   1HH1  ARG  73          1HH1      ARG  73 -14.744  16.099 -11.601
  540   2HH1  ARG  73          2HH1      ARG  73 -14.823  17.824 -11.460
  541   1HH2  ARG  73          1HH2      ARG  73 -11.358  18.263 -11.314
  542   2HH2  ARG  73          2HH2      ARG  73 -12.898  19.054 -11.297
  543    H    ASN  74           H        ASN  74 -12.670   9.352 -12.693
  544    HA   ASN  74           HA       ASN  74 -12.165   7.454 -13.867
  545   1HB   ASN  74          1HB       ASN  74 -14.536   8.041 -14.850
  546   2HB   ASN  74          2HB       ASN  74 -13.621   8.496 -16.285
  547   2HD2  ASN  74          2HD2      ASN  74 -14.278   6.882 -17.605
  548   1HD2  ASN  74          1HD2      ASN  74 -13.929   5.212 -17.338
  549    H    LEU  75           H        LEU  75 -10.535   9.831 -13.917
  550    HA   LEU  75           HA       LEU  75  -9.402  10.558 -16.320
  551   1HB   LEU  75          1HB       LEU  75  -8.595  10.308 -13.495
  552   2HB   LEU  75          2HB       LEU  75  -7.284  10.435 -14.645
  553    HG   LEU  75           HG       LEU  75  -9.573  12.399 -14.313
  554   1HD1  LEU  75          1HD1      LEU  75  -7.963  12.333 -12.414
  555   2HD1  LEU  75          2HD1      LEU  75  -6.681  12.765 -13.548
  556   3HD1  LEU  75          3HD1      LEU  75  -8.019  13.880 -13.261
  557   1HD2  LEU  75          1HD2      LEU  75  -8.607  12.246 -16.611
  558   2HD2  LEU  75          2HD2      LEU  75  -8.420  13.827 -15.851
  559   3HD2  LEU  75          3HD2      LEU  75  -7.049  12.720 -15.934
  560    H    CYS  76           H        CYS  76  -8.406   8.158 -14.077
  561    HA   CYS  76           HA       CYS  76  -6.407   6.915 -15.604
  562   1HB   CYS  76          1HB       CYS  76  -7.350   6.896 -13.045
  563   2HB   CYS  76          2HB       CYS  76  -7.822   5.305 -13.626
  564    H    ASN  77           H        ASN  77  -9.836   6.469 -15.218
  565    HA   ASN  77           HA       ASN  77 -11.396   5.142 -16.233
  566   1HB   ASN  77          1HB       ASN  77 -10.251   6.436 -18.198
  567   2HB   ASN  77          2HB       ASN  77  -9.548   4.869 -18.587
  568   2HD2  ASN  77          2HD2      ASN  77 -11.753   6.764 -19.684
  569   1HD2  ASN  77          1HD2      ASN  77 -13.025   5.667 -20.087
  570    H    ILE  78           H        ILE  78 -10.093   3.745 -14.468
  571    HA   ILE  78           HA       ILE  78  -9.389   1.235 -15.808
  572    HB   ILE  78           HB       ILE  78  -7.625   0.891 -14.471
  573   1HG1  ILE  78          1HG1      ILE  78  -9.493   1.771 -12.359
  574   2HG1  ILE  78          2HG1      ILE  78  -8.352   0.432 -12.365
  575   1HG2  ILE  78          1HG2      ILE  78  -7.532   3.275 -15.363
  576   2HG2  ILE  78          2HG2      ILE  78  -7.869   3.778 -13.706
  577   3HG2  ILE  78          3HG2      ILE  78  -6.414   2.848 -14.067
  578   1HD1  ILE  78          1HD1      ILE  78  -6.544   2.181 -12.022
  579   2HD1  ILE  78          2HD1      ILE  78  -7.858   3.303 -11.668
  580   3HD1  ILE  78          3HD1      ILE  78  -7.631   1.869 -10.668
  581    HA   PRO  79           HA       PRO  79 -12.647  -0.657 -13.465
  582   1HB   PRO  79          1HB       PRO  79 -11.358  -3.229 -13.467
  583   2HB   PRO  79          2HB       PRO  79 -12.663  -2.670 -14.513
  584   1HG   PRO  79          1HG       PRO  79 -10.108  -3.231 -15.374
  585   2HG   PRO  79          2HG       PRO  79 -11.239  -2.156 -16.214
  586   1HD   PRO  79          1HD       PRO  79  -8.950  -1.474 -14.415
  587   2HD   PRO  79          2HD       PRO  79  -9.512  -0.655 -15.889
  588    H    CYS  80           H        CYS  80 -12.763  -0.172 -11.337
  589    HA   CYS  80           HA       CYS  80 -10.623  -0.312  -9.544
  590   1HB   CYS  80          1HB       CYS  80 -13.491  -0.448  -8.660
  591   2HB   CYS  80          2HB       CYS  80 -12.135   0.372  -7.891
  592    H    SER  81           H        SER  81 -13.521  -2.417  -9.605
  593    HA   SER  81           HA       SER  81 -12.681  -4.228  -7.694
  594   1HB   SER  81          1HB       SER  81 -14.258  -5.832  -8.784
  595   2HB   SER  81          2HB       SER  81 -14.956  -4.238  -8.504
  596    HG   SER  81           HG       SER  81 -13.714  -4.546 -10.944
  597    H    ALA  82           H        ALA  82 -11.606  -3.932 -10.989
  598    HA   ALA  82           HA       ALA  82 -10.574  -6.579 -11.253
  599   1HB   ALA  82          1HB       ALA  82 -11.140  -4.936 -13.120
  600   2HB   ALA  82          2HB       ALA  82  -9.665  -5.887 -13.297
  601   3HB   ALA  82          3HB       ALA  82  -9.572  -4.202 -12.785
  602    H    LEU  83           H        LEU  83  -9.595  -4.018  -9.380
  603    HA   LEU  83           HA       LEU  83  -6.776  -4.862  -9.399
  604   1HB   LEU  83          1HB       LEU  83  -6.143  -2.763  -8.718
  605   2HB   LEU  83          2HB       LEU  83  -7.545  -2.384  -9.699
  606    HG   LEU  83           HG       LEU  83  -8.673  -2.668  -7.223
  607   1HD1  LEU  83          1HD1      LEU  83  -6.196  -2.809  -6.436
  608   2HD1  LEU  83          2HD1      LEU  83  -6.216  -1.062  -6.677
  609   3HD1  LEU  83          3HD1      LEU  83  -7.346  -1.809  -5.547
  610   1HD2  LEU  83          1HD2      LEU  83  -7.544  -0.165  -8.471
  611   2HD2  LEU  83          2HD2      LEU  83  -9.115  -0.886  -8.820
  612   3HD2  LEU  83          3HD2      LEU  83  -8.786  -0.221  -7.220
  613    H    LEU  84           H        LEU  84  -9.652  -5.133  -7.681
  614    HA   LEU  84           HA       LEU  84  -8.262  -5.695  -5.159
  615   1HB   LEU  84          1HB       LEU  84 -11.231  -5.597  -5.364
  616   2HB   LEU  84          2HB       LEU  84 -10.186  -5.134  -4.032
  617    HG   LEU  84           HG       LEU  84 -10.077  -3.526  -6.535
  618   1HD1  LEU  84          1HD1      LEU  84 -12.470  -3.908  -4.965
  619   2HD1  LEU  84          2HD1      LEU  84 -11.931  -2.229  -4.931
  620   3HD1  LEU  84          3HD1      LEU  84 -12.239  -3.026  -6.474
  621   1HD2  LEU  84          1HD2      LEU  84  -8.737  -3.345  -4.233
  622   2HD2  LEU  84          2HD2      LEU  84  -9.144  -1.940  -5.217
  623   3HD2  LEU  84          3HD2      LEU  84 -10.137  -2.355  -3.821
  624    H    SER  85           H        SER  85  -8.057  -7.537  -7.256
  625    HA   SER  85           HA       SER  85  -9.499  -9.804  -6.085
  626   1HB   SER  85          1HB       SER  85  -8.929 -10.351  -8.847
  627   2HB   SER  85          2HB       SER  85 -10.493 -10.325  -8.035
  628    HG   SER  85           HG       SER  85 -10.770  -8.244  -8.596
  629    H    SER  86           H        SER  86  -7.013  -8.817  -5.476
  630    HA   SER  86           HA       SER  86  -4.953  -9.603  -4.873
  631   1HB   SER  86          1HB       SER  86  -5.525 -12.113  -6.463
  632   2HB   SER  86          2HB       SER  86  -4.388 -11.912  -5.131
  633    HG   SER  86           HG       SER  86  -5.978 -12.572  -3.936
  634    H    ASP  87           H        ASP  87  -5.883  -8.369  -7.433
  635    HA   ASP  87           HA       ASP  87  -3.521  -8.878  -9.102
  636   1HB   ASP  87          1HB       ASP  87  -5.840  -9.471  -9.939
  637   2HB   ASP  87          2HB       ASP  87  -6.177  -7.747  -9.938
  638    H    ILE  88           H        ILE  88  -2.061  -7.259  -8.807
  639    HA   ILE  88           HA       ILE  88  -3.043  -4.576  -8.226
  640    HB   ILE  88           HB       ILE  88  -0.404  -4.210  -8.222
  641   1HG1  ILE  88          1HG1      ILE  88  -0.358  -6.902  -7.004
  642   2HG1  ILE  88          2HG1      ILE  88  -0.420  -6.865  -8.764
  643   1HG2  ILE  88          1HG2      ILE  88  -2.257  -5.197  -6.113
  644   2HG2  ILE  88          2HG2      ILE  88  -0.549  -4.981  -5.732
  645   3HG2  ILE  88          3HG2      ILE  88  -1.504  -3.614  -6.305
  646   1HD1  ILE  88          1HD1      ILE  88   1.546  -5.064  -7.534
  647   2HD1  ILE  88          2HD1      ILE  88   1.849  -6.789  -7.325
  648   3HD1  ILE  88          3HD1      ILE  88   1.685  -6.112  -8.945
  649    H    THR  89           H        THR  89  -3.377  -5.815 -10.857
  650    HA   THR  89           HA       THR  89  -1.483  -4.514 -12.603
  651    HB   THR  89           HB       THR  89  -4.146  -5.697 -13.407
  652    HG1  THR  89           HG1      THR  89  -1.821  -7.220 -13.634
  653   1HG2  THR  89          1HG2      THR  89  -1.710  -4.768 -14.806
  654   2HG2  THR  89          2HG2      THR  89  -2.447  -6.250 -15.414
  655   3HG2  THR  89          3HG2      THR  89  -3.393  -4.764 -15.335
  656    H    ALA  90           H        ALA  90  -4.936  -4.164 -11.836
  657    HA   ALA  90           HA       ALA  90  -5.276  -1.809 -13.305
  658   1HB   ALA  90          1HB       ALA  90  -6.877  -3.365 -11.394
  659   2HB   ALA  90          2HB       ALA  90  -7.288  -1.655 -11.535
  660   3HB   ALA  90          3HB       ALA  90  -7.321  -2.691 -12.962
  661    H    SER  91           H        SER  91  -4.536  -2.469  -9.921
  662    HA   SER  91           HA       SER  91  -4.682   0.186  -8.975
  663   1HB   SER  91          1HB       SER  91  -4.349  -2.231  -7.783
  664   2HB   SER  91          2HB       SER  91  -2.705  -1.601  -7.698
  665    HG   SER  91           HG       SER  91  -4.109  -1.055  -5.891
  666    H    VAL  92           H        VAL  92  -2.012  -1.730 -10.249
  667    HA   VAL  92           HA       VAL  92  -0.117   0.360  -9.815
  668    HB   VAL  92           HB       VAL  92   0.071  -2.159 -11.452
  669   1HG1  VAL  92          1HG1      VAL  92   1.915   0.211 -11.371
  670   2HG1  VAL  92          2HG1      VAL  92   2.562  -1.409 -11.629
  671   3HG1  VAL  92          3HG1      VAL  92   1.385  -0.738 -12.759
  672   1HG2  VAL  92          1HG2      VAL  92   1.435  -1.159  -8.951
  673   2HG2  VAL  92          2HG2      VAL  92   0.285  -2.489  -9.080
  674   3HG2  VAL  92          3HG2      VAL  92   1.888  -2.635  -9.802
  675    H    ASN  93           H        ASN  93  -1.656  -0.887 -12.796
  676    HA   ASN  93           HA       ASN  93  -0.597   0.718 -14.633
  677   1HB   ASN  93          1HB       ASN  93  -2.131  -0.306 -15.843
  678   2HB   ASN  93          2HB       ASN  93  -2.943  -0.788 -14.376
  679   2HD2  ASN  93          2HD2      ASN  93  -4.840   0.138 -13.835
  680   1HD2  ASN  93          1HD2      ASN  93  -5.614   1.379 -14.754
  681    H    CYS  94           H        CYS  94  -3.149   1.555 -12.386
  682    HA   CYS  94           HA       CYS  94  -3.609   4.165 -13.324
  683   1HB   CYS  94          1HB       CYS  94  -4.913   2.658 -11.578
  684   2HB   CYS  94          2HB       CYS  94  -3.927   3.553 -10.423
  685    H    ALA  95           H        ALA  95  -1.504   2.937 -10.714
  686    HA   ALA  95           HA       ALA  95  -0.522   5.532 -10.064
  687   1HB   ALA  95          1HB       ALA  95  -0.466   3.699  -8.466
  688   2HB   ALA  95          2HB       ALA  95   0.751   2.888  -9.454
  689   3HB   ALA  95          3HB       ALA  95   1.115   4.442  -8.699
  690    H    LYS  96           H        LYS  96   0.619   2.963 -12.210
  691    HA   LYS  96           HA       LYS  96   3.143   3.861 -12.820
  692   1HB   LYS  96          1HB       LYS  96   1.925   1.811 -13.753
  693   2HB   LYS  96          2HB       LYS  96   1.185   2.903 -14.915
  694   1HG   LYS  96          1HG       LYS  96   3.969   3.379 -14.972
  695   2HG   LYS  96          2HG       LYS  96   3.725   1.632 -15.022
  696   1HD   LYS  96          1HD       LYS  96   1.808   2.814 -16.740
  697   2HD   LYS  96          2HD       LYS  96   3.372   3.546 -17.103
  698   1HE   LYS  96          1HE       LYS  96   4.353   1.318 -17.357
  699   2HE   LYS  96          2HE       LYS  96   2.789   0.589 -16.994
  700   1HZ   LYS  96          1HZ       LYS  96   2.140   2.217 -19.002
  701   2HZ   LYS  96          2HZ       LYS  96   3.728   1.832 -19.438
  702   3HZ   LYS  96          3HZ       LYS  96   2.589   0.601 -19.217
  703    H    LYS  97           H        LYS  97   0.012   4.906 -13.689
  704    HA   LYS  97           HA       LYS  97   0.840   7.026 -15.490
  705   1HB   LYS  97          1HB       LYS  97  -1.667   5.745 -14.762
  706   2HB   LYS  97          2HB       LYS  97  -1.820   7.496 -14.794
  707   1HG   LYS  97          1HG       LYS  97  -1.878   7.507 -17.006
  708   2HG   LYS  97          2HG       LYS  97  -0.372   6.590 -17.100
  709   1HD   LYS  97          1HD       LYS  97  -1.565   4.889 -17.902
  710   2HD   LYS  97          2HD       LYS  97  -2.287   4.734 -16.299
  711   1HE   LYS  97          1HE       LYS  97  -4.225   5.060 -17.385
  712   2HE   LYS  97          2HE       LYS  97  -3.759   6.760 -17.345
  713   1HZ   LYS  97          1HZ       LYS  97  -2.659   5.274 -19.561
  714   2HZ   LYS  97          2HZ       LYS  97  -4.346   5.384 -19.578
  715   3HZ   LYS  97          3HZ       LYS  97  -3.409   6.792 -19.540
  716    H    ILE  98           H        ILE  98  -0.192   6.647 -12.154
  717    HA   ILE  98           HA       ILE  98  -0.550   9.349 -11.533
  718    HB   ILE  98           HB       ILE  98   0.243   7.072  -9.745
  719   1HG1  ILE  98          1HG1      ILE  98  -2.405   8.521  -9.976
  720   2HG1  ILE  98          2HG1      ILE  98  -2.032   7.065 -10.891
  721   1HG2  ILE  98          1HG2      ILE  98   0.185   9.918  -9.233
  722   2HG2  ILE  98          2HG2      ILE  98  -0.936   9.044  -8.190
  723   3HG2  ILE  98          3HG2      ILE  98   0.771   8.603  -8.215
  724   1HD1  ILE  98          1HD1      ILE  98  -1.428   6.277  -8.365
  725   2HD1  ILE  98          2HD1      ILE  98  -2.767   7.390  -8.082
  726   3HD1  ILE  98          3HD1      ILE  98  -2.978   6.014  -9.165
  727    H    VAL  99           H        VAL  99   2.266   7.260 -11.165
  728    HA   VAL  99           HA       VAL  99   3.988   9.321 -10.238
  729    HB   VAL  99           HB       VAL  99   4.199   6.765  -9.918
  730   1HG1  VAL  99          1HG1      VAL  99   4.298   6.436 -12.459
  731   2HG1  VAL  99          2HG1      VAL  99   5.971   6.975 -12.327
  732   3HG1  VAL  99          3HG1      VAL  99   5.439   5.531 -11.464
  733   1HG2  VAL  99          1HG2      VAL  99   6.527   8.592 -10.452
  734   2HG2  VAL  99          2HG2      VAL  99   5.740   8.264  -8.908
  735   3HG2  VAL  99          3HG2      VAL  99   6.685   7.004  -9.701
  736    H    SER 100           H        SER 100   3.055   8.156 -13.382
  737    HA   SER 100           HA       SER 100   5.283   9.433 -14.729
  738   1HB   SER 100          1HB       SER 100   4.156   7.342 -15.592
  739   2HB   SER 100          2HB       SER 100   2.748   8.335 -15.966
  740    HG   SER 100           HG       SER 100   4.618   9.648 -17.067
  741    H    ASP 101           H        ASP 101   2.412  10.387 -13.355
  742    HA   ASP 101           HA       ASP 101   1.928  12.597 -15.204
  743   1HB   ASP 101          1HB       ASP 101   0.074  11.158 -14.154
  744   2HB   ASP 101          2HB       ASP 101   0.390  12.056 -12.672
  745    H    GLY 102           H        GLY 102   3.871  12.013 -12.579
  746   1HA   GLY 102          1HA       GLY 102   3.675  14.787 -11.602
  747   2HA   GLY 102          2HA       GLY 102   5.216  14.162 -12.163
  748    H    ASN 103           H        ASN 103   2.626  12.925 -10.040
  749    HA   ASN 103           HA       ASN 103   4.003  13.134  -7.636
  750   1HB   ASN 103          1HB       ASN 103   1.862  11.187  -8.502
  751   2HB   ASN 103          2HB       ASN 103   2.440  11.318  -6.843
  752   2HD2  ASN 103          2HD2      ASN 103   2.107  13.296  -5.719
  753   1HD2  ASN 103          1HD2      ASN 103   0.809  14.346  -6.163
  754    H    GLY 104           H        GLY 104   6.123  12.464  -7.739
  755   1HA   GLY 104          1HA       GLY 104   7.892  10.982  -8.172
  756   2HA   GLY 104          2HA       GLY 104   6.721   9.739  -8.579
  757    H    MET 105           H        MET 105   5.284   9.141  -6.590
  758    HA   MET 105           HA       MET 105   5.357   7.768  -4.754
  759   1HB   MET 105          1HB       MET 105   8.143   8.799  -4.189
  760   2HB   MET 105          2HB       MET 105   7.360   7.404  -3.461
  761   1HG   MET 105          1HG       MET 105   8.548   7.712  -6.173
  762   2HG   MET 105          2HG       MET 105   8.756   6.421  -4.991
  763   1HE   MET 105          1HE       MET 105   6.038   5.817  -4.067
  764   2HE   MET 105          2HE       MET 105   5.126   4.822  -5.201
  765   3HE   MET 105          3HE       MET 105   6.751   4.340  -4.714
  766    H    ASN 106           H        ASN 106   5.259  10.916  -5.096
  767    HA   ASN 106           HA       ASN 106   5.298  11.697  -2.302
  768   1HB   ASN 106          1HB       ASN 106   5.226  13.062  -4.932
  769   2HB   ASN 106          2HB       ASN 106   4.450  13.888  -3.595
  770   2HD2  ASN 106          2HD2      ASN 106   5.790  15.433  -2.968
  771   1HD2  ASN 106          1HD2      ASN 106   7.474  15.234  -2.637
  772    H    ALA 107           H        ALA 107   3.034  10.948  -4.852
  773    HA   ALA 107           HA       ALA 107   0.713  12.138  -3.870
  774   1HB   ALA 107          1HB       ALA 107   1.339   9.931  -5.709
  775   2HB   ALA 107          2HB       ALA 107  -0.260   9.858  -4.967
  776   3HB   ALA 107          3HB       ALA 107   0.218  11.281  -5.892
  777    H    TRP 108           H        TRP 108   2.287   9.126  -3.005
  778    HA   TRP 108           HA       TRP 108   0.179   8.406  -1.148
  779   1HB   TRP 108          1HB       TRP 108   2.834   7.046  -1.660
  780   2HB   TRP 108          2HB       TRP 108   1.458   6.368  -0.791
  781    HD1  TRP 108           HD1      TRP 108  -0.580   5.454  -2.233
  782    HE1  TRP 108           HE1      TRP 108  -0.852   4.923  -4.738
  783    HE3  TRP 108           HE3      TRP 108   3.589   7.804  -4.025
  784    HZ2  TRP 108           HZ2      TRP 108   0.515   5.434  -7.161
  785    HZ3  TRP 108           HZ3      TRP 108   4.036   7.737  -6.443
  786    HH2  TRP 108           HH2      TRP 108   2.532   6.576  -7.975
  787    H    VAL 109           H        VAL 109   0.104   9.171   0.825
  788    HA   VAL 109           HA       VAL 109   2.165  10.743   1.969
  789    HB   VAL 109           HB       VAL 109   0.160   9.773   3.789
  790   1HG1  VAL 109          1HG1      VAL 109   1.638  12.184   3.207
  791   2HG1  VAL 109          2HG1      VAL 109  -0.062  12.511   3.541
  792   3HG1  VAL 109          3HG1      VAL 109   0.918  11.644   4.724
  793   1HG2  VAL 109          1HG2      VAL 109  -0.612  10.869   1.152
  794   2HG2  VAL 109          2HG2      VAL 109  -1.456   9.714   2.183
  795   3HG2  VAL 109          3HG2      VAL 109  -1.502  11.435   2.566
  796    H    ALA 110           H        ALA 110   1.363   7.379   2.253
  797    HA   ALA 110           HA       ALA 110   2.604   6.912   4.755
  798   1HB   ALA 110          1HB       ALA 110   2.443   4.845   2.590
  799   2HB   ALA 110          2HB       ALA 110   2.303   4.640   4.337
  800   3HB   ALA 110          3HB       ALA 110   0.993   5.398   3.430
  801    H    TRP 111           H        TRP 111   3.821   7.479   1.616
  802    HA   TRP 111           HA       TRP 111   6.398   6.268   2.163
  803   1HB   TRP 111          1HB       TRP 111   5.557   6.148  -0.118
  804   2HB   TRP 111          2HB       TRP 111   5.444   7.898  -0.200
  805    HD1  TRP 111           HD1      TRP 111   7.923   5.044  -0.490
  806    HE1  TRP 111           HE1      TRP 111  10.176   5.964  -1.329
  807    HE3  TRP 111           HE3      TRP 111   6.946  10.052  -0.138
  808    HZ2  TRP 111           HZ2      TRP 111  11.380   8.473  -1.780
  809    HZ3  TRP 111           HZ3      TRP 111   8.704  11.645  -0.793
  810    HH2  TRP 111           HH2      TRP 111  10.874  10.870  -1.597
  811    H    ARG 112           H        ARG 112   4.938   9.502   2.033
  812    HA   ARG 112           HA       ARG 112   7.495  10.733   2.701
  813   1HB   ARG 112          1HB       ARG 112   5.000  11.581   1.500
  814   2HB   ARG 112          2HB       ARG 112   5.504  12.664   2.789
  815   1HG   ARG 112          1HG       ARG 112   7.831  12.440   1.500
  816   2HG   ARG 112          2HG       ARG 112   6.731  12.152   0.151
  817   1HD   ARG 112          1HD       ARG 112   5.940  14.275   0.166
  818   2HD   ARG 112          2HD       ARG 112   6.068  14.423   1.918
  819    HE   ARG 112           HE       ARG 112   8.360  14.666   0.076
  820   1HH1  ARG 112          1HH1      ARG 112   6.648  15.556   2.978
  821   2HH1  ARG 112          2HH1      ARG 112   7.824  16.732   3.464
  822   1HH2  ARG 112          1HH2      ARG 112   9.912  16.211   0.708
  823   2HH2  ARG 112          2HH2      ARG 112   9.678  17.104   2.174
  824    H    ASN 113           H        ASN 113   6.656   9.034   4.654
  825    HA   ASN 113           HA       ASN 113   6.350  10.841   6.883
  826   1HB   ASN 113          1HB       ASN 113   3.998  10.035   5.935
  827   2HB   ASN 113          2HB       ASN 113   4.363   8.622   6.921
  828   2HD2  ASN 113          2HD2      ASN 113   4.633  12.153   7.208
  829   1HD2  ASN 113          1HD2      ASN 113   3.946  12.245   8.790
  830    H    ARG 114           H        ARG 114   5.910   7.376   6.221
  831    HA   ARG 114           HA       ARG 114   7.699   6.774   8.459
  832   1HB   ARG 114          1HB       ARG 114   5.496   5.344   7.077
  833   2HB   ARG 114          2HB       ARG 114   6.797   4.364   7.733
  834   1HG   ARG 114          1HG       ARG 114   5.289   4.415   9.474
  835   2HG   ARG 114          2HG       ARG 114   6.394   5.723   9.902
  836   1HD   ARG 114          1HD       ARG 114   4.362   6.782   8.219
  837   2HD   ARG 114          2HD       ARG 114   3.589   5.838   9.491
  838    HE   ARG 114           HE       ARG 114   5.086   8.296   9.803
  839   1HH1  ARG 114          1HH1      ARG 114   3.714   5.496  11.358
  840   2HH1  ARG 114          2HH1      ARG 114   3.667   6.231  12.927
  841   1HH2  ARG 114          1HH2      ARG 114   5.029   9.271  11.863
  842   2HH2  ARG 114          2HH2      ARG 114   4.414   8.376  13.213
  843    H    CYS 115           H        CYS 115   7.900   7.181   5.185
  844    HA   CYS 115           HA       CYS 115  10.040   5.176   4.933
  845   1HB   CYS 115          1HB       CYS 115   8.054   5.029   3.368
  846   2HB   CYS 115          2HB       CYS 115   8.624   6.531   2.648
  847    H    LYS 116           H        LYS 116   9.185   8.523   4.066
  848    HA   LYS 116           HA       LYS 116  11.576   9.261   2.880
  849   1HB   LYS 116          1HB       LYS 116   9.312  10.547   3.220
  850   2HB   LYS 116          2HB       LYS 116  10.122  11.196   4.639
  851   1HG   LYS 116          1HG       LYS 116  12.032  11.615   2.804
  852   2HG   LYS 116          2HG       LYS 116  10.600  11.714   1.777
  853   1HD   LYS 116          1HD       LYS 116   9.956  13.674   2.668
  854   2HD   LYS 116          2HD       LYS 116  10.360  13.167   4.310
  855   1HE   LYS 116          1HE       LYS 116  12.013  14.677   4.126
  856   2HE   LYS 116          2HE       LYS 116  12.830  13.406   3.217
  857   1HZ   LYS 116          1HZ       LYS 116  11.209  14.714   1.407
  858   2HZ   LYS 116          2HZ       LYS 116  11.928  15.940   2.326
  859   3HZ   LYS 116          3HZ       LYS 116  12.894  14.809   1.520
  860    H    GLY 117           H        GLY 117  13.406   8.499   3.894
  861   1HA   GLY 117          1HA       GLY 117  13.915   9.560   6.603
  862   2HA   GLY 117          2HA       GLY 117  15.118   9.665   5.328
  863    H    THR 118           H        THR 118  13.749   6.788   4.715
  864    HA   THR 118           HA       THR 118  15.501   5.354   6.598
  865    HB   THR 118           HB       THR 118  14.049   3.396   6.293
  866    HG1  THR 118           HG1      THR 118  12.159   3.575   5.085
  867   1HG2  THR 118          1HG2      THR 118  13.490   5.661   7.776
  868   2HG2  THR 118          2HG2      THR 118  11.960   5.306   6.971
  869   3HG2  THR 118          3HG2      THR 118  12.736   4.079   7.973
  870    H    ASP 119           H        ASP 119  15.072   2.859   5.054
  871    HA   ASP 119           HA       ASP 119  16.594   3.457   2.630
  872   1HB   ASP 119          1HB       ASP 119  17.907   2.605   4.709
  873   2HB   ASP 119          2HB       ASP 119  17.298   1.066   4.148
  874    H    VAL 120           H        VAL 120  15.162   2.936   1.098
  875    HA   VAL 120           HA       VAL 120  13.364   0.728   1.320
  876    HB   VAL 120           HB       VAL 120  12.742   1.269  -1.007
  877   1HG1  VAL 120          1HG1      VAL 120  12.396   2.856   1.281
  878   2HG1  VAL 120          2HG1      VAL 120  12.680   3.973  -0.055
  879   3HG1  VAL 120          3HG1      VAL 120  11.373   2.794  -0.153
  880   1HG2  VAL 120          1HG2      VAL 120  15.042   3.196  -0.785
  881   2HG2  VAL 120          2HG2      VAL 120  14.785   1.935  -1.991
  882   3HG2  VAL 120          3HG2      VAL 120  13.760   3.370  -1.984
  883    H    GLN 121           H        GLN 121  16.490   1.312  -0.127
  884    HA   GLN 121           HA       GLN 121  16.618  -0.874  -1.875
  885   1HB   GLN 121          1HB       GLN 121  18.751   0.598  -0.328
  886   2HB   GLN 121          2HB       GLN 121  19.132  -0.706  -1.445
  887   1HG   GLN 121          1HG       GLN 121  17.447   1.038  -2.845
  888   2HG   GLN 121          2HG       GLN 121  18.598   2.057  -1.981
  889   2HE2  GLN 121          2HE2      GLN 121  18.110   0.844  -4.858
  890   1HE2  GLN 121          1HE2      GLN 121  19.722   0.487  -5.367
  891    H    ALA 122           H        ALA 122  16.722  -0.628   1.543
  892    HA   ALA 122           HA       ALA 122  17.787  -3.310   1.918
  893   1HB   ALA 122          1HB       ALA 122  18.538  -1.615   3.467
  894   2HB   ALA 122          2HB       ALA 122  17.556  -2.801   4.329
  895   3HB   ALA 122          3HB       ALA 122  16.873  -1.232   3.904
  896    H    TRP 123           H        TRP 123  14.764  -1.667   1.668
  897    HA   TRP 123           HA       TRP 123  13.130  -3.402   3.176
  898   1HB   TRP 123          1HB       TRP 123  12.680  -1.434   0.993
  899   2HB   TRP 123          2HB       TRP 123  11.403  -2.605   1.296
  900    HD1  TRP 123           HD1      TRP 123  11.783   0.736   2.021
  901    HE1  TRP 123           HE1      TRP 123  10.900   1.438   4.335
  902    HE3  TRP 123           HE3      TRP 123  11.595  -3.831   4.276
  903    HZ2  TRP 123           HZ2      TRP 123  10.226   0.184   6.761
  904    HZ3  TRP 123           HZ3      TRP 123  10.822  -4.002   6.586
  905    HH2  TRP 123           HH2      TRP 123  10.145  -2.012   7.816
  906    H    ILE 124           H        ILE 124  14.756  -3.858   0.206
  907    HA   ILE 124           HA       ILE 124  13.262  -6.363  -0.231
  908    HB   ILE 124           HB       ILE 124  13.897  -6.127  -2.662
  909   1HG1  ILE 124          1HG1      ILE 124  14.002  -3.216  -2.523
  910   2HG1  ILE 124          2HG1      ILE 124  15.379  -3.970  -1.725
  911   1HG2  ILE 124          1HG2      ILE 124  11.651  -5.540  -1.501
  912   2HG2  ILE 124          2HG2      ILE 124  12.102  -3.875  -1.867
  913   3HG2  ILE 124          3HG2      ILE 124  11.921  -5.046  -3.172
  914   1HD1  ILE 124          1HD1      ILE 124  15.481  -5.378  -3.932
  915   2HD1  ILE 124          2HD1      ILE 124  14.591  -4.004  -4.588
  916   3HD1  ILE 124          3HD1      ILE 124  16.175  -3.758  -3.851
  917    H    ARG 125           H        ARG 125  15.948  -5.368   1.043
  918    HA   ARG 125           HA       ARG 125  18.026  -6.624  -0.411
  919   1HB   ARG 125          1HB       ARG 125  18.225  -4.875   1.449
  920   2HB   ARG 125          2HB       ARG 125  18.020  -6.211   2.573
  921   1HG   ARG 125          1HG       ARG 125  20.226  -6.435   2.497
  922   2HG   ARG 125          2HG       ARG 125  20.001  -7.106   0.880
  923   1HD   ARG 125          1HD       ARG 125  20.370  -4.172   1.462
  924   2HD   ARG 125          2HD       ARG 125  21.681  -5.262   1.012
  925    HE   ARG 125           HE       ARG 125  19.641  -4.179  -0.721
  926   1HH1  ARG 125          1HH1      ARG 125  22.043  -6.664  -0.273
  927   2HH1  ARG 125          2HH1      ARG 125  22.208  -6.989  -1.966
  928   1HH2  ARG 125          1HH2      ARG 125  19.852  -4.599  -2.951
  929   2HH2  ARG 125          2HH2      ARG 125  20.964  -5.814  -3.489
  930    H    GLY 126           H        GLY 126  17.520  -8.714  -0.980
  931   1HA   GLY 126          1HA       GLY 126  17.243 -10.612   1.270
  932   2HA   GLY 126          2HA       GLY 126  18.203 -10.950  -0.162
  933    H    CYS 127           H        CYS 127  15.480  -9.286  -1.091
  934    HA   CYS 127           HA       CYS 127  13.525 -11.302  -1.069
  935   1HB   CYS 127          1HB       CYS 127  13.860  -8.705  -2.338
  936   2HB   CYS 127          2HB       CYS 127  12.693  -9.775  -3.088
  937    H    ARG 128           H        ARG 128  12.485 -11.711  -3.456
  938    HA   ARG 128           HA       ARG 128  14.625 -12.745  -5.181
  939   1HB   ARG 128          1HB       ARG 128  12.983 -14.747  -5.544
  940   2HB   ARG 128          2HB       ARG 128  14.063 -14.739  -4.157
  941   1HG   ARG 128          1HG       ARG 128  12.125 -13.709  -2.863
  942   2HG   ARG 128          2HG       ARG 128  11.118 -14.181  -4.233
  943   1HD   ARG 128          1HD       ARG 128  10.891 -16.123  -3.137
  944   2HD   ARG 128          2HD       ARG 128  12.504 -16.475  -3.754
  945    HE   ARG 128           HE       ARG 128  12.482 -15.067  -1.242
  946   1HH1  ARG 128          1HH1      ARG 128  12.428 -18.184  -2.797
  947   2HH1  ARG 128          2HH1      ARG 128  13.058 -19.025  -1.420
  948   1HH2  ARG 128          1HH2      ARG 128  13.312 -16.165   0.575
  949   2HH2  ARG 128          2HH2      ARG 128  13.560 -17.878   0.497
  950    H    LEU 129           H        LEU 129  14.181 -10.966  -6.553
  951    HA   LEU 129           HA       LEU 129  11.772 -11.355  -8.190
  952   1HB   LEU 129          1HB       LEU 129  11.765  -8.819  -8.472
  953   2HB   LEU 129          2HB       LEU 129  11.156  -9.468  -6.960
  954    HG   LEU 129           HG       LEU 129  13.903  -8.992  -6.552
  955   1HD1  LEU 129          1HD1      LEU 129  12.916  -7.275  -8.579
  956   2HD1  LEU 129          2HD1      LEU 129  13.127  -6.321  -7.111
  957   3HD1  LEU 129          3HD1      LEU 129  14.482  -7.238  -7.772
  958   1HD2  LEU 129          1HD2      LEU 129  12.093  -8.849  -4.896
  959   2HD2  LEU 129          2HD2      LEU 129  13.094  -7.396  -4.913
  960   3HD2  LEU 129          3HD2      LEU 129  11.505  -7.383  -5.681

  No H/Q in entry =         960
  Start of MODEL    9
    1    H1   LYS   1           H1       LYS   1  -7.011  -8.963   1.771
    2    H2   LYS   1           H2       LYS   1  -7.782  -9.801   0.522
    3    H3   LYS   1           H3       LYS   1  -7.711 -10.473   2.073
    4    HA   LYS   1           HA       LYS   1  -5.679 -11.294   1.791
    5   1HB   LYS   1          1HB       LYS   1  -7.044 -11.774  -0.330
    6   2HB   LYS   1          2HB       LYS   1  -6.043 -10.558  -1.111
    7   1HG   LYS   1          1HG       LYS   1  -4.263 -11.916  -1.234
    8   2HG   LYS   1          2HG       LYS   1  -4.560 -12.624   0.355
    9   1HD   LYS   1          1HD       LYS   1  -5.818 -14.309  -0.484
   10   2HD   LYS   1          2HD       LYS   1  -6.515 -13.298  -1.751
   11   1HE   LYS   1          1HE       LYS   1  -5.170 -14.904  -2.850
   12   2HE   LYS   1          2HE       LYS   1  -4.268 -13.390  -2.894
   13   1HZ   LYS   1          1HZ       LYS   1  -3.087 -14.226  -0.857
   14   2HZ   LYS   1          2HZ       LYS   1  -3.793 -15.734  -1.147
   15   3HZ   LYS   1          3HZ       LYS   1  -2.745 -15.058  -2.290
   16    H    VAL   2           H        VAL   2  -3.773 -10.510   2.386
   17    HA   VAL   2           HA       VAL   2  -2.846  -7.979   1.206
   18    HB   VAL   2           HB       VAL   2  -2.152  -9.284   3.840
   19   1HG1  VAL   2          1HG1      VAL   2  -0.368  -7.867   2.385
   20   2HG1  VAL   2          2HG1      VAL   2  -1.166  -6.569   3.272
   21   3HG1  VAL   2          3HG1      VAL   2  -0.399  -7.893   4.148
   22   1HG2  VAL   2          1HG2      VAL   2  -4.252  -7.627   3.162
   23   2HG2  VAL   2          2HG2      VAL   2  -3.635  -7.914   4.789
   24   3HG2  VAL   2          3HG2      VAL   2  -3.063  -6.528   3.860
   25    H    PHE   3           H        PHE   3  -0.909  -7.870   0.152
   26    HA   PHE   3           HA       PHE   3   0.368 -10.318  -0.624
   27   1HB   PHE   3          1HB       PHE   3   1.062  -7.417  -1.134
   28   2HB   PHE   3          2HB       PHE   3   1.959  -8.769  -1.806
   29    HD1  PHE   3           HD1      PHE   3  -0.637 -10.455  -2.284
   30    HD2  PHE   3           HD2      PHE   3   0.542  -6.484  -3.250
   31    HE1  PHE   3           HE1      PHE   3  -2.136 -10.484  -4.233
   32    HE2  PHE   3           HE2      PHE   3  -0.952  -6.505  -5.191
   33    HZ   PHE   3           HZ       PHE   3  -2.295  -8.507  -5.693
   34    H    GLY   4           H        GLY   4   2.868 -10.308  -0.569
   35   1HA   GLY   4          1HA       GLY   4   4.487 -10.915   1.048
   36   2HA   GLY   4          2HA       GLY   4   3.655  -9.901   2.222
   37    H    ARG   5           H        ARG   5   6.498  -9.917   1.535
   38    HA   ARG   5           HA       ARG   5   6.739  -7.072   0.958
   39   1HB   ARG   5          1HB       ARG   5   8.918  -8.999   1.771
   40   2HB   ARG   5          2HB       ARG   5   8.993  -7.243   1.799
   41   1HG   ARG   5          1HG       ARG   5   6.911  -7.565   3.415
   42   2HG   ARG   5          2HG       ARG   5   7.699  -9.122   3.685
   43   1HD   ARG   5          1HD       ARG   5   8.917  -6.388   4.044
   44   2HD   ARG   5          2HD       ARG   5   8.483  -7.526   5.318
   45    HE   ARG   5           HE       ARG   5  10.823  -7.611   3.622
   46   1HH1  ARG   5          1HH1      ARG   5   8.744  -9.362   5.802
   47   2HH1  ARG   5          2HH1      ARG   5   9.943 -10.545   6.201
   48   1HH2  ARG   5          1HH2      ARG   5  12.409  -9.165   4.141
   49   2HH2  ARG   5          2HH2      ARG   5  12.027 -10.434   5.257
   50    H    CYS   6           H        CYS   6   8.367 -10.060  -0.131
   51    HA   CYS   6           HA       CYS   6   9.323  -8.648  -2.464
   52   1HB   CYS   6          1HB       CYS   6   9.601 -11.601  -1.986
   53   2HB   CYS   6          2HB       CYS   6  10.607 -10.532  -2.961
   54    H    GLU   7           H        GLU   7   6.922 -11.132  -1.708
   55    HA   GLU   7           HA       GLU   7   6.259 -12.043  -4.211
   56   1HB   GLU   7          1HB       GLU   7   4.359 -11.270  -1.982
   57   2HB   GLU   7          2HB       GLU   7   3.912 -12.239  -3.381
   58   1HG   GLU   7          1HG       GLU   7   6.180 -13.457  -2.248
   59   2HG   GLU   7          2HG       GLU   7   5.094 -13.059  -0.917
   60    H    LEU   8           H        LEU   8   5.057  -9.131  -2.615
   61    HA   LEU   8           HA       LEU   8   3.612  -8.136  -4.826
   62   1HB   LEU   8          1HB       LEU   8   3.208  -7.401  -2.520
   63   2HB   LEU   8          2HB       LEU   8   4.799  -6.671  -2.465
   64    HG   LEU   8           HG       LEU   8   2.660  -5.210  -2.876
   65   1HD1  LEU   8          1HD1      LEU   8   5.104  -4.546  -2.884
   66   2HD1  LEU   8          2HD1      LEU   8   5.040  -4.718  -4.638
   67   3HD1  LEU   8          3HD1      LEU   8   4.006  -3.540  -3.828
   68   1HD2  LEU   8          1HD2      LEU   8   2.198  -6.743  -4.961
   69   2HD2  LEU   8          2HD2      LEU   8   1.849  -5.015  -5.007
   70   3HD2  LEU   8          3HD2      LEU   8   3.325  -5.637  -5.747
   71    H    ALA   9           H        ALA   9   6.946  -7.632  -3.676
   72    HA   ALA   9           HA       ALA   9   7.625  -5.574  -5.465
   73   1HB   ALA   9          1HB       ALA   9   9.429  -7.668  -4.276
   74   2HB   ALA   9          2HB       ALA   9   9.005  -6.118  -3.547
   75   3HB   ALA   9          3HB       ALA   9   9.949  -6.164  -5.036
   76    H    ALA  10           H        ALA  10   8.140  -9.097  -5.788
   77    HA   ALA  10           HA       ALA  10   9.351  -9.129  -8.260
   78   1HB   ALA  10          1HB       ALA  10   7.592 -11.315  -8.254
   79   2HB   ALA  10          2HB       ALA  10   9.283 -11.298  -7.756
   80   3HB   ALA  10          3HB       ALA  10   8.010 -11.027  -6.566
   81    H    ALA  11           H        ALA  11   5.942  -8.860  -7.403
   82    HA   ALA  11           HA       ALA  11   4.924  -9.021 -10.017
   83   1HB   ALA  11          1HB       ALA  11   3.859  -7.951  -7.450
   84   2HB   ALA  11          2HB       ALA  11   3.293  -9.323  -8.403
   85   3HB   ALA  11          3HB       ALA  11   2.977  -7.678  -8.953
   86    H    MET  12           H        MET  12   6.131  -6.461  -8.098
   87    HA   MET  12           HA       MET  12   5.392  -4.272  -9.727
   88   1HB   MET  12          1HB       MET  12   7.946  -4.332  -8.151
   89   2HB   MET  12          2HB       MET  12   6.911  -2.965  -8.481
   90   1HG   MET  12          1HG       MET  12   6.071  -5.268  -6.765
   91   2HG   MET  12          2HG       MET  12   6.858  -3.824  -6.136
   92   1HE   MET  12          1HE       MET  12   6.049  -1.472  -6.945
   93   2HE   MET  12          2HE       MET  12   5.198  -1.733  -8.466
   94   3HE   MET  12          3HE       MET  12   4.348  -1.028  -7.090
   95    H    LYS  13           H        LYS  13   8.398  -6.153  -9.563
   96    HA   LYS  13           HA       LYS  13   9.882  -4.861 -11.493
   97   1HB   LYS  13          1HB       LYS  13  10.471  -6.889  -9.968
   98   2HB   LYS  13          2HB       LYS  13   9.894  -7.859 -11.317
   99   1HG   LYS  13          1HG       LYS  13  11.562  -6.246 -12.640
  100   2HG   LYS  13          2HG       LYS  13  12.343  -6.231 -11.057
  101   1HD   LYS  13          1HD       LYS  13  11.627  -8.909 -11.620
  102   2HD   LYS  13          2HD       LYS  13  12.400  -8.257 -13.066
  103   1HE   LYS  13          1HE       LYS  13  13.549  -8.088 -10.284
  104   2HE   LYS  13          2HE       LYS  13  13.986  -9.315 -11.472
  105   1HZ   LYS  13          1HZ       LYS  13  14.294  -6.398 -11.921
  106   2HZ   LYS  13          2HZ       LYS  13  15.536  -7.403 -11.367
  107   3HZ   LYS  13          3HZ       LYS  13  14.872  -7.649 -12.903
  108    H    ARG  14           H        ARG  14   7.634  -7.575 -11.938
  109    HA   ARG  14           HA       ARG  14   7.871  -7.716 -14.735
  110   1HB   ARG  14          1HB       ARG  14   6.197  -8.888 -12.671
  111   2HB   ARG  14          2HB       ARG  14   5.269  -8.528 -14.121
  112   1HG   ARG  14          1HG       ARG  14   7.616  -9.718 -15.040
  113   2HG   ARG  14          2HG       ARG  14   7.141 -10.654 -13.621
  114   1HD   ARG  14          1HD       ARG  14   4.932  -9.971 -15.423
  115   2HD   ARG  14          2HD       ARG  14   6.161 -11.013 -16.142
  116    HE   ARG  14           HE       ARG  14   5.549 -12.069 -13.647
  117   1HH1  ARG  14          1HH1      ARG  14   3.933 -11.473 -16.677
  118   2HH1  ARG  14          2HH1      ARG  14   2.832 -12.797 -16.497
  119   1HH2  ARG  14          1HH2      ARG  14   4.103 -13.815 -13.403
  120   2HH2  ARG  14          2HH2      ARG  14   2.928 -14.127 -14.637
  121    H    HIS  15           H        HIS  15   5.805  -5.810 -12.599
  122    HA   HIS  15           HA       HIS  15   4.178  -4.787 -14.696
  123   1HB   HIS  15          1HB       HIS  15   4.482  -4.321 -11.776
  124   2HB   HIS  15          2HB       HIS  15   3.709  -3.053 -12.722
  125    HD1  HIS  15           HD1      HIS  15   2.386  -5.062 -10.552
  126    HD2  HIS  15           HD2      HIS  15   1.998  -5.182 -14.688
  127    HE1  HIS  15           HE1      HIS  15   0.238  -6.293 -10.989
  128    HE2  HIS  15           HE2      HIS  15   0.070  -6.431 -13.499
  129    H    GLY  16           H        GLY  16   7.388  -4.134 -13.983
  130   1HA   GLY  16          1HA       GLY  16   7.367  -1.888 -15.700
  131   2HA   GLY  16          2HA       GLY  16   8.758  -2.584 -14.898
  132    H    LEU  17           H        LEU  17   7.371  -2.088 -12.155
  133    HA   LEU  17           HA       LEU  17   7.402   0.813 -12.183
  134   1HB   LEU  17          1HB       LEU  17   7.110  -0.850  -9.713
  135   2HB   LEU  17          2HB       LEU  17   6.532   0.776 -10.007
  136    HG   LEU  17           HG       LEU  17   5.292  -1.820 -10.642
  137   1HD1  LEU  17          1HD1      LEU  17   4.695   0.337  -9.069
  138   2HD1  LEU  17          2HD1      LEU  17   3.670   0.607 -10.479
  139   3HD1  LEU  17          3HD1      LEU  17   3.548  -0.903  -9.576
  140   1HD2  LEU  17          1HD2      LEU  17   5.485   0.362 -12.630
  141   2HD2  LEU  17          2HD2      LEU  17   5.214  -1.365 -12.863
  142   3HD2  LEU  17          3HD2      LEU  17   3.882  -0.321 -12.369
  143    H    ASP  18           H        ASP  18   9.636  -1.521 -11.989
  144    HA   ASP  18           HA       ASP  18  11.317  -0.475  -9.933
  145   1HB   ASP  18          1HB       ASP  18  11.865  -2.665 -10.295
  146   2HB   ASP  18          2HB       ASP  18  11.583  -2.571 -12.022
  147    H    ASN  19           H        ASN  19  11.728   1.615 -10.194
  148    HA   ASN  19           HA       ASN  19  12.740   3.515 -10.885
  149   1HB   ASN  19          1HB       ASN  19  14.638   1.693 -11.199
  150   2HB   ASN  19          2HB       ASN  19  14.389   2.049 -12.905
  151   2HD2  ASN  19          2HD2      ASN  19  16.728   2.540 -11.299
  152   1HD2  ASN  19          1HD2      ASN  19  17.014   4.243 -11.347
  153    H    TYR  20           H        TYR  20  10.366   2.678 -12.132
  154    HA   TYR  20           HA       TYR  20  10.471   3.168 -14.940
  155   1HB   TYR  20          1HB       TYR  20   8.557   2.041 -13.754
  156   2HB   TYR  20          2HB       TYR  20   8.127   3.602 -13.064
  157    HD1  TYR  20           HD1      TYR  20   8.739   2.005 -16.388
  158    HD2  TYR  20           HD2      TYR  20   6.548   4.890 -14.157
  159    HE1  TYR  20           HE1      TYR  20   7.375   2.497 -18.374
  160    HE2  TYR  20           HE2      TYR  20   5.178   5.390 -16.136
  161    HH   TYR  20           HH       TYR  20   5.150   3.429 -18.896
  162    H    ARG  21           H        ARG  21   9.272   5.200 -15.844
  163    HA   ARG  21           HA       ARG  21  10.604   7.428 -15.729
  164   1HB   ARG  21          1HB       ARG  21   7.787   6.892 -16.121
  165   2HB   ARG  21          2HB       ARG  21   8.028   8.486 -15.420
  166   1HG   ARG  21          1HG       ARG  21   9.793   7.815 -17.676
  167   2HG   ARG  21          2HG       ARG  21   8.078   7.973 -18.061
  168   1HD   ARG  21          1HD       ARG  21   9.302  10.064 -16.348
  169   2HD   ARG  21          2HD       ARG  21   9.743  10.051 -18.054
  170    HE   ARG  21           HE       ARG  21   7.085  10.553 -16.943
  171   1HH1  ARG  21          1HH1      ARG  21   9.169  10.266 -19.720
  172   2HH1  ARG  21          2HH1      ARG  21   8.060  11.052 -20.795
  173   1HH2  ARG  21          1HH2      ARG  21   5.619  11.587 -18.349
  174   2HH2  ARG  21          2HH2      ARG  21   6.043  11.803 -20.015
  175    H    GLY  22           H        GLY  22   8.408   6.431 -13.189
  176   1HA   GLY  22          1HA       GLY  22   7.974   7.305 -11.097
  177   2HA   GLY  22          2HA       GLY  22   8.868   8.748 -11.551
  178    H    TYR  23           H        TYR  23   8.940   5.794  -9.830
  179    HA   TYR  23           HA       TYR  23  11.811   6.173  -9.324
  180   1HB   TYR  23          1HB       TYR  23   9.572   5.969  -7.351
  181   2HB   TYR  23          2HB       TYR  23  11.199   5.473  -6.896
  182    HD1  TYR  23           HD1      TYR  23   9.442   8.356  -8.500
  183    HD2  TYR  23           HD2      TYR  23  12.588   7.060  -5.946
  184    HE1  TYR  23           HE1      TYR  23  10.008  10.698  -8.022
  185    HE2  TYR  23           HE2      TYR  23  13.163   9.401  -5.459
  186    HH   TYR  23           HH       TYR  23  11.878  12.022  -7.245
  187    H    SER  24           H        SER  24  12.591   4.374  -7.733
  188    HA   SER  24           HA       SER  24  12.386   1.933  -9.237
  189   1HB   SER  24          1HB       SER  24  14.276   1.187  -7.951
  190   2HB   SER  24          2HB       SER  24  14.558   2.862  -8.424
  191    HG   SER  24           HG       SER  24  14.926   2.171  -6.118
  192    H    LEU  25           H        LEU  25  12.317  -0.145  -8.123
  193    HA   LEU  25           HA       LEU  25   9.952  -0.792  -7.037
  194   1HB   LEU  25          1HB       LEU  25  12.608  -1.983  -7.121
  195   2HB   LEU  25          2HB       LEU  25  11.658  -2.545  -5.758
  196    HG   LEU  25           HG       LEU  25  10.371  -2.537  -8.429
  197   1HD1  LEU  25          1HD1      LEU  25  12.785  -3.503  -8.533
  198   2HD1  LEU  25          2HD1      LEU  25  12.080  -4.862  -7.658
  199   3HD1  LEU  25          3HD1      LEU  25  11.447  -4.408  -9.241
  200   1HD2  LEU  25          1HD2      LEU  25  10.275  -4.211  -5.936
  201   2HD2  LEU  25          2HD2      LEU  25   8.995  -3.236  -6.656
  202   3HD2  LEU  25          3HD2      LEU  25   9.515  -4.725  -7.443
  203    H    GLY  26           H        GLY  26  12.870  -0.241  -5.038
  204   1HA   GLY  26          1HA       GLY  26  13.065   0.679  -2.933
  205   2HA   GLY  26          2HA       GLY  26  11.922  -0.591  -2.539
  206    H    ASN  27           H        ASN  27  11.296   2.281  -4.506
  207    HA   ASN  27           HA       ASN  27  10.027   3.727  -2.401
  208   1HB   ASN  27          1HB       ASN  27   9.735   4.134  -5.380
  209   2HB   ASN  27          2HB       ASN  27   9.348   5.301  -4.118
  210   2HD2  ASN  27          2HD2      ASN  27  11.899   3.677  -5.838
  211   1HD2  ASN  27          1HD2      ASN  27  13.173   4.733  -5.345
  212    H    TRP  28           H        TRP  28   8.897   1.568  -4.920
  213    HA   TRP  28           HA       TRP  28   6.119   2.048  -4.567
  214   1HB   TRP  28          1HB       TRP  28   7.588  -0.304  -5.751
  215   2HB   TRP  28          2HB       TRP  28   5.843  -0.055  -5.848
  216    HD1  TRP  28           HD1      TRP  28   9.075   0.985  -7.431
  217    HE1  TRP  28           HE1      TRP  28   8.616   2.652  -9.327
  218    HE3  TRP  28           HE3      TRP  28   4.125   1.843  -6.552
  219    HZ2  TRP  28           HZ2      TRP  28   6.428   4.129 -10.344
  220    HZ3  TRP  28           HZ3      TRP  28   2.899   3.382  -8.023
  221    HH2  TRP  28           HH2      TRP  28   4.033   4.508  -9.889
  222    H    VAL  29           H        VAL  29   8.320  -0.465  -3.333
  223    HA   VAL  29           HA       VAL  29   6.347  -1.885  -1.916
  224    HB   VAL  29           HB       VAL  29   9.315  -1.712  -1.378
  225   1HG1  VAL  29          1HG1      VAL  29   7.887  -2.638   0.471
  226   2HG1  VAL  29          2HG1      VAL  29   7.437  -3.941  -0.630
  227   3HG1  VAL  29          3HG1      VAL  29   9.121  -3.733  -0.152
  228   1HG2  VAL  29          1HG2      VAL  29   7.918  -2.781  -3.591
  229   2HG2  VAL  29          2HG2      VAL  29   8.531  -4.139  -2.647
  230   3HG2  VAL  29          3HG2      VAL  29   9.640  -2.894  -3.226
  231    H    CYS  30           H        CYS  30   8.696   0.552  -0.913
  232    HA   CYS  30           HA       CYS  30   8.065   0.663   1.787
  233   1HB   CYS  30          1HB       CYS  30   9.932   1.816   0.359
  234   2HB   CYS  30          2HB       CYS  30   8.776   3.139   0.259
  235    H    ALA  31           H        ALA  31   6.759   2.616  -0.890
  236    HA   ALA  31           HA       ALA  31   4.981   4.136   0.675
  237   1HB   ALA  31          1HB       ALA  31   5.225   3.560  -2.243
  238   2HB   ALA  31          2HB       ALA  31   3.814   4.421  -1.628
  239   3HB   ALA  31          3HB       ALA  31   5.430   5.081  -1.377
  240    H    ALA  32           H        ALA  32   4.458   1.188  -1.243
  241    HA   ALA  32           HA       ALA  32   1.681   1.019  -0.722
  242   1HB   ALA  32          1HB       ALA  32   3.268  -0.187  -2.486
  243   2HB   ALA  32          2HB       ALA  32   3.192  -1.466  -1.274
  244   3HB   ALA  32          3HB       ALA  32   1.708  -0.852  -2.003
  245    H    LYS  33           H        LYS  33   4.442  -0.742   0.682
  246    HA   LYS  33           HA       LYS  33   3.197  -2.408   2.424
  247   1HB   LYS  33          1HB       LYS  33   5.616  -2.370   2.117
  248   2HB   LYS  33          2HB       LYS  33   5.711  -0.813   2.927
  249   1HG   LYS  33          1HG       LYS  33   4.573  -2.125   4.894
  250   2HG   LYS  33          2HG       LYS  33   5.266  -3.522   4.068
  251   1HD   LYS  33          1HD       LYS  33   7.463  -2.712   4.321
  252   2HD   LYS  33          2HD       LYS  33   6.903  -1.093   4.744
  253   1HE   LYS  33          1HE       LYS  33   7.512  -1.950   6.802
  254   2HE   LYS  33          2HE       LYS  33   5.781  -2.284   6.756
  255   1HZ   LYS  33          1HZ       LYS  33   6.867  -4.491   5.623
  256   2HZ   LYS  33          2HZ       LYS  33   7.996  -4.112   6.825
  257   3HZ   LYS  33          3HZ       LYS  33   6.375  -4.364   7.235
  258    H    PHE  34           H        PHE  34   4.266   0.894   3.242
  259    HA   PHE  34           HA       PHE  34   2.892   0.808   5.727
  260   1HB   PHE  34          1HB       PHE  34   4.536   2.743   4.318
  261   2HB   PHE  34          2HB       PHE  34   3.423   3.411   5.492
  262    HD1  PHE  34           HD1      PHE  34   3.436   1.996   7.791
  263    HD2  PHE  34           HD2      PHE  34   6.662   2.305   5.032
  264    HE1  PHE  34           HE1      PHE  34   5.021   1.433   9.586
  265    HE2  PHE  34           HE2      PHE  34   8.252   1.742   6.823
  266    HZ   PHE  34           HZ       PHE  34   7.432   1.305   9.104
  267    H    GLU  35           H        GLU  35   1.924   1.622   2.558
  268    HA   GLU  35           HA       GLU  35  -0.076   3.507   3.147
  269   1HB   GLU  35          1HB       GLU  35   0.953   2.116   0.885
  270   2HB   GLU  35          2HB       GLU  35  -0.795   1.930   0.886
  271   1HG   GLU  35          1HG       GLU  35  -1.162   4.224   0.720
  272   2HG   GLU  35          2HG       GLU  35   0.476   4.616   1.243
  273    H    SER  36           H        SER  36  -0.336   0.043   2.413
  274    HA   SER  36           HA       SER  36  -2.851  -0.032   3.956
  275   1HB   SER  36          1HB       SER  36  -3.578  -1.757   2.174
  276   2HB   SER  36          2HB       SER  36  -3.578  -0.059   1.704
  277    HG   SER  36           HG       SER  36  -1.214  -1.445   1.300
  278    H    ASN  37           H        ASN  37   0.125  -1.020   4.232
  279    HA   ASN  37           HA       ASN  37   1.190  -2.809   5.179
  280   1HB   ASN  37          1HB       ASN  37  -1.620  -3.096   6.155
  281   2HB   ASN  37          2HB       ASN  37  -0.521  -4.452   6.396
  282   2HD2  ASN  37          2HD2      ASN  37   1.671  -3.757   7.295
  283   1HD2  ASN  37          1HD2      ASN  37   1.624  -2.635   8.608
  284    H    PHE  38           H        PHE  38   0.192  -2.841   2.479
  285    HA   PHE  38           HA       PHE  38   0.282  -4.114   0.666
  286   1HB   PHE  38          1HB       PHE  38   1.120  -6.179   2.679
  287   2HB   PHE  38          2HB       PHE  38   0.897  -6.587   0.980
  288    HD1  PHE  38           HD1      PHE  38   1.939  -4.391  -0.484
  289    HD2  PHE  38           HD2      PHE  38   3.374  -6.062   3.154
  290    HE1  PHE  38           HE1      PHE  38   4.185  -3.535  -0.991
  291    HE2  PHE  38           HE2      PHE  38   5.626  -5.207   2.657
  292    HZ   PHE  38           HZ       PHE  38   6.038  -3.950   0.581
  293    H    ASN  39           H        ASN  39  -2.162  -3.748   2.343
  294    HA   ASN  39           HA       ASN  39  -3.721  -6.124   1.796
  295   1HB   ASN  39          1HB       ASN  39  -4.000  -4.452   3.778
  296   2HB   ASN  39          2HB       ASN  39  -4.903  -3.490   2.616
  297   2HD2  ASN  39          2HD2      ASN  39  -6.290  -5.289   1.204
  298   1HD2  ASN  39          1HD2      ASN  39  -7.369  -6.176   2.220
  299    H    THR  40           H        THR  40  -4.224  -6.508  -0.241
  300    HA   THR  40           HA       THR  40  -4.410  -4.474  -2.232
  301    HB   THR  40           HB       THR  40  -4.538  -6.180  -3.761
  302    HG1  THR  40           HG1      THR  40  -5.826  -7.959  -3.521
  303   1HG2  THR  40          1HG2      THR  40  -3.505  -7.487  -1.254
  304   2HG2  THR  40          2HG2      THR  40  -3.405  -8.240  -2.845
  305   3HG2  THR  40          3HG2      THR  40  -2.574  -6.715  -2.538
  306    H    GLN  41           H        GLN  41  -6.573  -6.103  -0.131
  307    HA   GLN  41           HA       GLN  41  -8.948  -5.169  -1.528
  308   1HB   GLN  41          1HB       GLN  41  -8.313  -7.155   0.576
  309   2HB   GLN  41          2HB       GLN  41  -9.884  -6.395   0.667
  310   1HG   GLN  41          1HG       GLN  41  -9.307  -7.257  -2.021
  311   2HG   GLN  41          2HG       GLN  41  -9.161  -8.588  -0.872
  312   2HE2  GLN  41          2HE2      GLN  41 -11.250  -6.892  -2.800
  313   1HE2  GLN  41          1HE2      GLN  41 -12.745  -7.368  -2.078
  314    H    ALA  42           H        ALA  42  -6.818  -3.718   0.356
  315    HA   ALA  42           HA       ALA  42  -8.284  -2.669   2.517
  316   1HB   ALA  42          1HB       ALA  42  -5.742  -1.966   1.152
  317   2HB   ALA  42          2HB       ALA  42  -6.045  -2.397   2.836
  318   3HB   ALA  42          3HB       ALA  42  -6.462  -0.788   2.250
  319    H    THR  43           H        THR  43  -9.784  -1.186   2.635
  320    HA   THR  43           HA       THR  43  -9.999   0.891   0.566
  321    HB   THR  43           HB       THR  43 -12.372   0.667   0.399
  322    HG1  THR  43           HG1      THR  43 -13.558  -0.675   1.716
  323   1HG2  THR  43          1HG2      THR  43 -10.981  -0.956  -0.914
  324   2HG2  THR  43          2HG2      THR  43 -11.308  -2.156   0.337
  325   3HG2  THR  43          3HG2      THR  43 -12.635  -1.488  -0.612
  326    H    ASN  44           H        ASN  44  -9.985   2.864   1.572
  327    HA   ASN  44           HA       ASN  44 -11.187   3.058   4.243
  328   1HB   ASN  44          1HB       ASN  44  -8.371   3.295   3.608
  329   2HB   ASN  44          2HB       ASN  44  -8.987   4.778   4.330
  330   2HD2  ASN  44          2HD2      ASN  44  -9.796   4.735   6.427
  331   1HD2  ASN  44          1HD2      ASN  44  -9.459   3.433   7.511
  332    H    ARG  45           H        ARG  45 -12.671   4.579   4.225
  333    HA   ARG  45           HA       ARG  45 -12.759   6.583   2.159
  334   1HB   ARG  45          1HB       ARG  45 -14.764   5.388   3.199
  335   2HB   ARG  45          2HB       ARG  45 -14.540   6.446   4.587
  336   1HG   ARG  45          1HG       ARG  45 -14.557   8.248   2.563
  337   2HG   ARG  45          2HG       ARG  45 -15.656   7.016   1.937
  338   1HD   ARG  45          1HD       ARG  45 -16.982   8.570   3.146
  339   2HD   ARG  45          2HD       ARG  45 -16.859   7.119   4.141
  340    HE   ARG  45           HE       ARG  45 -14.898   8.523   5.181
  341   1HH1  ARG  45          1HH1      ARG  45 -18.054   9.612   4.187
  342   2HH1  ARG  45          2HH1      ARG  45 -18.123  10.889   5.356
  343   1HH2  ARG  45          1HH2      ARG  45 -14.979  10.201   6.722
  344   2HH2  ARG  45          2HH2      ARG  45 -16.374  11.224   6.796
  345    H    ASN  46           H        ASN  46 -12.559   8.794   2.391
  346    HA   ASN  46           HA       ASN  46 -11.161   9.670   4.829
  347   1HB   ASN  46          1HB       ASN  46 -11.105  11.125   2.197
  348   2HB   ASN  46          2HB       ASN  46  -9.975  11.248   3.541
  349   2HD2  ASN  46          2HD2      ASN  46  -9.102   8.901   4.109
  350   1HD2  ASN  46          1HD2      ASN  46  -8.429   8.073   2.752
  351    H    THR  47           H        THR  47 -11.361  12.202   5.005
  352    HA   THR  47           HA       THR  47 -14.166  12.705   5.492
  353    HB   THR  47           HB       THR  47 -13.407  14.794   6.550
  354    HG1  THR  47           HG1      THR  47 -11.327  15.434   6.434
  355   1HG2  THR  47          1HG2      THR  47 -12.383  12.131   7.292
  356   2HG2  THR  47          2HG2      THR  47 -11.603  13.496   8.092
  357   3HG2  THR  47          3HG2      THR  47 -13.348  13.275   8.224
  358    H    ASP  48           H        ASP  48 -11.735  13.668   3.193
  359    HA   ASP  48           HA       ASP  48 -13.058  15.979   2.206
  360   1HB   ASP  48          1HB       ASP  48 -11.548  15.636   0.206
  361   2HB   ASP  48          2HB       ASP  48 -10.730  15.786   1.758
  362    H    GLY  49           H        GLY  49 -13.756  12.694   1.938
  363   1HA   GLY  49          1HA       GLY  49 -15.560  13.256  -0.332
  364   2HA   GLY  49          2HA       GLY  49 -15.920  12.129   0.967
  365    H    SER  50           H        SER  50 -12.752  12.250  -0.494
  366    HA   SER  50           HA       SER  50 -13.260  10.191  -2.413
  367   1HB   SER  50          1HB       SER  50 -10.589  10.129  -2.248
  368   2HB   SER  50          2HB       SER  50 -11.450  11.395  -3.123
  369    HG   SER  50           HG       SER  50  -9.747  11.871  -1.350
  370    H    THR  51           H        THR  51 -11.323   8.369  -2.249
  371    HA   THR  51           HA       THR  51 -11.118   7.187   0.365
  372    HB   THR  51           HB       THR  51 -12.768   5.741  -1.715
  373    HG1  THR  51           HG1      THR  51 -14.003   6.263   0.650
  374   1HG2  THR  51          1HG2      THR  51 -11.302   4.789   0.505
  375   2HG2  THR  51          2HG2      THR  51 -13.011   4.700   0.934
  376   3HG2  THR  51          3HG2      THR  51 -12.423   3.895  -0.522
  377    H    ASP  52           H        ASP  52  -9.764   5.251   0.357
  378    HA   ASP  52           HA       ASP  52  -8.082   5.087  -2.053
  379   1HB   ASP  52          1HB       ASP  52  -7.432   4.469   0.838
  380   2HB   ASP  52          2HB       ASP  52  -6.331   4.217  -0.514
  381    H    TYR  53           H        TYR  53  -8.959   3.490  -3.233
  382    HA   TYR  53           HA       TYR  53  -9.630   0.995  -1.865
  383   1HB   TYR  53          1HB       TYR  53 -10.306   1.895  -4.667
  384   2HB   TYR  53          2HB       TYR  53 -10.788   0.369  -3.937
  385    HD1  TYR  53           HD1      TYR  53 -12.229   0.496  -1.804
  386    HD2  TYR  53           HD2      TYR  53 -11.679   3.767  -4.466
  387    HE1  TYR  53           HE1      TYR  53 -14.280   1.538  -0.936
  388    HE2  TYR  53           HE2      TYR  53 -13.727   4.820  -3.604
  389    HH   TYR  53           HH       TYR  53 -15.778   3.183  -1.233
  390    H    GLY  54           H        GLY  54  -7.360   0.491  -1.622
  391   1HA   GLY  54          1HA       GLY  54  -5.886  -0.141  -4.049
  392   2HA   GLY  54          2HA       GLY  54  -6.488  -1.552  -3.208
  393    H    ILE  55           H        ILE  55  -4.153  -1.971  -3.387
  394    HA   ILE  55           HA       ILE  55  -2.903  -1.648  -0.836
  395    HB   ILE  55           HB       ILE  55  -2.578  -3.651  -2.357
  396   1HG1  ILE  55          1HG1      ILE  55  -0.020  -2.221  -1.597
  397   2HG1  ILE  55          2HG1      ILE  55  -1.041  -3.107  -0.468
  398   1HG2  ILE  55          1HG2      ILE  55  -2.351  -2.372  -4.448
  399   2HG2  ILE  55          2HG2      ILE  55  -0.792  -1.763  -3.891
  400   3HG2  ILE  55          3HG2      ILE  55  -1.008  -3.487  -4.194
  401   1HD1  ILE  55          1HD1      ILE  55  -0.679  -5.059  -2.182
  402   2HD1  ILE  55          2HD1      ILE  55   0.752  -4.121  -2.606
  403   3HD1  ILE  55          3HD1      ILE  55   0.527  -4.687  -0.951
  404    H    LEU  56           H        LEU  56  -3.007   0.066  -3.784
  405    HA   LEU  56           HA       LEU  56  -0.764   1.784  -2.969
  406   1HB   LEU  56          1HB       LEU  56  -1.329   0.587  -5.479
  407   2HB   LEU  56          2HB       LEU  56  -1.635   2.302  -5.661
  408    HG   LEU  56           HG       LEU  56   0.601   2.110  -6.300
  409   1HD1  LEU  56          1HD1      LEU  56   0.060   3.595  -4.136
  410   2HD1  LEU  56          2HD1      LEU  56   1.293   2.532  -3.460
  411   3HD1  LEU  56          3HD1      LEU  56   1.655   3.513  -4.882
  412   1HD2  LEU  56          1HD2      LEU  56   0.761   0.029  -4.151
  413   2HD2  LEU  56          2HD2      LEU  56   1.163  -0.096  -5.864
  414   3HD2  LEU  56          3HD2      LEU  56   2.222   0.796  -4.773
  415    H    GLN  57           H        GLN  57  -3.948   1.526  -2.681
  416    HA   GLN  57           HA       GLN  57  -5.604   2.945  -2.127
  417   1HB   GLN  57          1HB       GLN  57  -3.522   5.114  -2.405
  418   2HB   GLN  57          2HB       GLN  57  -5.086   5.275  -1.616
  419   1HG   GLN  57          1HG       GLN  57  -4.344   3.463  -0.034
  420   2HG   GLN  57          2HG       GLN  57  -2.733   3.631  -0.733
  421   2HE2  GLN  57          2HE2      GLN  57  -2.114   6.089  -0.903
  422   1HE2  GLN  57          1HE2      GLN  57  -2.312   6.971   0.570
  423    H    ILE  58           H        ILE  58  -6.446   2.276  -4.343
  424    HA   ILE  58           HA       ILE  58  -6.152   4.256  -6.420
  425    HB   ILE  58           HB       ILE  58  -8.177   2.029  -6.406
  426   1HG1  ILE  58          1HG1      ILE  58  -6.151   0.897  -5.860
  427   2HG1  ILE  58          2HG1      ILE  58  -6.389   0.677  -7.589
  428   1HG2  ILE  58          1HG2      ILE  58  -7.765   4.018  -8.186
  429   2HG2  ILE  58          2HG2      ILE  58  -6.702   2.771  -8.839
  430   3HG2  ILE  58          3HG2      ILE  58  -8.417   2.435  -8.606
  431   1HD1  ILE  58          1HD1      ILE  58  -4.857   2.992  -7.354
  432   2HD1  ILE  58          2HD1      ILE  58  -4.187   1.863  -6.178
  433   3HD1  ILE  58          3HD1      ILE  58  -4.317   1.396  -7.874
  434    H    ASN  59           H        ASN  59  -7.076   6.174  -5.909
  435    HA   ASN  59           HA       ASN  59  -9.480   6.391  -4.420
  436   1HB   ASN  59          1HB       ASN  59  -7.753   8.155  -4.468
  437   2HB   ASN  59          2HB       ASN  59  -8.100   8.439  -6.172
  438   2HD2  ASN  59          2HD2      ASN  59 -10.763   7.631  -4.174
  439   1HD2  ASN  59          1HD2      ASN  59 -11.427   9.218  -4.034
  440    H    SER  60           H        SER  60 -11.172   5.328  -5.360
  441    HA   SER  60           HA       SER  60 -11.754   5.357  -8.120
  442   1HB   SER  60          1HB       SER  60 -13.601   4.086  -7.588
  443   2HB   SER  60          2HB       SER  60 -12.625   3.830  -6.143
  444    HG   SER  60           HG       SER  60 -14.597   4.405  -5.397
  445    H    ARG  61           H        ARG  61 -12.077   7.813  -5.811
  446    HA   ARG  61           HA       ARG  61 -14.293   9.095  -7.236
  447   1HB   ARG  61          1HB       ARG  61 -14.023   8.931  -4.634
  448   2HB   ARG  61          2HB       ARG  61 -12.929  10.290  -4.849
  449   1HG   ARG  61          1HG       ARG  61 -14.632  11.682  -5.651
  450   2HG   ARG  61          2HG       ARG  61 -15.720  10.323  -5.945
  451   1HD   ARG  61          1HD       ARG  61 -16.604  10.642  -3.935
  452   2HD   ARG  61          2HD       ARG  61 -15.048  10.229  -3.217
  453    HE   ARG  61           HE       ARG  61 -14.555  12.522  -3.018
  454   1HH1  ARG  61          1HH1      ARG  61 -17.719  11.935  -4.356
  455   2HH1  ARG  61          2HH1      ARG  61 -18.286  13.543  -4.053
  456   1HH2  ARG  61          1HH2      ARG  61 -15.294  14.641  -2.615
  457   2HH2  ARG  61          2HH2      ARG  61 -16.907  15.081  -3.064
  458    H    TRP  62           H        TRP  62 -11.456   8.761  -8.167
  459    HA   TRP  62           HA       TRP  62 -11.182  11.384  -9.297
  460   1HB   TRP  62          1HB       TRP  62  -9.918  11.064  -6.886
  461   2HB   TRP  62          2HB       TRP  62  -8.633  10.695  -8.030
  462    HD1  TRP  62           HD1      TRP  62  -8.137  12.691  -9.912
  463    HE1  TRP  62           HE1      TRP  62  -8.232  15.245  -9.610
  464    HE3  TRP  62           HE3      TRP  62 -11.019  12.905  -5.694
  465    HZ2  TRP  62           HZ2      TRP  62  -9.378  17.105  -7.822
  466    HZ3  TRP  62           HZ3      TRP  62 -11.569  15.110  -4.752
  467    HH2  TRP  62           HH2      TRP  62 -10.763  17.166  -5.794
  468    H    TRP  63           H        TRP  63 -10.466   8.048  -9.290
  469    HA   TRP  63           HA       TRP  63  -8.915   8.405 -11.759
  470   1HB   TRP  63          1HB       TRP  63  -8.407   6.437  -9.521
  471   2HB   TRP  63          2HB       TRP  63  -7.666   6.310 -11.115
  472    HD1  TRP  63           HD1      TRP  63  -6.601   7.329  -7.903
  473    HE1  TRP  63           HE1      TRP  63  -4.840   9.212  -7.984
  474    HE3  TRP  63           HE3      TRP  63  -7.337   8.895 -12.683
  475    HZ2  TRP  63           HZ2      TRP  63  -3.902  11.129  -9.857
  476    HZ3  TRP  63           HZ3      TRP  63  -6.022  10.752 -13.557
  477    HH2  TRP  63           HH2      TRP  63  -4.314  11.853 -12.175
  478    H    CYS  64           H        CYS  64 -10.165   5.590 -10.031
  479    HA   CYS  64           HA       CYS  64 -11.245   4.607 -12.546
  480   1HB   CYS  64          1HB       CYS  64 -11.309   2.472 -11.591
  481   2HB   CYS  64          2HB       CYS  64  -9.904   3.205 -10.828
  482    H    ASN  65           H        ASN  65 -13.323   3.789 -12.817
  483    HA   ASN  65           HA       ASN  65 -15.339   5.365 -11.403
  484   1HB   ASN  65          1HB       ASN  65 -15.324   5.382 -13.876
  485   2HB   ASN  65          2HB       ASN  65 -15.613   3.645 -13.877
  486   2HD2  ASN  65          2HD2      ASN  65 -16.973   6.472 -12.210
  487   1HD2  ASN  65          1HD2      ASN  65 -18.623   6.087 -12.547
  488    H    ASP  66           H        ASP  66 -16.031   4.433  -9.588
  489    HA   ASP  66           HA       ASP  66 -16.412   1.534  -9.502
  490   1HB   ASP  66          1HB       ASP  66 -16.577   1.776  -7.098
  491   2HB   ASP  66          2HB       ASP  66 -15.153   2.639  -7.669
  492    H    GLY  67           H        GLY  67 -18.184   4.272 -10.177
  493   1HA   GLY  67          1HA       GLY  67 -20.651   2.827 -10.203
  494   2HA   GLY  67          2HA       GLY  67 -20.432   4.519 -10.621
  495    H    ARG  68           H        ARG  68 -19.122   3.952  -7.602
  496    HA   ARG  68           HA       ARG  68 -21.616   4.311  -6.142
  497   1HB   ARG  68          1HB       ARG  68 -18.780   4.071  -5.118
  498   2HB   ARG  68          2HB       ARG  68 -20.236   4.065  -4.131
  499   1HG   ARG  68          1HG       ARG  68 -20.352   2.055  -6.205
  500   2HG   ARG  68          2HG       ARG  68 -18.928   1.863  -5.181
  501   1HD   ARG  68          1HD       ARG  68 -20.247   1.703  -3.220
  502   2HD   ARG  68          2HD       ARG  68 -21.694   2.251  -4.066
  503    HE   ARG  68           HE       ARG  68 -21.036  -0.021  -5.377
  504   1HH1  ARG  68          1HH1      ARG  68 -21.505   0.743  -2.010
  505   2HH1  ARG  68          2HH1      ARG  68 -22.061  -0.844  -1.595
  506   1HH2  ARG  68          1HH2      ARG  68 -21.767  -2.113  -4.840
  507   2HH2  ARG  68          2HH2      ARG  68 -22.210  -2.468  -3.203
  508    H    THR  69           H        THR  69 -19.898   6.332  -7.866
  509    HA   THR  69           HA       THR  69 -20.518   8.600  -6.146
  510    HB   THR  69           HB       THR  69 -17.833   8.604  -7.478
  511    HG1  THR  69           HG1      THR  69 -17.877   6.762  -6.089
  512   1HG2  THR  69          1HG2      THR  69 -19.176  10.579  -6.295
  513   2HG2  THR  69          2HG2      THR  69 -18.414   9.885  -4.863
  514   3HG2  THR  69          3HG2      THR  69 -17.419  10.452  -6.204
  515    HA   PRO  70           HA       PRO  70 -21.927   9.796 -10.242
  516   1HB   PRO  70          1HB       PRO  70 -23.138  12.101  -9.476
  517   2HB   PRO  70          2HB       PRO  70 -23.867  10.509  -9.234
  518   1HG   PRO  70          1HG       PRO  70 -22.373  12.224  -7.287
  519   2HG   PRO  70          2HG       PRO  70 -23.864  11.295  -7.044
  520   1HD   PRO  70          1HD       PRO  70 -21.445  10.405  -6.217
  521   2HD   PRO  70          2HD       PRO  70 -22.730   9.308  -6.762
  522    H    GLY  71           H        GLY  71 -19.654  11.290  -8.217
  523   1HA   GLY  71          1HA       GLY  71 -18.509  13.380  -8.539
  524   2HA   GLY  71          2HA       GLY  71 -19.071  13.385 -10.204
  525    H    SER  72           H        SER  72 -18.284  10.338 -10.000
  526    HA   SER  72           HA       SER  72 -15.506  10.179  -9.761
  527   1HB   SER  72          1HB       SER  72 -17.066   8.227  -9.836
  528   2HB   SER  72          2HB       SER  72 -17.254   8.495 -11.569
  529    HG   SER  72           HG       SER  72 -14.900   8.264 -11.664
  530    H    ARG  73           H        ARG  73 -13.910  10.924 -10.974
  531    HA   ARG  73           HA       ARG  73 -14.443  12.316 -13.420
  532   1HB   ARG  73          1HB       ARG  73 -11.858  11.656 -12.002
  533   2HB   ARG  73          2HB       ARG  73 -11.958  12.648 -13.449
  534   1HG   ARG  73          1HG       ARG  73 -13.733  13.508 -11.289
  535   2HG   ARG  73          2HG       ARG  73 -12.014  13.583 -10.896
  536   1HD   ARG  73          1HD       ARG  73 -12.546  14.591 -13.555
  537   2HD   ARG  73          2HD       ARG  73 -13.488  15.452 -12.339
  538    HE   ARG  73           HE       ARG  73 -10.575  15.371 -12.558
  539   1HH1  ARG  73          1HH1      ARG  73 -13.422  16.482 -10.883
  540   2HH1  ARG  73          2HH1      ARG  73 -12.582  17.722 -10.014
  541   1HH2  ARG  73          1HH2      ARG  73  -9.462  17.002 -11.417
  542   2HH2  ARG  73          2HH2      ARG  73 -10.332  18.019 -10.317
  543    H    ASN  74           H        ASN  74 -12.795   9.310 -12.543
  544    HA   ASN  74           HA       ASN  74 -12.267   7.436 -13.744
  545   1HB   ASN  74          1HB       ASN  74 -14.676   8.051 -14.703
  546   2HB   ASN  74          2HB       ASN  74 -13.750   8.406 -16.159
  547   2HD2  ASN  74          2HD2      ASN  74 -14.747   6.702 -17.250
  548   1HD2  ASN  74          1HD2      ASN  74 -14.319   5.055 -16.949
  549    H    LEU  75           H        LEU  75 -10.684   9.829 -13.795
  550    HA   LEU  75           HA       LEU  75  -9.618  10.630 -16.208
  551   1HB   LEU  75          1HB       LEU  75  -8.745  10.331 -13.409
  552   2HB   LEU  75          2HB       LEU  75  -7.460  10.502 -14.583
  553    HG   LEU  75           HG       LEU  75  -9.769  12.426 -14.157
  554   1HD1  LEU  75          1HD1      LEU  75  -7.836  12.172 -12.401
  555   2HD1  LEU  75          2HD1      LEU  75  -6.932  13.124 -13.578
  556   3HD1  LEU  75          3HD1      LEU  75  -8.419  13.765 -12.882
  557   1HD2  LEU  75          1HD2      LEU  75  -8.807  12.301 -16.484
  558   2HD2  LEU  75          2HD2      LEU  75  -8.727  13.884 -15.712
  559   3HD2  LEU  75          3HD2      LEU  75  -7.284  12.873 -15.802
  560    H    CYS  76           H        CYS  76  -8.631   8.153 -14.064
  561    HA   CYS  76           HA       CYS  76  -6.611   6.984 -15.652
  562   1HB   CYS  76          1HB       CYS  76  -7.469   6.927 -13.072
  563   2HB   CYS  76          2HB       CYS  76  -7.962   5.343 -13.650
  564    H    ASN  77           H        ASN  77 -10.025   6.492 -15.198
  565    HA   ASN  77           HA       ASN  77 -11.589   5.167 -16.207
  566   1HB   ASN  77          1HB       ASN  77 -10.042   6.321 -18.217
  567   2HB   ASN  77          2HB       ASN  77 -10.111   4.617 -18.658
  568   2HD2  ASN  77          2HD2      ASN  77 -12.230   3.636 -18.821
  569   1HD2  ASN  77          1HD2      ASN  77 -13.573   4.603 -19.317
  570    H    ILE  78           H        ILE  78 -10.238   3.776 -14.459
  571    HA   ILE  78           HA       ILE  78  -9.537   1.275 -15.816
  572    HB   ILE  78           HB       ILE  78  -7.774   0.925 -14.476
  573   1HG1  ILE  78          1HG1      ILE  78  -9.637   1.810 -12.361
  574   2HG1  ILE  78          2HG1      ILE  78  -8.503   0.466 -12.370
  575   1HG2  ILE  78          1HG2      ILE  78  -7.674   3.301 -15.373
  576   2HG2  ILE  78          2HG2      ILE  78  -8.029   3.814 -13.724
  577   3HG2  ILE  78          3HG2      ILE  78  -6.568   2.886 -14.063
  578   1HD1  ILE  78          1HD1      ILE  78  -6.677   2.125 -11.969
  579   2HD1  ILE  78          2HD1      ILE  78  -7.927   3.349 -11.753
  580   3HD1  ILE  78          3HD1      ILE  78  -7.845   1.969 -10.658
  581    HA   PRO  79           HA       PRO  79 -12.812  -0.636 -13.516
  582   1HB   PRO  79          1HB       PRO  79 -11.520  -3.212 -13.587
  583   2HB   PRO  79          2HB       PRO  79 -12.850  -2.634 -14.590
  584   1HG   PRO  79          1HG       PRO  79 -10.325  -3.172 -15.532
  585   2HG   PRO  79          2HG       PRO  79 -11.464  -2.058 -16.307
  586   1HD   PRO  79          1HD       PRO  79  -9.133  -1.457 -14.532
  587   2HD   PRO  79          2HD       PRO  79  -9.710  -0.589 -15.971
  588    H    CYS  80           H        CYS  80 -12.918  -0.197 -11.380
  589    HA   CYS  80           HA       CYS  80 -10.778  -0.393  -9.591
  590   1HB   CYS  80          1HB       CYS  80 -13.643  -0.539  -8.703
  591   2HB   CYS  80          2HB       CYS  80 -12.285   0.267  -7.925
  592    H    SER  81           H        SER  81 -13.688  -2.479  -9.709
  593    HA   SER  81           HA       SER  81 -12.850  -4.342  -7.842
  594   1HB   SER  81          1HB       SER  81 -14.448  -5.909  -8.986
  595   2HB   SER  81          2HB       SER  81 -15.130  -4.330  -8.596
  596    HG   SER  81           HG       SER  81 -14.617  -3.742 -10.810
  597    H    ALA  82           H        ALA  82 -11.790  -3.970 -11.134
  598    HA   ALA  82           HA       ALA  82 -10.787  -6.633 -11.448
  599   1HB   ALA  82          1HB       ALA  82 -11.376  -4.835 -13.249
  600   2HB   ALA  82          2HB       ALA  82 -10.071  -5.987 -13.533
  601   3HB   ALA  82          3HB       ALA  82  -9.698  -4.343 -13.016
  602    H    LEU  83           H        LEU  83  -9.759  -4.041  -9.624
  603    HA   LEU  83           HA       LEU  83  -6.944  -4.891  -9.692
  604   1HB   LEU  83          1HB       LEU  83  -6.305  -2.791  -9.013
  605   2HB   LEU  83          2HB       LEU  83  -7.724  -2.413  -9.968
  606    HG   LEU  83           HG       LEU  83  -8.825  -2.697  -7.491
  607   1HD1  LEU  83          1HD1      LEU  83  -6.394  -2.918  -6.672
  608   2HD1  LEU  83          2HD1      LEU  83  -6.298  -1.182  -6.965
  609   3HD1  LEU  83          3HD1      LEU  83  -7.476  -1.818  -5.819
  610   1HD2  LEU  83          1HD2      LEU  83  -9.149  -0.878  -9.147
  611   2HD2  LEU  83          2HD2      LEU  83  -9.008  -0.301  -7.486
  612   3HD2  LEU  83          3HD2      LEU  83  -7.641  -0.152  -8.590
  613    H    LEU  84           H        LEU  84  -9.785  -5.187  -7.931
  614    HA   LEU  84           HA       LEU  84  -8.342  -5.784  -5.442
  615   1HB   LEU  84          1HB       LEU  84 -11.312  -5.611  -5.561
  616   2HB   LEU  84          2HB       LEU  84 -10.218  -5.182  -4.258
  617    HG   LEU  84           HG       LEU  84 -10.081  -3.545  -6.728
  618   1HD1  LEU  84          1HD1      LEU  84 -12.556  -4.009  -5.445
  619   2HD1  LEU  84          2HD1      LEU  84 -12.027  -2.381  -5.016
  620   3HD1  LEU  84          3HD1      LEU  84 -12.176  -2.841  -6.712
  621   1HD2  LEU  84          1HD2      LEU  84  -8.620  -3.205  -4.744
  622   2HD2  LEU  84          2HD2      LEU  84  -9.578  -1.789  -5.182
  623   3HD2  LEU  84          3HD2      LEU  84 -10.058  -2.791  -3.812
  624    H    SER  85           H        SER  85  -8.234  -7.613  -7.557
  625    HA   SER  85           HA       SER  85  -9.749  -9.842  -6.396
  626   1HB   SER  85          1HB       SER  85  -9.839 -10.855  -8.704
  627   2HB   SER  85          2HB       SER  85 -10.809  -9.394  -8.517
  628    HG   SER  85           HG       SER  85  -9.715  -8.950 -10.308
  629    H    SER  86           H        SER  86  -7.244  -8.961  -5.726
  630    HA   SER  86           HA       SER  86  -5.236  -9.845  -5.081
  631   1HB   SER  86          1HB       SER  86  -5.893 -12.279  -6.760
  632   2HB   SER  86          2HB       SER  86  -4.720 -12.167  -5.449
  633    HG   SER  86           HG       SER  86  -6.341 -12.096  -3.987
  634    H    ASP  87           H        ASP  87  -6.023  -8.459  -7.585
  635    HA   ASP  87           HA       ASP  87  -3.600  -8.960  -9.170
  636   1HB   ASP  87          1HB       ASP  87  -5.856  -9.611 -10.134
  637   2HB   ASP  87          2HB       ASP  87  -6.233  -7.895 -10.159
  638    H    ILE  88           H        ILE  88  -2.210  -7.292  -8.931
  639    HA   ILE  88           HA       ILE  88  -3.239  -4.669  -8.207
  640    HB   ILE  88           HB       ILE  88  -0.625  -4.189  -8.386
  641   1HG1  ILE  88          1HG1      ILE  88  -0.534  -7.013  -7.395
  642   2HG1  ILE  88          2HG1      ILE  88  -0.436  -6.709  -9.128
  643   1HG2  ILE  88          1HG2      ILE  88  -2.261  -5.359  -6.185
  644   2HG2  ILE  88          2HG2      ILE  88  -0.549  -5.024  -5.928
  645   3HG2  ILE  88          3HG2      ILE  88  -1.645  -3.719  -6.380
  646   1HD1  ILE  88          1HD1      ILE  88   1.357  -5.113  -7.414
  647   2HD1  ILE  88          2HD1      ILE  88   1.701  -6.839  -7.538
  648   3HD1  ILE  88          3HD1      ILE  88   1.641  -5.844  -8.993
  649    H    THR  89           H        THR  89  -2.674  -6.300 -11.043
  650    HA   THR  89           HA       THR  89  -1.296  -4.654 -12.720
  651    HB   THR  89           HB       THR  89  -3.917  -5.822 -13.615
  652    HG1  THR  89           HG1      THR  89  -1.842  -7.137 -12.428
  653   1HG2  THR  89          1HG2      THR  89  -1.389  -4.960 -14.849
  654   2HG2  THR  89          2HG2      THR  89  -2.027  -6.492 -15.447
  655   3HG2  THR  89          3HG2      THR  89  -3.016  -5.034 -15.528
  656    H    ALA  90           H        ALA  90  -4.808  -4.402 -12.097
  657    HA   ALA  90           HA       ALA  90  -5.184  -2.090 -13.578
  658   1HB   ALA  90          1HB       ALA  90  -6.760  -3.767 -11.859
  659   2HB   ALA  90          2HB       ALA  90  -7.155  -2.064 -11.624
  660   3HB   ALA  90          3HB       ALA  90  -7.260  -2.780 -13.233
  661    H    SER  91           H        SER  91  -4.585  -2.532 -10.110
  662    HA   SER  91           HA       SER  91  -4.846   0.183  -9.379
  663   1HB   SER  91          1HB       SER  91  -2.978  -1.001  -7.633
  664   2HB   SER  91          2HB       SER  91  -4.710  -0.800  -7.370
  665    HG   SER  91           HG       SER  91  -4.886  -2.832  -8.636
  666    H    VAL  92           H        VAL  92  -2.173  -1.691 -10.581
  667    HA   VAL  92           HA       VAL  92  -0.253   0.360 -10.072
  668    HB   VAL  92           HB       VAL  92  -0.052  -2.085 -11.822
  669   1HG1  VAL  92          1HG1      VAL  92   2.018   0.039 -11.235
  670   2HG1  VAL  92          2HG1      VAL  92   2.371  -1.518 -11.982
  671   3HG1  VAL  92          3HG1      VAL  92   1.328  -0.361 -12.806
  672   1HG2  VAL  92          1HG2      VAL  92   0.768  -1.377  -9.047
  673   2HG2  VAL  92          2HG2      VAL  92   0.103  -2.885  -9.677
  674   3HG2  VAL  92          3HG2      VAL  92   1.793  -2.474  -9.972
  675    H    ASN  93           H        ASN  93  -1.809  -0.829 -13.060
  676    HA   ASN  93           HA       ASN  93  -0.712   0.791 -14.874
  677   1HB   ASN  93          1HB       ASN  93  -2.239  -0.220 -16.108
  678   2HB   ASN  93          2HB       ASN  93  -3.072  -0.708 -14.655
  679   2HD2  ASN  93          2HD2      ASN  93  -4.973   0.216 -14.139
  680   1HD2  ASN  93          1HD2      ASN  93  -5.724   1.477 -15.050
  681    H    CYS  94           H        CYS  94  -3.246   1.587 -12.603
  682    HA   CYS  94           HA       CYS  94  -3.733   4.210 -13.487
  683   1HB   CYS  94          1HB       CYS  94  -4.992   2.667 -11.741
  684   2HB   CYS  94          2HB       CYS  94  -3.985   3.543 -10.590
  685    H    ALA  95           H        ALA  95  -1.603   2.963 -10.903
  686    HA   ALA  95           HA       ALA  95  -0.605   5.554 -10.260
  687   1HB   ALA  95          1HB       ALA  95  -0.327   4.160  -8.498
  688   2HB   ALA  95          2HB       ALA  95   1.291   4.128  -9.199
  689   3HB   ALA  95          3HB       ALA  95   0.170   2.799  -9.503
  690    H    LYS  96           H        LYS  96   0.534   2.978 -12.399
  691    HA   LYS  96           HA       LYS  96   3.059   3.869 -13.011
  692   1HB   LYS  96          1HB       LYS  96   1.283   2.013 -14.096
  693   2HB   LYS  96          2HB       LYS  96   1.566   3.142 -15.414
  694   1HG   LYS  96          1HG       LYS  96   4.085   2.789 -14.714
  695   2HG   LYS  96          2HG       LYS  96   3.444   1.274 -14.075
  696   1HD   LYS  96          1HD       LYS  96   2.639   2.050 -16.823
  697   2HD   LYS  96          2HD       LYS  96   4.304   1.517 -16.584
  698   1HE   LYS  96          1HE       LYS  96   3.257  -0.479 -17.044
  699   2HE   LYS  96          2HE       LYS  96   3.181  -0.448 -15.283
  700   1HZ   LYS  96          1HZ       LYS  96   0.914   0.834 -16.016
  701   2HZ   LYS  96          2HZ       LYS  96   1.052  -0.357 -17.211
  702   3HZ   LYS  96          3HZ       LYS  96   1.012  -0.796 -15.579
  703    H    LYS  97           H        LYS  97  -0.065   4.938 -13.871
  704    HA   LYS  97           HA       LYS  97   0.775   7.055 -15.671
  705   1HB   LYS  97          1HB       LYS  97  -1.619   5.675 -15.268
  706   2HB   LYS  97          2HB       LYS  97  -1.947   7.301 -14.684
  707   1HG   LYS  97          1HG       LYS  97  -2.524   7.531 -16.876
  708   2HG   LYS  97          2HG       LYS  97  -0.822   7.992 -16.957
  709   1HD   LYS  97          1HD       LYS  97  -1.087   5.143 -17.214
  710   2HD   LYS  97          2HD       LYS  97  -2.124   5.955 -18.389
  711   1HE   LYS  97          1HE       LYS  97  -0.337   6.302 -19.660
  712   2HE   LYS  97          2HE       LYS  97   0.314   7.348 -18.399
  713   1HZ   LYS  97          1HZ       LYS  97   0.669   4.422 -18.266
  714   2HZ   LYS  97          2HZ       LYS  97   1.716   5.378 -19.189
  715   3HZ   LYS  97          3HZ       LYS  97   1.582   5.637 -17.522
  716    H    ILE  98           H        ILE  98  -0.271   6.682 -12.337
  717    HA   ILE  98           HA       ILE  98  -0.583   9.381 -11.696
  718    HB   ILE  98           HB       ILE  98   0.198   7.077  -9.937
  719   1HG1  ILE  98          1HG1      ILE  98  -2.428   8.569 -10.132
  720   2HG1  ILE  98          2HG1      ILE  98  -2.086   7.106 -11.049
  721   1HG2  ILE  98          1HG2      ILE  98   0.044   9.950  -9.379
  722   2HG2  ILE  98          2HG2      ILE  98  -0.868   8.936  -8.263
  723   3HG2  ILE  98          3HG2      ILE  98   0.859   8.663  -8.490
  724   1HD1  ILE  98          1HD1      ILE  98  -1.477   6.287  -8.546
  725   2HD1  ILE  98          2HD1      ILE  98  -2.760   7.450  -8.219
  726   3HD1  ILE  98          3HD1      ILE  98  -3.057   6.093  -9.306
  727    H    VAL  99           H        VAL  99   2.211   7.258 -11.338
  728    HA   VAL  99           HA       VAL  99   3.962   9.295 -10.417
  729    HB   VAL  99           HB       VAL  99   4.125   6.712 -10.146
  730   1HG1  VAL  99          1HG1      VAL  99   4.266   6.280 -12.589
  731   2HG1  VAL  99          2HG1      VAL  99   5.834   7.087 -12.600
  732   3HG1  VAL  99          3HG1      VAL  99   5.612   5.603 -11.672
  733   1HG2  VAL  99          1HG2      VAL  99   6.460   8.565 -10.537
  734   2HG2  VAL  99          2HG2      VAL  99   5.630   8.166  -9.034
  735   3HG2  VAL  99          3HG2      VAL  99   6.609   6.947  -9.850
  736    H    SER 100           H        SER 100   3.009   8.150 -13.565
  737    HA   SER 100           HA       SER 100   5.246   9.404 -14.916
  738   1HB   SER 100          1HB       SER 100   4.180   7.362 -15.844
  739   2HB   SER 100          2HB       SER 100   2.682   8.266 -16.066
  740    HG   SER 100           HG       SER 100   3.586   9.412 -17.665
  741    H    ASP 101           H        ASP 101   2.408  10.398 -13.513
  742    HA   ASP 101           HA       ASP 101   1.942  12.628 -15.343
  743   1HB   ASP 101          1HB       ASP 101   0.083  11.195 -14.260
  744   2HB   ASP 101          2HB       ASP 101   0.412  12.126 -12.802
  745    H    GLY 102           H        GLY 102   3.904  11.991 -12.750
  746   1HA   GLY 102          1HA       GLY 102   3.780  14.771 -11.771
  747   2HA   GLY 102          2HA       GLY 102   5.304  14.083 -12.306
  748    H    ASN 103           H        ASN 103   2.645  12.915 -10.233
  749    HA   ASN 103           HA       ASN 103   3.974  13.106  -7.798
  750   1HB   ASN 103          1HB       ASN 103   1.894  11.063  -8.609
  751   2HB   ASN 103          2HB       ASN 103   2.327  11.492  -6.957
  752   2HD2  ASN 103          2HD2      ASN 103   1.876  13.649  -6.241
  753   1HD2  ASN 103          1HD2      ASN 103   0.570  14.536  -6.944
  754    H    GLY 104           H        GLY 104   6.078  12.387  -7.837
  755   1HA   GLY 104          1HA       GLY 104   7.816  10.856  -8.275
  756   2HA   GLY 104          2HA       GLY 104   6.614   9.632  -8.644
  757    H    MET 105           H        MET 105   5.180   9.113  -6.623
  758    HA   MET 105           HA       MET 105   5.229   7.799  -4.747
  759   1HB   MET 105          1HB       MET 105   8.057   8.716  -4.219
  760   2HB   MET 105          2HB       MET 105   7.233   7.325  -3.530
  761   1HG   MET 105          1HG       MET 105   8.383   7.681  -6.261
  762   2HG   MET 105          2HG       MET 105   8.636   6.380  -5.099
  763   1HE   MET 105          1HE       MET 105   6.548   5.382  -4.076
  764   2HE   MET 105          2HE       MET 105   4.947   5.403  -4.814
  765   3HE   MET 105          3HE       MET 105   6.064   4.086  -5.170
  766    H    ASN 106           H        ASN 106   5.257  10.938  -5.158
  767    HA   ASN 106           HA       ASN 106   5.393  11.763  -2.377
  768   1HB   ASN 106          1HB       ASN 106   5.401  13.083  -5.028
  769   2HB   ASN 106          2HB       ASN 106   4.685  13.983  -3.705
  770   2HD2  ASN 106          2HD2      ASN 106   7.265  14.110  -5.345
  771   1HD2  ASN 106          1HD2      ASN 106   8.493  14.323  -4.148
  772    H    ALA 107           H        ALA 107   3.055  11.162  -4.908
  773    HA   ALA 107           HA       ALA 107   0.842  12.526  -3.891
  774   1HB   ALA 107          1HB       ALA 107   1.253  10.253  -5.732
  775   2HB   ALA 107          2HB       ALA 107  -0.353  10.403  -5.020
  776   3HB   ALA 107          3HB       ALA 107   0.329  11.738  -5.949
  777    H    TRP 108           H        TRP 108   2.113   9.331  -3.138
  778    HA   TRP 108           HA       TRP 108  -0.028   8.741  -1.296
  779   1HB   TRP 108          1HB       TRP 108   2.560   7.249  -1.780
  780   2HB   TRP 108          2HB       TRP 108   1.137   6.634  -0.941
  781    HD1  TRP 108           HD1      TRP 108  -0.986   5.967  -2.444
  782    HE1  TRP 108           HE1      TRP 108  -1.219   5.426  -4.949
  783    HE3  TRP 108           HE3      TRP 108   3.474   7.841  -4.102
  784    HZ2  TRP 108           HZ2      TRP 108   0.284   5.752  -7.322
  785    HZ3  TRP 108           HZ3      TRP 108   3.998   7.688  -6.500
  786    HH2  TRP 108           HH2      TRP 108   2.437   6.665  -8.074
  787    H    VAL 109           H        VAL 109  -0.102   9.355   0.732
  788    HA   VAL 109           HA       VAL 109   1.981  10.849   1.952
  789    HB   VAL 109           HB       VAL 109  -0.075   9.877   3.711
  790   1HG1  VAL 109          1HG1      VAL 109   1.356  12.363   3.106
  791   2HG1  VAL 109          2HG1      VAL 109  -0.292  12.558   3.703
  792   3HG1  VAL 109          3HG1      VAL 109   0.893  11.671   4.661
  793   1HG2  VAL 109          1HG2      VAL 109  -0.786  11.172   1.127
  794   2HG2  VAL 109          2HG2      VAL 109  -1.612   9.876   1.992
  795   3HG2  VAL 109          3HG2      VAL 109  -1.731  11.538   2.570
  796    H    ALA 110           H        ALA 110   1.087   7.493   2.124
  797    HA   ALA 110           HA       ALA 110   2.265   6.924   4.635
  798   1HB   ALA 110          1HB       ALA 110   1.845   5.076   2.287
  799   2HB   ALA 110          2HB       ALA 110   2.170   4.589   3.950
  800   3HB   ALA 110          3HB       ALA 110   0.665   5.417   3.553
  801    H    TRP 111           H        TRP 111   3.574   7.601   1.578
  802    HA   TRP 111           HA       TRP 111   6.114   6.302   2.150
  803   1HB   TRP 111          1HB       TRP 111   5.351   6.217  -0.152
  804   2HB   TRP 111          2HB       TRP 111   5.243   7.969  -0.220
  805    HD1  TRP 111           HD1      TRP 111   7.711   5.113  -0.504
  806    HE1  TRP 111           HE1      TRP 111   9.994   6.035  -1.256
  807    HE3  TRP 111           HE3      TRP 111   6.765  10.119  -0.045
  808    HZ2  TRP 111           HZ2      TRP 111  11.230   8.545  -1.609
  809    HZ3  TRP 111           HZ3      TRP 111   8.552  11.713  -0.611
  810    HH2  TRP 111           HH2      TRP 111  10.738  10.940  -1.376
  811    H    ARG 112           H        ARG 112   4.720   9.565   2.045
  812    HA   ARG 112           HA       ARG 112   7.286  10.733   2.790
  813   1HB   ARG 112          1HB       ARG 112   4.885  11.637   1.485
  814   2HB   ARG 112          2HB       ARG 112   5.277  12.678   2.847
  815   1HG   ARG 112          1HG       ARG 112   7.704  12.347   1.595
  816   2HG   ARG 112          2HG       ARG 112   6.563  12.437   0.252
  817   1HD   ARG 112          1HD       ARG 112   7.346  14.654   0.781
  818   2HD   ARG 112          2HD       ARG 112   5.645  14.516   1.221
  819    HE   ARG 112           HE       ARG 112   7.450  13.970   3.391
  820   1HH1  ARG 112          1HH1      ARG 112   5.734  16.452   1.648
  821   2HH1  ARG 112          2HH1      ARG 112   5.737  17.565   2.975
  822   1HH2  ARG 112          1HH2      ARG 112   7.458  15.428   5.142
  823   2HH2  ARG 112          2HH2      ARG 112   6.717  16.983   4.961
  824    H    ASN 113           H        ASN 113   6.330   9.021   4.697
  825    HA   ASN 113           HA       ASN 113   6.004  10.824   6.935
  826   1HB   ASN 113          1HB       ASN 113   3.741   9.352   5.855
  827   2HB   ASN 113          2HB       ASN 113   4.041   8.946   7.542
  828   2HD2  ASN 113          2HD2      ASN 113   2.521  11.050   5.489
  829   1HD2  ASN 113          1HD2      ASN 113   2.219  12.345   6.592
  830    H    ARG 114           H        ARG 114   5.466   7.370   6.298
  831    HA   ARG 114           HA       ARG 114   7.181   6.723   8.572
  832   1HB   ARG 114          1HB       ARG 114   5.025   5.338   7.077
  833   2HB   ARG 114          2HB       ARG 114   6.283   4.335   7.776
  834   1HG   ARG 114          1HG       ARG 114   5.558   4.667   9.876
  835   2HG   ARG 114          2HG       ARG 114   5.179   6.365   9.583
  836   1HD   ARG 114          1HD       ARG 114   3.413   4.650   8.087
  837   2HD   ARG 114          2HD       ARG 114   3.383   4.230   9.799
  838    HE   ARG 114           HE       ARG 114   3.179   6.980   9.678
  839   1HH1  ARG 114          1HH1      ARG 114   1.356   4.237   8.540
  840   2HH1  ARG 114          2HH1      ARG 114  -0.168   5.057   8.612
  841   1HH2  ARG 114          1HH2      ARG 114   1.177   8.067   9.775
  842   2HH2  ARG 114          2HH2      ARG 114  -0.269   7.235   9.313
  843    H    CYS 115           H        CYS 115   7.461   7.096   5.278
  844    HA   CYS 115           HA       CYS 115   9.619   5.104   5.107
  845   1HB   CYS 115          1HB       CYS 115   7.802   4.816   3.472
  846   2HB   CYS 115          2HB       CYS 115   8.110   6.437   2.857
  847    H    LYS 116           H        LYS 116   8.801   8.457   4.241
  848    HA   LYS 116           HA       LYS 116  11.243   9.176   3.125
  849   1HB   LYS 116          1HB       LYS 116   9.151  10.535   3.070
  850   2HB   LYS 116          2HB       LYS 116   9.424  10.956   4.756
  851   1HG   LYS 116          1HG       LYS 116  10.294  12.784   3.683
  852   2HG   LYS 116          2HG       LYS 116  11.735  11.785   3.883
  853   1HD   LYS 116          1HD       LYS 116  10.541  10.985   1.465
  854   2HD   LYS 116          2HD       LYS 116  10.517  12.750   1.472
  855   1HE   LYS 116          1HE       LYS 116  12.655  12.720   0.870
  856   2HE   LYS 116          2HE       LYS 116  13.039  12.022   2.442
  857   1HZ   LYS 116          1HZ       LYS 116  12.080  10.000   0.738
  858   2HZ   LYS 116          2HZ       LYS 116  13.314  10.841  -0.060
  859   3HZ   LYS 116          3HZ       LYS 116  13.607  10.142   1.451
  860    H    GLY 117           H        GLY 117  13.012   8.399   4.246
  861   1HA   GLY 117          1HA       GLY 117  13.371   9.411   6.991
  862   2HA   GLY 117          2HA       GLY 117  14.615   9.669   5.779
  863    H    THR 118           H        THR 118  13.382   6.731   5.018
  864    HA   THR 118           HA       THR 118  15.231   5.325   6.828
  865    HB   THR 118           HB       THR 118  13.873   3.301   6.453
  866    HG1  THR 118           HG1      THR 118  12.052   3.373   5.227
  867   1HG2  THR 118          1HG2      THR 118  13.223   5.510   8.032
  868   2HG2  THR 118          2HG2      THR 118  11.698   4.999   7.309
  869   3HG2  THR 118          3HG2      THR 118  12.659   3.853   8.243
  870    H    ASP 119           H        ASP 119  14.948   2.861   5.243
  871    HA   ASP 119           HA       ASP 119  16.391   3.615   2.809
  872   1HB   ASP 119          1HB       ASP 119  17.759   2.738   4.846
  873   2HB   ASP 119          2HB       ASP 119  17.207   1.197   4.229
  874    H    VAL 120           H        VAL 120  15.084   3.037   1.203
  875    HA   VAL 120           HA       VAL 120  13.301   0.808   1.374
  876    HB   VAL 120           HB       VAL 120  12.697   1.352  -0.936
  877   1HG1  VAL 120          1HG1      VAL 120  11.911   2.687   1.128
  878   2HG1  VAL 120          2HG1      VAL 120  12.937   3.973   0.492
  879   3HG1  VAL 120          3HG1      VAL 120  11.602   3.351  -0.478
  880   1HG2  VAL 120          1HG2      VAL 120  15.280   2.654  -0.901
  881   2HG2  VAL 120          2HG2      VAL 120  14.273   2.187  -2.271
  882   3HG2  VAL 120          3HG2      VAL 120  14.014   3.739  -1.474
  883    H    GLN 121           H        GLN 121  16.457   1.438   0.008
  884    HA   GLN 121           HA       GLN 121  16.661  -0.745  -1.735
  885   1HB   GLN 121          1HB       GLN 121  18.283   1.268  -1.303
  886   2HB   GLN 121          2HB       GLN 121  19.010   0.191  -0.119
  887   1HG   GLN 121          1HG       GLN 121  19.962  -1.100  -1.683
  888   2HG   GLN 121          2HG       GLN 121  18.573  -1.000  -2.763
  889   2HE2  GLN 121          2HE2      GLN 121  18.269   1.349  -3.619
  890   1HE2  GLN 121          1HE2      GLN 121  19.700   2.072  -4.263
  891    H    ALA 122           H        ALA 122  16.718  -0.496   1.693
  892    HA   ALA 122           HA       ALA 122  17.793  -3.173   2.073
  893   1HB   ALA 122          1HB       ALA 122  17.332  -0.821   3.768
  894   2HB   ALA 122          2HB       ALA 122  16.997  -2.369   4.546
  895   3HB   ALA 122          3HB       ALA 122  18.589  -2.056   3.855
  896    H    TRP 123           H        TRP 123  14.770  -1.562   1.767
  897    HA   TRP 123           HA       TRP 123  13.137  -3.318   3.267
  898   1HB   TRP 123          1HB       TRP 123  12.683  -1.313   1.119
  899   2HB   TRP 123          2HB       TRP 123  11.409  -2.493   1.400
  900    HD1  TRP 123           HD1      TRP 123  11.742   0.832   2.167
  901    HE1  TRP 123           HE1      TRP 123  10.868   1.495   4.496
  902    HE3  TRP 123           HE3      TRP 123  11.652  -3.759   4.381
  903    HZ2  TRP 123           HZ2      TRP 123  10.238   0.208   6.916
  904    HZ3  TRP 123           HZ3      TRP 123  10.903  -3.966   6.694
  905    HH2  TRP 123           HH2      TRP 123  10.203  -2.000   7.950
  906    H    ILE 124           H        ILE 124  14.779  -3.714   0.301
  907    HA   ILE 124           HA       ILE 124  13.302  -6.216  -0.191
  908    HB   ILE 124           HB       ILE 124  13.927  -5.923  -2.618
  909   1HG1  ILE 124          1HG1      ILE 124  13.987  -3.116  -2.751
  910   2HG1  ILE 124          2HG1      ILE 124  15.158  -3.554  -1.512
  911   1HG2  ILE 124          1HG2      ILE 124  11.910  -4.340  -1.132
  912   2HG2  ILE 124          2HG2      ILE 124  12.134  -3.981  -2.844
  913   3HG2  ILE 124          3HG2      ILE 124  11.693  -5.611  -2.334
  914   1HD1  ILE 124          1HD1      ILE 124  15.805  -5.319  -3.443
  915   2HD1  ILE 124          2HD1      ILE 124  15.230  -3.964  -4.415
  916   3HD1  ILE 124          3HD1      ILE 124  16.544  -3.728  -3.263
  917    H    ARG 125           H        ARG 125  15.959  -5.267   1.131
  918    HA   ARG 125           HA       ARG 125  18.072  -6.420  -0.351
  919   1HB   ARG 125          1HB       ARG 125  18.053  -4.825   1.760
  920   2HB   ARG 125          2HB       ARG 125  18.163  -6.348   2.633
  921   1HG   ARG 125          1HG       ARG 125  20.208  -6.908   1.487
  922   2HG   ARG 125          2HG       ARG 125  20.075  -5.463   0.482
  923   1HD   ARG 125          1HD       ARG 125  21.511  -4.678   2.068
  924   2HD   ARG 125          2HD       ARG 125  19.980  -4.276   2.845
  925    HE   ARG 125           HE       ARG 125  20.321  -6.005   4.377
  926   1HH1  ARG 125          1HH1      ARG 125  22.880  -5.855   2.016
  927   2HH1  ARG 125          2HH1      ARG 125  23.952  -6.866   2.926
  928   1HH2  ARG 125          1HH2      ARG 125  21.727  -7.337   5.580
  929   2HH2  ARG 125          2HH2      ARG 125  23.297  -7.709   4.951
  930    H    GLY 126           H        GLY 126  17.728  -8.481  -1.043
  931   1HA   GLY 126          1HA       GLY 126  17.443 -10.520   1.075
  932   2HA   GLY 126          2HA       GLY 126  18.352 -10.755  -0.410
  933    H    CYS 127           H        CYS 127  15.652  -9.068  -1.238
  934    HA   CYS 127           HA       CYS 127  13.639 -11.013  -1.214
  935   1HB   CYS 127          1HB       CYS 127  14.067  -8.446  -2.516
  936   2HB   CYS 127          2HB       CYS 127  12.865  -9.484  -3.255
  937    H    ARG 128           H        ARG 128  13.341 -12.776  -2.401
  938    HA   ARG 128           HA       ARG 128  15.171 -13.376  -4.557
  939   1HB   ARG 128          1HB       ARG 128  14.414 -15.046  -2.815
  940   2HB   ARG 128          2HB       ARG 128  12.841 -15.040  -3.601
  941   1HG   ARG 128          1HG       ARG 128  14.382 -15.545  -5.727
  942   2HG   ARG 128          2HG       ARG 128  15.391 -16.250  -4.462
  943   1HD   ARG 128          1HD       ARG 128  14.043 -18.026  -5.113
  944   2HD   ARG 128          2HD       ARG 128  13.223 -17.402  -3.682
  945    HE   ARG 128           HE       ARG 128  12.146 -16.129  -5.920
  946   1HH1  ARG 128          1HH1      ARG 128  12.299 -19.315  -4.518
  947   2HH1  ARG 128          2HH1      ARG 128  10.783 -19.821  -5.184
  948   1HH2  ARG 128          1HH2      ARG 128  10.149 -16.788  -6.801
  949   2HH2  ARG 128          2HH2      ARG 128   9.560 -18.385  -6.482
  950    H    LEU 129           H        LEU 129  14.658 -12.037  -6.258
  951    HA   LEU 129           HA       LEU 129  12.422 -12.857  -7.865
  952   1HB   LEU 129          1HB       LEU 129  11.343 -10.704  -8.042
  953   2HB   LEU 129          2HB       LEU 129  11.355 -11.225  -6.368
  954    HG   LEU 129           HG       LEU 129  13.643  -9.708  -6.526
  955   1HD1  LEU 129          1HD1      LEU 129  11.553  -8.567  -8.355
  956   2HD1  LEU 129          2HD1      LEU 129  12.748  -7.557  -7.541
  957   3HD1  LEU 129          3HD1      LEU 129  13.271  -8.812  -8.664
  958   1HD2  LEU 129          1HD2      LEU 129  10.838  -9.052  -5.667
  959   2HD2  LEU 129          2HD2      LEU 129  12.200  -9.564  -4.669
  960   3HD2  LEU 129          3HD2      LEU 129  12.194  -7.957  -5.397

  No H/Q in entry =         960
  Start of MODEL   10
    1    H1   LYS   1           H1       LYS   1  -7.098  -9.428   1.992
    2    H2   LYS   1           H2       LYS   1  -7.502  -8.996   0.406
    3    H3   LYS   1           H3       LYS   1  -8.014 -10.480   1.036
    4    HA   LYS   1           HA       LYS   1  -5.761 -11.270   1.170
    5   1HB   LYS   1          1HB       LYS   1  -7.185 -11.423  -0.934
    6   2HB   LYS   1          2HB       LYS   1  -6.247 -10.074  -1.560
    7   1HG   LYS   1          1HG       LYS   1  -4.995 -11.719  -2.439
    8   2HG   LYS   1          2HG       LYS   1  -4.251 -11.717  -0.838
    9   1HD   LYS   1          1HD       LYS   1  -5.025 -13.760  -0.371
   10   2HD   LYS   1          2HD       LYS   1  -6.645 -13.361  -0.948
   11   1HE   LYS   1          1HE       LYS   1  -5.554 -13.558  -3.305
   12   2HE   LYS   1          2HE       LYS   1  -4.314 -14.477  -2.453
   13   1HZ   LYS   1          1HZ       LYS   1  -6.210 -15.853  -1.555
   14   2HZ   LYS   1          2HZ       LYS   1  -7.194 -15.105  -2.710
   15   3HZ   LYS   1          3HZ       LYS   1  -5.874 -16.039  -3.203
   16    H    VAL   2           H        VAL   2  -3.922 -10.522   1.992
   17    HA   VAL   2           HA       VAL   2  -2.850  -7.970   0.982
   18    HB   VAL   2           HB       VAL   2  -2.343  -9.370   3.612
   19   1HG1  VAL   2          1HG1      VAL   2  -0.471  -7.923   2.318
   20   2HG1  VAL   2          2HG1      VAL   2  -1.322  -6.638   3.173
   21   3HG1  VAL   2          3HG1      VAL   2  -0.618  -7.979   4.075
   22   1HG2  VAL   2          1HG2      VAL   2  -4.382  -7.645   2.854
   23   2HG2  VAL   2          2HG2      VAL   2  -3.905  -8.057   4.501
   24   3HG2  VAL   2          3HG2      VAL   2  -3.235  -6.624   3.722
   25    H    PHE   3           H        PHE   3  -0.987  -7.990  -0.160
   26    HA   PHE   3           HA       PHE   3   0.341 -10.461  -0.723
   27   1HB   PHE   3          1HB       PHE   3   1.101  -7.597  -1.354
   28   2HB   PHE   3          2HB       PHE   3   1.958  -9.008  -1.955
   29    HD1  PHE   3           HD1      PHE   3  -0.938 -10.453  -2.233
   30    HD2  PHE   3           HD2      PHE   3   0.894  -6.902  -3.689
   31    HE1  PHE   3           HE1      PHE   3  -2.405 -10.504  -4.205
   32    HE2  PHE   3           HE2      PHE   3  -0.566  -6.946  -5.656
   33    HZ   PHE   3           HZ       PHE   3  -2.218  -8.747  -5.923
   34    H    GLY   4           H        GLY   4   2.883 -10.336  -0.604
   35   1HA   GLY   4          1HA       GLY   4   4.439 -10.863   1.104
   36   2HA   GLY   4          2HA       GLY   4   3.526  -9.844   2.211
   37    H    ARG   5           H        ARG   5   6.398  -9.797   1.639
   38    HA   ARG   5           HA       ARG   5   6.584  -6.959   1.013
   39   1HB   ARG   5          1HB       ARG   5   8.712  -8.862   2.011
   40   2HB   ARG   5          2HB       ARG   5   8.874  -7.117   1.874
   41   1HG   ARG   5          1HG       ARG   5   6.833  -7.045   3.461
   42   2HG   ARG   5          2HG       ARG   5   7.269  -8.717   3.820
   43   1HD   ARG   5          1HD       ARG   5   9.673  -7.339   3.941
   44   2HD   ARG   5          2HD       ARG   5   8.511  -6.245   4.688
   45    HE   ARG   5           HE       ARG   5   8.033  -8.711   5.808
   46   1HH1  ARG   5          1HH1      ARG   5  10.741  -6.530   5.580
   47   2HH1  ARG   5          2HH1      ARG   5  11.433  -7.027   7.087
   48   1HH2  ARG   5          1HH2      ARG   5   8.938  -9.371   7.794
   49   2HH2  ARG   5          2HH2      ARG   5  10.408  -8.643   8.345
   50    H    CYS   6           H        CYS   6   8.281  -9.941   0.025
   51    HA   CYS   6           HA       CYS   6   9.303  -8.544  -2.294
   52   1HB   CYS   6          1HB       CYS   6   9.639 -11.484  -1.861
   53   2HB   CYS   6          2HB       CYS   6  10.703 -10.332  -2.661
   54    H    GLU   7           H        GLU   7   6.908 -11.030  -1.558
   55    HA   GLU   7           HA       GLU   7   6.359 -12.025  -4.061
   56   1HB   GLU   7          1HB       GLU   7   5.068 -12.051  -1.594
   57   2HB   GLU   7          2HB       GLU   7   3.897 -11.299  -2.669
   58   1HG   GLU   7          1HG       GLU   7   3.422 -13.227  -3.665
   59   2HG   GLU   7          2HG       GLU   7   5.123 -13.653  -3.841
   60    H    LEU   8           H        LEU   8   5.057  -9.088  -2.592
   61    HA   LEU   8           HA       LEU   8   3.698  -8.180  -4.897
   62   1HB   LEU   8          1HB       LEU   8   3.174  -7.409  -2.618
   63   2HB   LEU   8          2HB       LEU   8   4.735  -6.618  -2.527
   64    HG   LEU   8           HG       LEU   8   2.546  -5.263  -3.075
   65   1HD1  LEU   8          1HD1      LEU   8   4.908  -4.444  -2.936
   66   2HD1  LEU   8          2HD1      LEU   8   5.043  -4.743  -4.668
   67   3HD1  LEU   8          3HD1      LEU   8   3.875  -3.567  -4.065
   68   1HD2  LEU   8          1HD2      LEU   8   2.250  -6.852  -5.139
   69   2HD2  LEU   8          2HD2      LEU   8   1.866  -5.135  -5.264
   70   3HD2  LEU   8          3HD2      LEU   8   3.397  -5.744  -5.893
   71    H    ALA   9           H        ALA   9   6.965  -7.579  -3.593
   72    HA   ALA   9           HA       ALA   9   7.682  -5.542  -5.391
   73   1HB   ALA   9          1HB       ALA   9   9.384  -7.559  -3.955
   74   2HB   ALA   9          2HB       ALA   9   9.038  -5.896  -3.478
   75   3HB   ALA   9          3HB       ALA   9  10.034  -6.217  -4.899
   76    H    ALA  10           H        ALA  10   8.280  -9.056  -5.618
   77    HA   ALA  10           HA       ALA  10   9.598  -9.115  -8.036
   78   1HB   ALA  10          1HB       ALA  10   7.962 -11.351  -8.119
   79   2HB   ALA  10          2HB       ALA  10   9.564 -11.256  -7.390
   80   3HB   ALA  10          3HB       ALA  10   8.129 -11.010  -6.396
   81    H    ALA  11           H        ALA  11   6.152  -8.902  -7.322
   82    HA   ALA  11           HA       ALA  11   5.245  -9.129  -9.972
   83   1HB   ALA  11          1HB       ALA  11   3.781  -7.471  -7.983
   84   2HB   ALA  11          2HB       ALA  11   3.921  -9.211  -7.733
   85   3HB   ALA  11          3HB       ALA  11   3.141  -8.588  -9.188
   86    H    MET  12           H        MET  12   6.317  -6.504  -8.054
   87    HA   MET  12           HA       MET  12   5.607  -4.369  -9.764
   88   1HB   MET  12          1HB       MET  12   8.079  -4.340  -8.062
   89   2HB   MET  12          2HB       MET  12   7.041  -3.001  -8.479
   90   1HG   MET  12          1HG       MET  12   6.148  -5.275  -6.752
   91   2HG   MET  12          2HG       MET  12   6.880  -3.804  -6.118
   92   1HE   MET  12          1HE       MET  12   6.092  -1.811  -8.024
   93   2HE   MET  12          2HE       MET  12   4.397  -1.329  -8.070
   94   3HE   MET  12          3HE       MET  12   5.324  -1.147  -6.583
   95    H    LYS  13           H        LYS  13   8.635  -6.182  -9.406
   96    HA   LYS  13           HA       LYS  13  10.201  -4.905 -11.277
   97   1HB   LYS  13          1HB       LYS  13  10.956  -6.729  -9.753
   98   2HB   LYS  13          2HB       LYS  13  10.128  -7.889 -10.784
   99   1HG   LYS  13          1HG       LYS  13  12.224  -8.074 -11.630
  100   2HG   LYS  13          2HG       LYS  13  11.631  -6.757 -12.644
  101   1HD   LYS  13          1HD       LYS  13  12.662  -5.133 -11.128
  102   2HD   LYS  13          2HD       LYS  13  13.256  -6.452 -10.118
  103   1HE   LYS  13          1HE       LYS  13  14.844  -7.091 -11.647
  104   2HE   LYS  13          2HE       LYS  13  13.935  -6.453 -13.017
  105   1HZ   LYS  13          1HZ       LYS  13  14.951  -4.550 -11.040
  106   2HZ   LYS  13          2HZ       LYS  13  16.064  -5.248 -12.106
  107   3HZ   LYS  13          3HZ       LYS  13  14.751  -4.368 -12.709
  108    H    ARG  14           H        ARG  14   8.007  -7.648 -11.790
  109    HA   ARG  14           HA       ARG  14   8.391  -7.833 -14.570
  110   1HB   ARG  14          1HB       ARG  14   5.951  -8.588 -12.947
  111   2HB   ARG  14          2HB       ARG  14   6.307  -9.134 -14.580
  112   1HG   ARG  14          1HG       ARG  14   8.272 -10.314 -13.781
  113   2HG   ARG  14          2HG       ARG  14   7.975  -9.728 -12.143
  114   1HD   ARG  14          1HD       ARG  14   6.080 -11.453 -13.732
  115   2HD   ARG  14          2HD       ARG  14   7.197 -12.050 -12.506
  116    HE   ARG  14           HE       ARG  14   5.456  -9.983 -11.543
  117   1HH1  ARG  14          1HH1      ARG  14   5.758 -13.402 -12.140
  118   2HH1  ARG  14          2HH1      ARG  14   4.571 -13.844 -10.958
  119   1HH2  ARG  14          1HH2      ARG  14   3.893 -10.555  -9.985
  120   2HH2  ARG  14          2HH2      ARG  14   3.510 -12.225  -9.735
  121    H    HIS  15           H        HIS  15   6.226  -5.895 -12.567
  122    HA   HIS  15           HA       HIS  15   4.678  -4.936 -14.753
  123   1HB   HIS  15          1HB       HIS  15   4.864  -4.382 -11.836
  124   2HB   HIS  15          2HB       HIS  15   4.106  -3.161 -12.854
  125    HD1  HIS  15           HD1      HIS  15   2.763  -5.168 -10.668
  126    HD2  HIS  15           HD2      HIS  15   2.482  -5.342 -14.809
  127    HE1  HIS  15           HE1      HIS  15   0.649  -6.440 -11.144
  128    HE2  HIS  15           HE2      HIS  15   0.545  -6.610 -13.655
  129    H    GLY  16           H        GLY  16   7.857  -4.237 -13.924
  130   1HA   GLY  16          1HA       GLY  16   7.874  -2.026 -15.691
  131   2HA   GLY  16          2HA       GLY  16   9.243  -2.700 -14.837
  132    H    LEU  17           H        LEU  17   7.781  -2.159 -12.141
  133    HA   LEU  17           HA       LEU  17   7.817   0.745 -12.232
  134   1HB   LEU  17          1HB       LEU  17   7.422  -0.842  -9.731
  135   2HB   LEU  17          2HB       LEU  17   6.841   0.764 -10.111
  136    HG   LEU  17           HG       LEU  17   5.655  -1.870 -10.691
  137   1HD1  LEU  17          1HD1      LEU  17   4.967   0.233  -9.165
  138   2HD1  LEU  17          2HD1      LEU  17   4.090   0.633 -10.642
  139   3HD1  LEU  17          3HD1      LEU  17   3.798  -0.906  -9.834
  140   1HD2  LEU  17          1HD2      LEU  17   5.713   0.349 -12.704
  141   2HD2  LEU  17          2HD2      LEU  17   5.847  -1.391 -12.955
  142   3HD2  LEU  17          3HD2      LEU  17   4.286  -0.676 -12.553
  143    H    ASP  18           H        ASP  18  10.044  -1.567 -11.935
  144    HA   ASP  18           HA       ASP  18  11.627  -0.550  -9.793
  145   1HB   ASP  18          1HB       ASP  18  12.195  -2.733 -10.194
  146   2HB   ASP  18          2HB       ASP  18  12.024  -2.579 -11.933
  147    H    ASN  19           H        ASN  19  12.012   1.568 -10.000
  148    HA   ASN  19           HA       ASN  19  13.068   3.477 -10.591
  149   1HB   ASN  19          1HB       ASN  19  14.950   1.593 -10.947
  150   2HB   ASN  19          2HB       ASN  19  14.814   2.161 -12.608
  151   2HD2  ASN  19          2HD2      ASN  19  16.493   3.425 -12.967
  152   1HD2  ASN  19          1HD2      ASN  19  17.020   4.719 -11.951
  153    H    TYR  20           H        TYR  20  10.745   2.665 -11.971
  154    HA   TYR  20           HA       TYR  20  10.974   3.197 -14.771
  155   1HB   TYR  20          1HB       TYR  20   9.076   1.944 -13.725
  156   2HB   TYR  20          2HB       TYR  20   8.541   3.444 -12.978
  157    HD1  TYR  20           HD1      TYR  20   9.368   2.091 -16.367
  158    HD2  TYR  20           HD2      TYR  20   6.890   4.648 -14.040
  159    HE1  TYR  20           HE1      TYR  20   8.029   2.603 -18.365
  160    HE2  TYR  20           HE2      TYR  20   5.543   5.167 -16.030
  161    HH   TYR  20           HH       TYR  20   6.027   3.484 -19.066
  162    H    ARG  21           H        ARG  21   9.588   5.136 -15.670
  163    HA   ARG  21           HA       ARG  21  10.805   7.465 -15.497
  164   1HB   ARG  21          1HB       ARG  21   7.866   6.932 -15.743
  165   2HB   ARG  21          2HB       ARG  21   8.464   8.585 -15.748
  166   1HG   ARG  21          1HG       ARG  21   9.924   6.847 -17.569
  167   2HG   ARG  21          2HG       ARG  21   8.201   6.954 -17.938
  168   1HD   ARG  21          1HD       ARG  21   9.726   9.449 -17.350
  169   2HD   ARG  21          2HD       ARG  21   9.901   8.688 -18.931
  170    HE   ARG  21           HE       ARG  21   7.186   9.183 -18.016
  171   1HH1  ARG  21          1HH1      ARG  21   9.881  10.220 -19.966
  172   2HH1  ARG  21          2HH1      ARG  21   8.920  11.245 -20.978
  173   1HH2  ARG  21          1HH2      ARG  21   5.913  10.530 -19.343
  174   2HH2  ARG  21          2HH2      ARG  21   6.665  11.422 -20.624
  175    H    GLY  22           H        GLY  22   8.881   6.105 -13.020
  176   1HA   GLY  22          1HA       GLY  22   8.076   7.023 -10.997
  177   2HA   GLY  22          2HA       GLY  22   8.887   8.533 -11.391
  178    H    TYR  23           H        TYR  23   9.062   5.627  -9.668
  179    HA   TYR  23           HA       TYR  23  11.891   6.126  -9.039
  180   1HB   TYR  23          1HB       TYR  23   9.577   5.771  -7.180
  181   2HB   TYR  23          2HB       TYR  23  11.204   5.353  -6.655
  182    HD1  TYR  23           HD1      TYR  23   9.316   8.160  -8.233
  183    HD2  TYR  23           HD2      TYR  23  12.520   7.001  -5.686
  184    HE1  TYR  23           HE1      TYR  23   9.730  10.522  -7.693
  185    HE2  TYR  23           HE2      TYR  23  12.943   9.360  -5.137
  186    HH   TYR  23           HH       TYR  23  11.630  11.514  -5.123
  187    H    SER  24           H        SER  24  12.705   4.335  -7.457
  188    HA   SER  24           HA       SER  24  12.702   1.924  -9.011
  189   1HB   SER  24          1HB       SER  24  14.535   1.231  -7.620
  190   2HB   SER  24          2HB       SER  24  14.768   2.932  -8.021
  191    HG   SER  24           HG       SER  24  13.317   2.573  -5.739
  192    H    LEU  25           H        LEU  25  12.650  -0.188  -7.946
  193    HA   LEU  25           HA       LEU  25  10.231  -0.931  -7.025
  194   1HB   LEU  25          1HB       LEU  25  12.920  -2.065  -6.981
  195   2HB   LEU  25          2HB       LEU  25  11.882  -2.702  -5.719
  196    HG   LEU  25           HG       LEU  25  10.857  -2.609  -8.513
  197   1HD1  LEU  25          1HD1      LEU  25  13.214  -3.599  -8.449
  198   2HD1  LEU  25          2HD1      LEU  25  12.496  -4.918  -7.525
  199   3HD1  LEU  25          3HD1      LEU  25  11.933  -4.579  -9.162
  200   1HD2  LEU  25          1HD2      LEU  25  10.418  -4.271  -6.055
  201   2HD2  LEU  25          2HD2      LEU  25   9.253  -3.307  -6.964
  202   3HD2  LEU  25          3HD2      LEU  25   9.876  -4.810  -7.644
  203    H    GLY  26           H        GLY  26  13.028  -0.428  -4.847
  204   1HA   GLY  26          1HA       GLY  26  13.105   0.388  -2.697
  205   2HA   GLY  26          2HA       GLY  26  11.892  -0.849  -2.424
  206    H    ASN  27           H        ASN  27  11.469   2.070  -4.371
  207    HA   ASN  27           HA       ASN  27  10.165   3.567  -2.340
  208   1HB   ASN  27          1HB       ASN  27  10.094   3.865  -5.345
  209   2HB   ASN  27          2HB       ASN  27   9.443   5.041  -4.208
  210   2HD2  ASN  27          2HD2      ASN  27  12.237   3.819  -5.748
  211   1HD2  ASN  27          1HD2      ASN  27  13.379   4.909  -5.046
  212    H    TRP  28           H        TRP  28   9.059   1.350  -4.813
  213    HA   TRP  28           HA       TRP  28   6.277   1.901  -4.514
  214   1HB   TRP  28          1HB       TRP  28   7.719  -0.475  -5.684
  215   2HB   TRP  28          2HB       TRP  28   5.979  -0.199  -5.794
  216    HD1  TRP  28           HD1      TRP  28   9.250   0.825  -7.319
  217    HE1  TRP  28           HE1      TRP  28   8.831   2.470  -9.238
  218    HE3  TRP  28           HE3      TRP  28   4.276   1.662  -6.569
  219    HZ2  TRP  28           HZ2      TRP  28   6.659   3.921 -10.329
  220    HZ3  TRP  28           HZ3      TRP  28   3.080   3.178  -8.089
  221    HH2  TRP  28           HH2      TRP  28   4.251   4.292  -9.936
  222    H    VAL  29           H        VAL  29   8.462  -0.574  -3.185
  223    HA   VAL  29           HA       VAL  29   6.470  -2.048  -1.870
  224    HB   VAL  29           HB       VAL  29   9.401  -1.776  -1.194
  225   1HG1  VAL  29          1HG1      VAL  29   8.118  -2.716   0.652
  226   2HG1  VAL  29          2HG1      VAL  29   7.428  -3.925  -0.431
  227   3HG1  VAL  29          3HG1      VAL  29   9.157  -3.937  -0.083
  228   1HG2  VAL  29          1HG2      VAL  29   8.610  -2.576  -3.548
  229   2HG2  VAL  29          2HG2      VAL  29   9.878  -3.456  -2.696
  230   3HG2  VAL  29          3HG2      VAL  29   8.225  -4.072  -2.697
  231    H    CYS  30           H        CYS  30   8.693   0.456  -0.688
  232    HA   CYS  30           HA       CYS  30   7.796   0.454   1.954
  233   1HB   CYS  30          1HB       CYS  30   9.871   1.576   0.979
  234   2HB   CYS  30          2HB       CYS  30   8.808   2.905   0.527
  235    H    ALA  31           H        ALA  31   6.733   2.442  -0.819
  236    HA   ALA  31           HA       ALA  31   4.896   4.008   0.617
  237   1HB   ALA  31          1HB       ALA  31   4.858   3.248  -2.301
  238   2HB   ALA  31          2HB       ALA  31   3.958   4.573  -1.563
  239   3HB   ALA  31          3HB       ALA  31   5.721   4.615  -1.597
  240    H    ALA  32           H        ALA  32   4.435   1.017  -1.251
  241    HA   ALA  32           HA       ALA  32   1.639   0.866  -0.822
  242   1HB   ALA  32          1HB       ALA  32   2.780  -0.276  -2.670
  243   2HB   ALA  32          2HB       ALA  32   3.556  -1.356  -1.511
  244   3HB   ALA  32          3HB       ALA  32   1.803  -1.384  -1.707
  245    H    LYS  33           H        LYS  33   4.366  -0.833   0.725
  246    HA   LYS  33           HA       LYS  33   3.065  -2.498   2.431
  247   1HB   LYS  33          1HB       LYS  33   5.493  -2.431   2.221
  248   2HB   LYS  33          2HB       LYS  33   5.535  -0.866   3.018
  249   1HG   LYS  33          1HG       LYS  33   4.421  -2.071   4.994
  250   2HG   LYS  33          2HG       LYS  33   4.938  -3.553   4.188
  251   1HD   LYS  33          1HD       LYS  33   7.082  -3.251   4.768
  252   2HD   LYS  33          2HD       LYS  33   7.038  -1.530   4.376
  253   1HE   LYS  33          1HE       LYS  33   7.486  -1.880   6.748
  254   2HE   LYS  33          2HE       LYS  33   5.940  -1.068   6.507
  255   1HZ   LYS  33          1HZ       LYS  33   5.586  -3.877   6.553
  256   2HZ   LYS  33          2HZ       LYS  33   6.407  -3.376   7.946
  257   3HZ   LYS  33          3HZ       LYS  33   4.905  -2.701   7.560
  258    H    PHE  34           H        PHE  34   4.051   0.826   3.253
  259    HA   PHE  34           HA       PHE  34   2.568   0.755   5.677
  260   1HB   PHE  34          1HB       PHE  34   4.270   2.681   4.326
  261   2HB   PHE  34          2HB       PHE  34   3.099   3.359   5.436
  262    HD1  PHE  34           HD1      PHE  34   3.079   2.419   7.815
  263    HD2  PHE  34           HD2      PHE  34   6.284   1.812   5.082
  264    HE1  PHE  34           HE1      PHE  34   4.574   1.886   9.694
  265    HE2  PHE  34           HE2      PHE  34   7.785   1.277   6.957
  266    HZ   PHE  34           HZ       PHE  34   6.931   1.314   9.267
  267    H    GLU  35           H        GLU  35   1.752   1.538   2.454
  268    HA   GLU  35           HA       GLU  35  -0.286   3.416   2.942
  269   1HB   GLU  35          1HB       GLU  35   0.847   2.019   0.727
  270   2HB   GLU  35          2HB       GLU  35  -0.900   1.847   0.650
  271   1HG   GLU  35          1HG       GLU  35  -1.248   4.116   0.404
  272   2HG   GLU  35          2HG       GLU  35   0.308   4.535   1.117
  273    H    SER  36           H        SER  36  -0.484  -0.060   2.231
  274    HA   SER  36           HA       SER  36  -3.068  -0.133   3.657
  275   1HB   SER  36          1HB       SER  36  -3.736  -1.866   1.894
  276   2HB   SER  36          2HB       SER  36  -3.639  -0.194   1.344
  277    HG   SER  36           HG       SER  36  -1.241  -1.298   1.075
  278    H    ASN  37           H        ASN  37  -0.095  -1.085   4.083
  279    HA   ASN  37           HA       ASN  37   0.943  -2.842   5.123
  280   1HB   ASN  37          1HB       ASN  37  -1.848  -3.796   5.813
  281   2HB   ASN  37          2HB       ASN  37  -0.351  -4.200   6.648
  282   2HD2  ASN  37          2HD2      ASN  37   0.776  -2.452   7.733
  283   1HD2  ASN  37          1HD2      ASN  37  -0.140  -1.152   8.407
  284    H    PHE  38           H        PHE  38   0.088  -2.920   2.381
  285    HA   PHE  38           HA       PHE  38   0.272  -4.201   0.586
  286   1HB   PHE  38          1HB       PHE  38   1.086  -6.214   2.657
  287   2HB   PHE  38          2HB       PHE  38   0.888  -6.680   0.970
  288    HD1  PHE  38           HD1      PHE  38   1.916  -4.542  -0.567
  289    HD2  PHE  38           HD2      PHE  38   3.328  -6.026   3.162
  290    HE1  PHE  38           HE1      PHE  38   4.154  -3.666  -1.077
  291    HE2  PHE  38           HE2      PHE  38   5.571  -5.149   2.661
  292    HZ   PHE  38           HZ       PHE  38   5.991  -3.975   0.537
  293    H    ASN  39           H        ASN  39  -2.229  -3.841   2.150
  294    HA   ASN  39           HA       ASN  39  -3.740  -6.231   1.483
  295   1HB   ASN  39          1HB       ASN  39  -4.165  -4.916   3.592
  296   2HB   ASN  39          2HB       ASN  39  -4.776  -3.612   2.581
  297   2HD2  ASN  39          2HD2      ASN  39  -6.577  -4.263   4.207
  298   1HD2  ASN  39          1HD2      ASN  39  -7.760  -5.355   3.578
  299    H    THR  40           H        THR  40  -4.246  -6.484  -0.564
  300    HA   THR  40           HA       THR  40  -4.383  -4.329  -2.427
  301    HB   THR  40           HB       THR  40  -4.498  -5.935  -4.061
  302    HG1  THR  40           HG1      THR  40  -6.347  -7.005  -3.890
  303   1HG2  THR  40          1HG2      THR  40  -2.994  -6.700  -1.801
  304   2HG2  THR  40          2HG2      THR  40  -3.721  -8.165  -2.460
  305   3HG2  THR  40          3HG2      THR  40  -2.721  -7.137  -3.487
  306    H    GLN  41           H        GLN  41  -6.504  -5.660  -0.219
  307    HA   GLN  41           HA       GLN  41  -8.869  -4.690  -1.662
  308   1HB   GLN  41          1HB       GLN  41  -8.342  -6.932   0.196
  309   2HB   GLN  41          2HB       GLN  41  -9.889  -6.133   0.357
  310   1HG   GLN  41          1HG       GLN  41  -9.114  -6.825  -2.387
  311   2HG   GLN  41          2HG       GLN  41  -9.400  -8.190  -1.310
  312   2HE2  GLN  41          2HE2      GLN  41 -10.805  -5.918  -3.329
  313   1HE2  GLN  41          1HE2      GLN  41 -12.457  -6.161  -2.887
  314    H    ALA  42           H        ALA  42  -6.746  -3.592   0.533
  315    HA   ALA  42           HA       ALA  42  -8.372  -2.714   2.671
  316   1HB   ALA  42          1HB       ALA  42  -5.620  -2.328   1.793
  317   2HB   ALA  42          2HB       ALA  42  -6.285  -2.484   3.420
  318   3HB   ALA  42          3HB       ALA  42  -6.307  -0.920   2.604
  319    H    THR  43           H        THR  43  -9.510  -0.920   3.007
  320    HA   THR  43           HA       THR  43  -9.624   1.098   0.861
  321    HB   THR  43           HB       THR  43 -11.919   1.206   0.947
  322    HG1  THR  43           HG1      THR  43 -11.866   0.033   3.548
  323   1HG2  THR  43          1HG2      THR  43 -11.385  -1.631   1.840
  324   2HG2  THR  43          2HG2      THR  43 -12.874  -1.061   1.085
  325   3HG2  THR  43          3HG2      THR  43 -11.361  -1.039   0.180
  326    H    ASN  44           H        ASN  44  -9.416   3.215   1.523
  327    HA   ASN  44           HA       ASN  44  -9.509   3.732   4.419
  328   1HB   ASN  44          1HB       ASN  44  -7.286   4.105   2.544
  329   2HB   ASN  44          2HB       ASN  44  -7.651   5.538   3.501
  330   2HD2  ASN  44          2HD2      ASN  44  -7.669   5.316   5.818
  331   1HD2  ASN  44          1HD2      ASN  44  -6.658   4.135   6.571
  332    H    ARG  45           H        ARG  45 -11.503   4.712   4.370
  333    HA   ARG  45           HA       ARG  45 -12.283   6.648   2.457
  334   1HB   ARG  45          1HB       ARG  45 -14.067   7.196   4.182
  335   2HB   ARG  45          2HB       ARG  45 -14.025   5.537   3.602
  336   1HG   ARG  45          1HG       ARG  45 -12.377   5.922   5.959
  337   2HG   ARG  45          2HG       ARG  45 -14.066   6.353   6.233
  338   1HD   ARG  45          1HD       ARG  45 -14.155   3.981   4.773
  339   2HD   ARG  45          2HD       ARG  45 -12.851   3.748   5.936
  340    HE   ARG  45           HE       ARG  45 -14.469   4.254   7.692
  341   1HH1  ARG  45          1HH1      ARG  45 -15.710   3.455   4.536
  342   2HH1  ARG  45          2HH1      ARG  45 -17.255   2.946   5.130
  343   1HH2  ARG  45          1HH2      ARG  45 -16.500   3.586   8.484
  344   2HH2  ARG  45          2HH2      ARG  45 -17.705   3.022   7.374
  345    H    ASN  46           H        ASN  46 -11.844   8.748   2.308
  346    HA   ASN  46           HA       ASN  46 -10.239   9.996   4.399
  347   1HB   ASN  46          1HB       ASN  46 -10.986  11.278   1.784
  348   2HB   ASN  46          2HB       ASN  46  -9.576  11.580   2.794
  349   2HD2  ASN  46          2HD2      ASN  46  -8.730   8.995   3.259
  350   1HD2  ASN  46          1HD2      ASN  46  -8.186   8.302   1.773
  351    H    THR  47           H        THR  47 -10.711  12.495   4.525
  352    HA   THR  47           HA       THR  47 -13.494  12.708   5.406
  353    HB   THR  47           HB       THR  47 -12.717  14.764   6.599
  354    HG1  THR  47           HG1      THR  47 -10.526  14.318   5.084
  355   1HG2  THR  47          1HG2      THR  47 -11.421  12.105   7.146
  356   2HG2  THR  47          2HG2      THR  47 -11.221  13.482   8.230
  357   3HG2  THR  47          3HG2      THR  47 -12.829  12.824   7.927
  358    H    ASP  48           H        ASP  48 -12.097  13.201   2.601
  359    HA   ASP  48           HA       ASP  48 -13.412  15.791   2.115
  360   1HB   ASP  48          1HB       ASP  48 -11.878  16.213   0.341
  361   2HB   ASP  48          2HB       ASP  48 -10.925  15.677   1.720
  362    H    GLY  49           H        GLY  49 -13.855  12.564   1.737
  363   1HA   GLY  49          1HA       GLY  49 -15.540  13.000  -0.649
  364   2HA   GLY  49          2HA       GLY  49 -15.947  11.904   0.659
  365    H    SER  50           H        SER  50 -12.692  12.049  -0.587
  366    HA   SER  50           HA       SER  50 -13.073   9.880  -2.439
  367   1HB   SER  50          1HB       SER  50 -10.419   9.965  -2.280
  368   2HB   SER  50          2HB       SER  50 -11.330  11.169  -3.190
  369    HG   SER  50           HG       SER  50  -9.706  11.559  -1.137
  370    H    THR  51           H        THR  51 -11.081   8.159  -2.164
  371    HA   THR  51           HA       THR  51 -10.789   7.167   0.515
  372    HB   THR  51           HB       THR  51 -12.324   5.409  -1.395
  373    HG1  THR  51           HG1      THR  51 -14.149   5.929  -0.037
  374   1HG2  THR  51          1HG2      THR  51 -10.932   4.839   0.935
  375   2HG2  THR  51          2HG2      THR  51 -12.616   4.927   1.449
  376   3HG2  THR  51          3HG2      THR  51 -12.144   3.819   0.162
  377    H    ASP  52           H        ASP  52  -9.519   5.088   0.521
  378    HA   ASP  52           HA       ASP  52  -7.804   4.934  -1.873
  379   1HB   ASP  52          1HB       ASP  52  -7.082   4.348   1.009
  380   2HB   ASP  52          2HB       ASP  52  -5.995   4.215  -0.371
  381    H    TYR  53           H        TYR  53  -9.077   3.371  -2.871
  382    HA   TYR  53           HA       TYR  53  -9.427   0.828  -1.479
  383   1HB   TYR  53          1HB       TYR  53 -10.438   1.749  -4.174
  384   2HB   TYR  53          2HB       TYR  53 -10.793   0.194  -3.438
  385    HD1  TYR  53           HD1      TYR  53 -11.965   0.277  -1.110
  386    HD2  TYR  53           HD2      TYR  53 -11.894   3.520  -3.859
  387    HE1  TYR  53           HE1      TYR  53 -13.956   1.230  -0.027
  388    HE2  TYR  53           HE2      TYR  53 -13.888   4.480  -2.789
  389    HH   TYR  53           HH       TYR  53 -15.731   2.739  -0.438
  390    H    GLY  54           H        GLY  54  -7.009   0.382  -1.577
  391   1HA   GLY  54          1HA       GLY  54  -5.837  -0.006  -4.145
  392   2HA   GLY  54          2HA       GLY  54  -6.418  -1.523  -3.480
  393    H    ILE  55           H        ILE  55  -4.143  -2.151  -3.594
  394    HA   ILE  55           HA       ILE  55  -2.862  -1.923  -1.065
  395    HB   ILE  55           HB       ILE  55  -2.556  -3.868  -2.656
  396   1HG1  ILE  55          1HG1      ILE  55   0.074  -2.583  -1.920
  397   2HG1  ILE  55          2HG1      ILE  55  -1.010  -3.279  -0.719
  398   1HG2  ILE  55          1HG2      ILE  55  -0.866  -1.855  -4.129
  399   2HG2  ILE  55          2HG2      ILE  55  -0.809  -3.596  -4.406
  400   3HG2  ILE  55          3HG2      ILE  55  -2.292  -2.700  -4.731
  401   1HD1  ILE  55          1HD1      ILE  55  -0.293  -4.996  -3.009
  402   2HD1  ILE  55          2HD1      ILE  55   0.982  -4.637  -1.843
  403   3HD1  ILE  55          3HD1      ILE  55  -0.515  -5.400  -1.307
  404    H    LEU  56           H        LEU  56  -2.840  -0.160  -4.004
  405    HA   LEU  56           HA       LEU  56  -0.616   1.531  -3.085
  406   1HB   LEU  56          1HB       LEU  56  -1.188   0.423  -5.636
  407   2HB   LEU  56          2HB       LEU  56  -1.468   2.148  -5.762
  408    HG   LEU  56           HG       LEU  56   0.771   1.886  -6.416
  409   1HD1  LEU  56          1HD1      LEU  56   0.204   3.389  -4.242
  410   2HD1  LEU  56          2HD1      LEU  56   1.491   2.365  -3.607
  411   3HD1  LEU  56          3HD1      LEU  56   1.775   3.349  -5.042
  412   1HD2  LEU  56          1HD2      LEU  56   0.937  -0.107  -4.174
  413   2HD2  LEU  56          2HD2      LEU  56   1.244  -0.346  -5.894
  414   3HD2  LEU  56          3HD2      LEU  56   2.380   0.584  -4.917
  415    H    GLN  57           H        GLN  57  -3.761   1.322  -2.710
  416    HA   GLN  57           HA       GLN  57  -5.379   2.755  -2.089
  417   1HB   GLN  57          1HB       GLN  57  -3.255   4.861  -2.507
  418   2HB   GLN  57          2HB       GLN  57  -4.831   5.158  -1.785
  419   1HG   GLN  57          1HG       GLN  57  -4.168   3.333  -0.101
  420   2HG   GLN  57          2HG       GLN  57  -2.528   3.589  -0.697
  421   2HE2  GLN  57          2HE2      GLN  57  -2.262   6.188  -1.008
  422   1HE2  GLN  57          1HE2      GLN  57  -2.533   7.047   0.466
  423    H    ILE  58           H        ILE  58  -6.348   2.007  -4.209
  424    HA   ILE  58           HA       ILE  58  -6.164   3.902  -6.378
  425    HB   ILE  58           HB       ILE  58  -8.148   1.648  -6.196
  426   1HG1  ILE  58          1HG1      ILE  58  -6.054   0.599  -5.677
  427   2HG1  ILE  58          2HG1      ILE  58  -6.407   0.255  -7.367
  428   1HG2  ILE  58          1HG2      ILE  58  -6.808   3.102  -8.467
  429   2HG2  ILE  58          2HG2      ILE  58  -7.776   1.642  -8.674
  430   3HG2  ILE  58          3HG2      ILE  58  -8.519   3.109  -8.038
  431   1HD1  ILE  58          1HD1      ILE  58  -4.889   2.637  -7.284
  432   2HD1  ILE  58          2HD1      ILE  58  -4.102   1.458  -6.235
  433   3HD1  ILE  58          3HD1      ILE  58  -4.427   1.059  -7.922
  434    H    ASN  59           H        ASN  59  -7.042   5.824  -5.740
  435    HA   ASN  59           HA       ASN  59  -9.383   6.088  -4.212
  436   1HB   ASN  59          1HB       ASN  59  -7.683   7.876  -4.527
  437   2HB   ASN  59          2HB       ASN  59  -8.207   8.049  -6.199
  438   2HD2  ASN  59          2HD2      ASN  59  -8.315  10.276  -4.916
  439   1HD2  ASN  59          1HD2      ASN  59  -9.911  10.693  -4.401
  440    H    SER  60           H        SER  60 -11.159   4.999  -4.942
  441    HA   SER  60           HA       SER  60 -11.855   4.717  -7.653
  442   1HB   SER  60          1HB       SER  60 -13.740   3.594  -6.892
  443   2HB   SER  60          2HB       SER  60 -12.644   3.411  -5.523
  444    HG   SER  60           HG       SER  60 -13.693   5.287  -4.615
  445    H    ARG  61           H        ARG  61 -12.153   7.398  -5.555
  446    HA   ARG  61           HA       ARG  61 -14.319   8.546  -7.166
  447   1HB   ARG  61          1HB       ARG  61 -14.173   8.531  -4.530
  448   2HB   ARG  61          2HB       ARG  61 -13.151   9.937  -4.794
  449   1HG   ARG  61          1HG       ARG  61 -15.152  10.706  -6.310
  450   2HG   ARG  61          2HG       ARG  61 -16.059   9.583  -5.296
  451   1HD   ARG  61          1HD       ARG  61 -16.205  11.756  -4.309
  452   2HD   ARG  61          2HD       ARG  61 -15.155  10.764  -3.298
  453    HE   ARG  61           HE       ARG  61 -13.315  11.948  -4.707
  454   1HH1  ARG  61          1HH1      ARG  61 -16.279  13.352  -3.529
  455   2HH1  ARG  61          2HH1      ARG  61 -15.625  14.952  -3.414
  456   1HH2  ARG  61          1HH2      ARG  61 -12.447  14.050  -4.559
  457   2HH2  ARG  61          2HH2      ARG  61 -13.448  15.349  -4.000
  458    H    TRP  62           H        TRP  62 -11.472   8.221  -8.006
  459    HA   TRP  62           HA       TRP  62 -11.170  10.858  -9.116
  460   1HB   TRP  62          1HB       TRP  62 -10.043  10.706  -6.727
  461   2HB   TRP  62          2HB       TRP  62  -8.737   9.969  -7.649
  462    HD1  TRP  62           HD1      TRP  62  -7.272  11.541  -9.167
  463    HE1  TRP  62           HE1      TRP  62  -7.126  14.096  -9.439
  464    HE3  TRP  62           HE3      TRP  62 -11.542  12.868  -6.688
  465    HZ2  TRP  62           HZ2      TRP  62  -8.621  16.373  -8.700
  466    HZ3  TRP  62           HZ3      TRP  62 -12.112  15.255  -6.516
  467    HH2  TRP  62           HH2      TRP  62 -10.681  16.970  -7.500
  468    H    TRP  63           H        TRP  63 -10.489   7.504  -9.189
  469    HA   TRP  63           HA       TRP  63  -9.002   7.931 -11.683
  470   1HB   TRP  63          1HB       TRP  63  -8.256   5.885  -9.589
  471   2HB   TRP  63          2HB       TRP  63  -7.511   6.049 -11.172
  472    HD1  TRP  63           HD1      TRP  63  -6.676   6.796  -7.794
  473    HE1  TRP  63           HE1      TRP  63  -5.043   8.778  -7.606
  474    HE3  TRP  63           HE3      TRP  63  -7.281   8.773 -12.454
  475    HZ2  TRP  63           HZ2      TRP  63  -4.131  10.906  -9.232
  476    HZ3  TRP  63           HZ3      TRP  63  -6.021  10.780 -13.062
  477    HH2  TRP  63           HH2      TRP  63  -4.467  11.830 -11.488
  478    H    CYS  64           H        CYS  64 -11.549   6.301 -10.093
  479    HA   CYS  64           HA       CYS  64 -11.876   4.677 -12.506
  480   1HB   CYS  64          1HB       CYS  64 -11.984   2.636 -11.447
  481   2HB   CYS  64          2HB       CYS  64 -10.821   3.442 -10.401
  482    H    ASN  65           H        ASN  65 -13.964   3.988 -12.988
  483    HA   ASN  65           HA       ASN  65 -16.032   5.692 -11.829
  484   1HB   ASN  65          1HB       ASN  65 -15.660   5.241 -14.360
  485   2HB   ASN  65          2HB       ASN  65 -16.462   3.706 -14.049
  486   2HD2  ASN  65          2HD2      ASN  65 -16.977   6.684 -15.171
  487   1HD2  ASN  65          1HD2      ASN  65 -18.644   6.891 -14.769
  488    H    ASP  66           H        ASP  66 -16.858   4.919  -9.980
  489    HA   ASP  66           HA       ASP  66 -17.288   2.037  -9.709
  490   1HB   ASP  66          1HB       ASP  66 -17.404   2.373  -7.358
  491   2HB   ASP  66          2HB       ASP  66 -16.054   3.342  -7.940
  492    H    GLY  67           H        GLY  67 -19.034   4.949 -10.254
  493   1HA   GLY  67          1HA       GLY  67 -21.474   3.547 -10.602
  494   2HA   GLY  67          2HA       GLY  67 -21.267   5.289 -10.650
  495    H    ARG  68           H        ARG  68 -20.111   3.954  -7.758
  496    HA   ARG  68           HA       ARG  68 -22.685   4.210  -6.400
  497   1HB   ARG  68          1HB       ARG  68 -20.189   2.764  -5.899
  498   2HB   ARG  68          2HB       ARG  68 -20.839   3.549  -4.466
  499   1HG   ARG  68          1HG       ARG  68 -22.484   2.062  -4.271
  500   2HG   ARG  68          2HG       ARG  68 -22.870   2.136  -5.991
  501   1HD   ARG  68          1HD       ARG  68 -20.348   0.819  -5.590
  502   2HD   ARG  68          2HD       ARG  68 -21.596   0.057  -4.606
  503    HE   ARG  68           HE       ARG  68 -21.698   0.360  -7.534
  504   1HH1  ARG  68          1HH1      ARG  68 -22.670  -1.228  -4.590
  505   2HH1  ARG  68          2HH1      ARG  68 -23.552  -2.478  -5.403
  506   1HH2  ARG  68          1HH2      ARG  68 -22.857  -1.280  -8.614
  507   2HH2  ARG  68          2HH2      ARG  68 -23.657  -2.508  -7.690
  508    H    THR  69           H        THR  69 -20.115   6.154  -7.187
  509    HA   THR  69           HA       THR  69 -20.730   7.978  -4.961
  510    HB   THR  69           HB       THR  69 -17.976   7.809  -6.169
  511    HG1  THR  69           HG1      THR  69 -18.681   6.640  -3.685
  512   1HG2  THR  69          1HG2      THR  69 -18.753   9.852  -4.895
  513   2HG2  THR  69          2HG2      THR  69 -18.843   8.821  -3.466
  514   3HG2  THR  69          3HG2      THR  69 -17.297   9.073  -4.276
  515    HA   PRO  70           HA       PRO  70 -21.823  10.214  -8.813
  516   1HB   PRO  70          1HB       PRO  70 -22.834  12.059  -6.707
  517   2HB   PRO  70          2HB       PRO  70 -23.635  11.470  -8.168
  518   1HG   PRO  70          1HG       PRO  70 -24.302  10.513  -5.775
  519   2HG   PRO  70          2HG       PRO  70 -24.222   9.450  -7.192
  520   1HD   PRO  70          1HD       PRO  70 -22.289   9.750  -4.934
  521   2HD   PRO  70          2HD       PRO  70 -22.776   8.289  -5.818
  522    H    GLY  71           H        GLY  71 -19.911  10.998  -9.568
  523   1HA   GLY  71          1HA       GLY  71 -18.576  13.112  -8.011
  524   2HA   GLY  71          2HA       GLY  71 -19.017  13.407  -9.686
  525    H    SER  72           H        SER  72 -18.288  10.244  -9.643
  526    HA   SER  72           HA       SER  72 -15.511  10.096  -9.391
  527   1HB   SER  72          1HB       SER  72 -17.129   8.458 -11.346
  528   2HB   SER  72          2HB       SER  72 -15.651   7.993 -10.505
  529    HG   SER  72           HG       SER  72 -17.356   8.625  -8.632
  530    H    ARG  73           H        ARG  73 -13.969  11.075 -10.509
  531    HA   ARG  73           HA       ARG  73 -14.487  12.503 -12.909
  532   1HB   ARG  73          1HB       ARG  73 -12.291  12.189 -11.039
  533   2HB   ARG  73          2HB       ARG  73 -11.717  12.217 -12.700
  534   1HG   ARG  73          1HG       ARG  73 -12.248  14.387 -12.993
  535   2HG   ARG  73          2HG       ARG  73 -13.693  14.283 -11.985
  536   1HD   ARG  73          1HD       ARG  73 -12.534  14.678 -10.044
  537   2HD   ARG  73          2HD       ARG  73 -11.024  14.038 -10.689
  538    HE   ARG  73           HE       ARG  73 -10.652  16.102 -11.786
  539   1HH1  ARG  73          1HH1      ARG  73 -13.496  16.095  -9.772
  540   2HH1  ARG  73          2HH1      ARG  73 -13.603  17.822  -9.696
  541   1HH2  ARG  73          1HH2      ARG  73 -10.786  18.376 -11.692
  542   2HH2  ARG  73          2HH2      ARG  73 -12.064  19.119 -10.788
  543    H    ASN  74           H        ASN  74 -12.840   9.454 -12.193
  544    HA   ASN  74           HA       ASN  74 -12.287   7.663 -13.506
  545   1HB   ASN  74          1HB       ASN  74 -14.697   8.324 -14.432
  546   2HB   ASN  74          2HB       ASN  74 -13.769   8.768 -15.861
  547   2HD2  ASN  74          2HD2      ASN  74 -14.535   7.167 -17.162
  548   1HD2  ASN  74          1HD2      ASN  74 -14.189   5.492 -16.917
  549    H    LEU  75           H        LEU  75 -10.618   9.891 -13.346
  550    HA   LEU  75           HA       LEU  75  -9.593  10.930 -15.714
  551   1HB   LEU  75          1HB       LEU  75  -8.698  10.459 -12.947
  552   2HB   LEU  75          2HB       LEU  75  -7.429  10.726 -14.121
  553    HG   LEU  75           HG       LEU  75  -9.750  12.590 -13.542
  554   1HD1  LEU  75          1HD1      LEU  75  -6.851  12.708 -12.728
  555   2HD1  LEU  75          2HD1      LEU  75  -7.970  14.067 -12.605
  556   3HD1  LEU  75          3HD1      LEU  75  -8.263  12.597 -11.675
  557   1HD2  LEU  75          1HD2      LEU  75  -7.745  12.508 -15.672
  558   2HD2  LEU  75          2HD2      LEU  75  -9.281  13.371 -15.589
  559   3HD2  LEU  75          3HD2      LEU  75  -7.840  14.058 -14.837
  560    H    CYS  76           H        CYS  76  -9.072   8.001 -14.032
  561    HA   CYS  76           HA       CYS  76  -6.944   7.117 -15.799
  562   1HB   CYS  76          1HB       CYS  76  -7.057   6.996 -13.238
  563   2HB   CYS  76          2HB       CYS  76  -8.145   5.643 -13.493
  564    H    ASN  77           H        ASN  77 -10.208   7.149 -15.690
  565    HA   ASN  77           HA       ASN  77 -11.950   5.815 -16.485
  566   1HB   ASN  77          1HB       ASN  77 -10.355   6.744 -18.518
  567   2HB   ASN  77          2HB       ASN  77 -10.369   5.014 -18.845
  568   2HD2  ASN  77          2HD2      ASN  77 -11.975   7.901 -19.278
  569   1HD2  ASN  77          1HD2      ASN  77 -13.493   7.282 -19.822
  570    H    ILE  78           H        ILE  78 -10.785   4.467 -14.641
  571    HA   ILE  78           HA       ILE  78 -10.130   1.857 -15.708
  572    HB   ILE  78           HB       ILE  78  -8.690   3.499 -14.128
  573   1HG1  ILE  78          1HG1      ILE  78  -7.832   0.865 -13.728
  574   2HG1  ILE  78          2HG1      ILE  78  -8.584   0.967 -15.316
  575   1HG2  ILE  78          1HG2      ILE  78  -9.973   1.418 -12.394
  576   2HG2  ILE  78          2HG2      ILE  78  -8.435   2.186 -11.997
  577   3HG2  ILE  78          3HG2      ILE  78  -9.900   3.160 -12.128
  578   1HD1  ILE  78          1HD1      ILE  78  -7.086   3.153 -15.443
  579   2HD1  ILE  78          2HD1      ILE  78  -6.105   2.222 -14.311
  580   3HD1  ILE  78          3HD1      ILE  78  -6.482   1.563 -15.902
  581    HA   PRO  79           HA       PRO  79 -13.423   0.147 -13.224
  582   1HB   PRO  79          1HB       PRO  79 -12.897  -2.446 -13.734
  583   2HB   PRO  79          2HB       PRO  79 -13.504  -1.361 -14.988
  584   1HG   PRO  79          1HG       PRO  79 -10.832  -2.539 -14.676
  585   2HG   PRO  79          2HG       PRO  79 -11.588  -1.838 -16.114
  586   1HD   PRO  79          1HD       PRO  79  -9.706  -0.615 -14.272
  587   2HD   PRO  79          2HD       PRO  79 -10.343   0.031 -15.798
  588    H    CYS  80           H        CYS  80 -13.158   0.365 -11.033
  589    HA   CYS  80           HA       CYS  80 -10.873  -0.311  -9.606
  590   1HB   CYS  80          1HB       CYS  80 -13.667   0.379  -8.899
  591   2HB   CYS  80          2HB       CYS  80 -12.693  -0.386  -7.646
  592    H    SER  81           H        SER  81 -13.863  -2.228 -10.007
  593    HA   SER  81           HA       SER  81 -13.159  -4.322  -8.311
  594   1HB   SER  81          1HB       SER  81 -14.764  -5.684  -9.629
  595   2HB   SER  81          2HB       SER  81 -15.410  -4.097  -9.209
  596    HG   SER  81           HG       SER  81 -15.834  -4.156 -11.303
  597    H    ALA  82           H        ALA  82 -11.917  -3.534 -11.453
  598    HA   ALA  82           HA       ALA  82 -10.912  -6.175 -12.013
  599   1HB   ALA  82          1HB       ALA  82 -11.011  -3.597 -13.387
  600   2HB   ALA  82          2HB       ALA  82  -9.537  -4.518 -13.689
  601   3HB   ALA  82          3HB       ALA  82 -11.112  -5.235 -14.033
  602    H    LEU  83           H        LEU  83  -9.848  -3.482 -10.226
  603    HA   LEU  83           HA       LEU  83  -7.067  -4.423 -10.256
  604   1HB   LEU  83          1HB       LEU  83  -6.758  -2.288  -8.774
  605   2HB   LEU  83          2HB       LEU  83  -6.867  -2.163 -10.515
  606    HG   LEU  83           HG       LEU  83  -9.490  -1.870  -9.739
  607   1HD1  LEU  83          1HD1      LEU  83  -8.203  -1.643  -7.380
  608   2HD1  LEU  83          2HD1      LEU  83  -8.166   0.031  -7.932
  609   3HD1  LEU  83          3HD1      LEU  83  -9.708  -0.810  -7.769
  610   1HD2  LEU  83          1HD2      LEU  83  -7.383  -0.316 -10.895
  611   2HD2  LEU  83          2HD2      LEU  83  -9.123  -0.206 -11.157
  612   3HD2  LEU  83          3HD2      LEU  83  -8.370   0.700  -9.845
  613    H    LEU  84           H        LEU  84  -9.846  -4.874  -8.540
  614    HA   LEU  84           HA       LEU  84  -8.370  -5.486  -6.068
  615   1HB   LEU  84          1HB       LEU  84 -11.337  -5.056  -6.238
  616   2HB   LEU  84          2HB       LEU  84 -10.306  -4.996  -4.820
  617    HG   LEU  84           HG       LEU  84  -9.884  -3.035  -7.026
  618   1HD1  LEU  84          1HD1      LEU  84 -12.057  -2.941  -4.949
  619   2HD1  LEU  84          2HD1      LEU  84 -11.430  -1.495  -5.744
  620   3HD1  LEU  84          3HD1      LEU  84 -12.204  -2.762  -6.698
  621   1HD2  LEU  84          1HD2      LEU  84  -8.619  -3.506  -4.646
  622   2HD2  LEU  84          2HD2      LEU  84  -8.560  -1.996  -5.555
  623   3HD2  LEU  84          3HD2      LEU  84  -9.716  -2.187  -4.237
  624    H    SER  85           H        SER  85  -8.375  -7.243  -8.209
  625    HA   SER  85           HA       SER  85 -10.091  -9.409  -7.198
  626   1HB   SER  85          1HB       SER  85 -10.121  -8.397  -9.768
  627   2HB   SER  85          2HB       SER  85  -9.077  -9.810  -9.917
  628    HG   SER  85           HG       SER  85 -11.599  -9.904  -8.636
  629    H    SER  86           H        SER  86  -7.648  -8.744  -6.159
  630    HA   SER  86           HA       SER  86  -5.792  -9.760  -5.297
  631   1HB   SER  86          1HB       SER  86  -7.247 -12.001  -6.525
  632   2HB   SER  86          2HB       SER  86  -5.501 -12.240  -6.478
  633    HG   SER  86           HG       SER  86  -7.327 -11.983  -4.377
  634    H    ASP  87           H        ASP  87  -6.090  -8.311  -7.799
  635    HA   ASP  87           HA       ASP  87  -3.558  -9.052  -9.094
  636   1HB   ASP  87          1HB       ASP  87  -5.702  -9.635 -10.319
  637   2HB   ASP  87          2HB       ASP  87  -5.983  -7.906 -10.456
  638    H    ILE  88           H        ILE  88  -2.097  -7.406  -9.004
  639    HA   ILE  88           HA       ILE  88  -3.060  -4.745  -8.326
  640    HB   ILE  88           HB       ILE  88  -0.441  -4.345  -8.404
  641   1HG1  ILE  88          1HG1      ILE  88  -0.336  -7.132  -7.384
  642   2HG1  ILE  88          2HG1      ILE  88  -0.381  -6.930  -9.132
  643   1HG2  ILE  88          1HG2      ILE  88  -2.145  -5.545  -6.268
  644   2HG2  ILE  88          2HG2      ILE  88  -0.440  -5.212  -5.966
  645   3HG2  ILE  88          3HG2      ILE  88  -1.528  -3.900  -6.420
  646   1HD1  ILE  88          1HD1      ILE  88   1.538  -5.173  -7.826
  647   2HD1  ILE  88          2HD1      ILE  88   1.863  -6.889  -7.572
  648   3HD1  ILE  88          3HD1      ILE  88   1.738  -6.248  -9.210
  649    H    THR  89           H        THR  89  -2.339  -6.483 -11.099
  650    HA   THR  89           HA       THR  89  -0.892  -4.870 -12.747
  651    HB   THR  89           HB       THR  89  -3.448  -6.117 -13.731
  652    HG1  THR  89           HG1      THR  89  -1.552  -7.902 -13.935
  653   1HG2  THR  89          1HG2      THR  89  -0.713  -5.632 -14.900
  654   2HG2  THR  89          2HG2      THR  89  -1.904  -6.693 -15.654
  655   3HG2  THR  89          3HG2      THR  89  -2.259  -4.978 -15.442
  656    H    ALA  90           H        ALA  90  -4.435  -4.642 -12.327
  657    HA   ALA  90           HA       ALA  90  -4.741  -2.373 -13.890
  658   1HB   ALA  90          1HB       ALA  90  -6.424  -3.808 -11.926
  659   2HB   ALA  90          2HB       ALA  90  -6.906  -2.178 -12.396
  660   3HB   ALA  90          3HB       ALA  90  -6.732  -3.432 -13.622
  661    H    SER  91           H        SER  91  -4.310  -2.740 -10.390
  662    HA   SER  91           HA       SER  91  -4.649  -0.024  -9.711
  663   1HB   SER  91          1HB       SER  91  -3.162  -2.271  -8.346
  664   2HB   SER  91          2HB       SER  91  -3.329  -0.663  -7.640
  665    HG   SER  91           HG       SER  91  -4.960  -2.115  -6.926
  666    H    VAL  92           H        VAL  92  -1.907  -1.853 -10.812
  667    HA   VAL  92           HA       VAL  92  -0.051   0.258 -10.272
  668    HB   VAL  92           HB       VAL  92   0.291  -2.230 -11.941
  669   1HG1  VAL  92          1HG1      VAL  92   2.174   0.057 -11.397
  670   2HG1  VAL  92          2HG1      VAL  92   2.759  -1.550 -11.826
  671   3HG1  VAL  92          3HG1      VAL  92   1.734  -0.656 -12.948
  672   1HG2  VAL  92          1HG2      VAL  92   0.551  -1.626  -9.136
  673   2HG2  VAL  92          2HG2      VAL  92   0.680  -3.179  -9.962
  674   3HG2  VAL  92          3HG2      VAL  92   2.099  -2.144  -9.803
  675    H    ASN  93           H        ASN  93  -1.457  -1.057 -13.284
  676    HA   ASN  93           HA       ASN  93  -0.303   0.532 -15.091
  677   1HB   ASN  93          1HB       ASN  93  -1.744  -0.508 -16.398
  678   2HB   ASN  93          2HB       ASN  93  -2.560  -1.083 -14.968
  679   2HD2  ASN  93          2HD2      ASN  93  -2.404   1.642 -17.193
  680   1HD2  ASN  93          1HD2      ASN  93  -4.067   2.087 -17.050
  681    H    CYS  94           H        CYS  94  -2.978   1.346 -12.982
  682    HA   CYS  94           HA       CYS  94  -3.441   3.939 -13.997
  683   1HB   CYS  94          1HB       CYS  94  -4.916   2.499 -12.431
  684   2HB   CYS  94          2HB       CYS  94  -3.935   3.174 -11.134
  685    H    ALA  95           H        ALA  95  -1.502   2.763 -11.233
  686    HA   ALA  95           HA       ALA  95  -0.580   5.359 -10.506
  687   1HB   ALA  95          1HB       ALA  95  -0.098   4.175  -8.718
  688   2HB   ALA  95          2HB       ALA  95   1.347   3.647  -9.581
  689   3HB   ALA  95          3HB       ALA  95  -0.113   2.655  -9.615
  690    H    LYS  96           H        LYS  96   0.720   2.825 -12.600
  691    HA   LYS  96           HA       LYS  96   3.246   3.791 -13.093
  692   1HB   LYS  96          1HB       LYS  96   2.141   1.686 -14.048
  693   2HB   LYS  96          2HB       LYS  96   1.429   2.735 -15.265
  694   1HG   LYS  96          1HG       LYS  96   3.858   3.476 -15.721
  695   2HG   LYS  96          2HG       LYS  96   4.297   2.004 -14.852
  696   1HD   LYS  96          1HD       LYS  96   2.365   1.119 -16.585
  697   2HD   LYS  96          2HD       LYS  96   3.202   2.344 -17.540
  698   1HE   LYS  96          1HE       LYS  96   4.921   0.978 -17.871
  699   2HE   LYS  96          2HE       LYS  96   5.116   0.743 -16.134
  700   1HZ   LYS  96          1HZ       LYS  96   3.261  -0.925 -16.324
  701   2HZ   LYS  96          2HZ       LYS  96   3.439  -0.827 -18.003
  702   3HZ   LYS  96          3HZ       LYS  96   4.724  -1.371 -17.047
  703    H    LYS  97           H        LYS  97   0.125   4.723 -14.126
  704    HA   LYS  97           HA       LYS  97   0.972   6.836 -15.925
  705   1HB   LYS  97          1HB       LYS  97  -1.182   5.475 -16.165
  706   2HB   LYS  97          2HB       LYS  97  -1.811   6.432 -14.832
  707   1HG   LYS  97          1HG       LYS  97  -1.150   8.463 -16.283
  708   2HG   LYS  97          2HG       LYS  97  -1.109   7.295 -17.605
  709   1HD   LYS  97          1HD       LYS  97  -3.407   6.717 -17.251
  710   2HD   LYS  97          2HD       LYS  97  -3.471   7.679 -15.773
  711   1HE   LYS  97          1HE       LYS  97  -2.649   9.535 -17.574
  712   2HE   LYS  97          2HE       LYS  97  -3.667   8.509 -18.584
  713   1HZ   LYS  97          1HZ       LYS  97  -4.674   9.398 -15.972
  714   2HZ   LYS  97          2HZ       LYS  97  -4.694  10.481 -17.271
  715   3HZ   LYS  97          3HZ       LYS  97  -5.531   9.015 -17.379
  716    H    ILE  98           H        ILE  98  -0.128   6.461 -12.621
  717    HA   ILE  98           HA       ILE  98  -0.596   9.145 -12.004
  718    HB   ILE  98           HB       ILE  98   0.304   6.900 -10.218
  719   1HG1  ILE  98          1HG1      ILE  98  -2.392   8.242 -10.538
  720   2HG1  ILE  98          2HG1      ILE  98  -1.948   6.706 -11.276
  721   1HG2  ILE  98          1HG2      ILE  98   0.179   9.736  -9.701
  722   2HG2  ILE  98          2HG2      ILE  98  -0.953   8.856  -8.673
  723   3HG2  ILE  98          3HG2      ILE  98   0.759   8.431  -8.664
  724   1HD1  ILE  98          1HD1      ILE  98  -1.465   5.941  -8.870
  725   2HD1  ILE  98          2HD1      ILE  98  -2.417   7.347  -8.395
  726   3HD1  ILE  98          3HD1      ILE  98  -3.142   6.087  -9.393
  727    H    VAL  99           H        VAL  99   2.279   7.165 -11.573
  728    HA   VAL  99           HA       VAL  99   3.933   9.306 -10.701
  729    HB   VAL  99           HB       VAL  99   4.194   6.753 -10.308
  730   1HG1  VAL  99          1HG1      VAL  99   4.401   6.262 -12.758
  731   2HG1  VAL  99          2HG1      VAL  99   5.974   7.057 -12.715
  732   3HG1  VAL  99          3HG1      VAL  99   5.694   5.603 -11.758
  733   1HG2  VAL  99          1HG2      VAL  99   6.370   8.772 -10.680
  734   2HG2  VAL  99          2HG2      VAL  99   5.643   8.180  -9.186
  735   3HG2  VAL  99          3HG2      VAL  99   6.728   7.141 -10.111
  736    H    SER 100           H        SER 100   3.040   8.063 -13.809
  737    HA   SER 100           HA       SER 100   5.281   9.309 -15.172
  738   1HB   SER 100          1HB       SER 100   3.016   7.556 -15.943
  739   2HB   SER 100          2HB       SER 100   3.581   8.679 -17.178
  740    HG   SER 100           HG       SER 100   5.411   7.097 -15.738
  741    H    ASP 101           H        ASP 101   2.385  10.286 -13.870
  742    HA   ASP 101           HA       ASP 101   1.928  12.429 -15.809
  743   1HB   ASP 101          1HB       ASP 101   0.131  10.903 -14.512
  744   2HB   ASP 101          2HB       ASP 101   0.255  12.232 -13.364
  745    H    GLY 102           H        GLY 102   3.763  11.918 -13.095
  746   1HA   GLY 102          1HA       GLY 102   3.682  14.788 -12.394
  747   2HA   GLY 102          2HA       GLY 102   5.179  13.877 -12.520
  748    H    ASN 103           H        ASN 103   2.331  12.467 -11.092
  749    HA   ASN 103           HA       ASN 103   3.037  13.156  -8.393
  750   1HB   ASN 103          1HB       ASN 103   0.934  11.436  -9.663
  751   2HB   ASN 103          2HB       ASN 103   1.238  11.311  -7.934
  752   2HD2  ASN 103          2HD2      ASN 103   1.537  13.675  -6.971
  753   1HD2  ASN 103          1HD2      ASN 103   0.224  14.735  -7.339
  754    H    GLY 104           H        GLY 104   5.044  12.370  -7.897
  755   1HA   GLY 104          1HA       GLY 104   6.719  10.822  -7.502
  756   2HA   GLY 104          2HA       GLY 104   5.835   9.674  -8.495
  757    H    MET 105           H        MET 105   7.190   9.309  -5.898
  758    HA   MET 105           HA       MET 105   5.200   7.724  -4.620
  759   1HB   MET 105          1HB       MET 105   7.748   8.461  -3.244
  760   2HB   MET 105          2HB       MET 105   6.918   6.913  -3.297
  761   1HG   MET 105          1HG       MET 105   8.461   8.150  -5.565
  762   2HG   MET 105          2HG       MET 105   9.040   6.868  -4.503
  763   1HE   MET 105          1HE       MET 105   6.967   5.160  -3.907
  764   2HE   MET 105          2HE       MET 105   5.484   5.508  -4.797
  765   3HE   MET 105          3HE       MET 105   6.440   4.080  -5.197
  766    H    ASN 106           H        ASN 106   5.953  10.943  -4.619
  767    HA   ASN 106           HA       ASN 106   5.492  11.627  -1.907
  768   1HB   ASN 106          1HB       ASN 106   5.853  13.024  -4.497
  769   2HB   ASN 106          2HB       ASN 106   5.020  13.907  -3.236
  770   2HD2  ASN 106          2HD2      ASN 106   7.934  12.023  -3.857
  771   1HD2  ASN 106          1HD2      ASN 106   8.958  12.919  -2.792
  772    H    ALA 107           H        ALA 107   3.473  11.240  -4.758
  773    HA   ALA 107           HA       ALA 107   1.175  12.578  -3.978
  774   1HB   ALA 107          1HB       ALA 107   1.887  10.850  -6.039
  775   2HB   ALA 107          2HB       ALA 107   0.355  11.704  -5.856
  776   3HB   ALA 107          3HB       ALA 107   0.527  10.060  -5.242
  777    H    TRP 108           H        TRP 108   2.187   9.268  -3.251
  778    HA   TRP 108           HA       TRP 108  -0.104   8.771  -1.579
  779   1HB   TRP 108          1HB       TRP 108   2.436   7.169  -1.973
  780   2HB   TRP 108          2HB       TRP 108   1.002   6.610  -1.114
  781    HD1  TRP 108           HD1      TRP 108  -1.221   6.154  -2.626
  782    HE1  TRP 108           HE1      TRP 108  -1.466   5.523  -5.110
  783    HE3  TRP 108           HE3      TRP 108   3.441   7.465  -4.259
  784    HZ2  TRP 108           HZ2      TRP 108   0.112   5.577  -7.467
  785    HZ3  TRP 108           HZ3      TRP 108   3.993   7.147  -6.634
  786    HH2  TRP 108           HH2      TRP 108   2.366   6.221  -8.200
  787    H    VAL 109           H        VAL 109  -0.295   9.207   0.503
  788    HA   VAL 109           HA       VAL 109   1.665  10.716   1.877
  789    HB   VAL 109           HB       VAL 109  -0.414   9.574   3.504
  790   1HG1  VAL 109          1HG1      VAL 109   1.173  11.609   3.861
  791   2HG1  VAL 109          2HG1      VAL 109  -0.065  12.472   2.947
  792   3HG1  VAL 109          3HG1      VAL 109  -0.487  11.663   4.457
  793   1HG2  VAL 109          1HG2      VAL 109  -1.079  11.016   0.978
  794   2HG2  VAL 109          2HG2      VAL 109  -1.839   9.583   1.672
  795   3HG2  VAL 109          3HG2      VAL 109  -2.117  11.168   2.395
  796    H    ALA 110           H        ALA 110   0.941   7.308   1.903
  797    HA   ALA 110           HA       ALA 110   2.090   6.762   4.443
  798   1HB   ALA 110          1HB       ALA 110   2.315   4.566   2.565
  799   2HB   ALA 110          2HB       ALA 110   1.379   4.686   4.055
  800   3HB   ALA 110          3HB       ALA 110   0.710   5.296   2.542
  801    H    TRP 111           H        TRP 111   3.397   7.359   1.326
  802    HA   TRP 111           HA       TRP 111   5.978   6.223   2.007
  803   1HB   TRP 111          1HB       TRP 111   5.191   6.058  -0.316
  804   2HB   TRP 111          2HB       TRP 111   5.161   7.810  -0.436
  805    HD1  TRP 111           HD1      TRP 111   7.504   4.847  -0.596
  806    HE1  TRP 111           HE1      TRP 111   9.848   5.651  -1.290
  807    HE3  TRP 111           HE3      TRP 111   6.776   9.896  -0.234
  808    HZ2  TRP 111           HZ2      TRP 111  11.209   8.098  -1.638
  809    HZ3  TRP 111           HZ3      TRP 111   8.650  11.398  -0.765
  810    HH2  TRP 111           HH2      TRP 111  10.821  10.516  -1.451
  811    H    ARG 112           H        ARG 112   4.425   9.409   1.822
  812    HA   ARG 112           HA       ARG 112   6.939  10.711   2.505
  813   1HB   ARG 112          1HB       ARG 112   4.315  11.534   1.457
  814   2HB   ARG 112          2HB       ARG 112   5.072  12.664   2.570
  815   1HG   ARG 112          1HG       ARG 112   6.819  11.612   0.450
  816   2HG   ARG 112          2HG       ARG 112   5.499  12.650  -0.089
  817   1HD   ARG 112          1HD       ARG 112   7.414  13.392   2.114
  818   2HD   ARG 112          2HD       ARG 112   7.656  13.833   0.424
  819    HE   ARG 112           HE       ARG 112   5.702  15.209   0.558
  820   1HH1  ARG 112          1HH1      ARG 112   6.799  13.917   3.603
  821   2HH1  ARG 112          2HH1      ARG 112   5.964  15.102   4.551
  822   1HH2  ARG 112          1HH2      ARG 112   4.601  16.773   1.799
  823   2HH2  ARG 112          2HH2      ARG 112   4.714  16.724   3.527
  824    H    ASN 113           H        ASN 113   6.140   8.975   4.453
  825    HA   ASN 113           HA       ASN 113   5.719  10.785   6.672
  826   1HB   ASN 113          1HB       ASN 113   3.574   9.145   5.661
  827   2HB   ASN 113          2HB       ASN 113   3.996   8.646   7.297
  828   2HD2  ASN 113          2HD2      ASN 113   1.887   9.417   7.873
  829   1HD2  ASN 113          1HD2      ASN 113   1.635  11.101   8.161
  830    H    ARG 114           H        ARG 114   5.584   7.295   6.027
  831    HA   ARG 114           HA       ARG 114   7.529   6.886   8.190
  832   1HB   ARG 114          1HB       ARG 114   5.283   5.297   7.083
  833   2HB   ARG 114          2HB       ARG 114   6.677   4.407   7.670
  834   1HG   ARG 114          1HG       ARG 114   5.564   6.516   9.427
  835   2HG   ARG 114          2HG       ARG 114   4.628   5.033   9.228
  836   1HD   ARG 114          1HD       ARG 114   7.088   4.005   9.642
  837   2HD   ARG 114          2HD       ARG 114   7.204   5.487  10.588
  838    HE   ARG 114           HE       ARG 114   4.854   4.444  11.401
  839   1HH1  ARG 114          1HH1      ARG 114   8.060   3.112  11.108
  840   2HH1  ARG 114          2HH1      ARG 114   7.854   1.994  12.416
  841   1HH2  ARG 114          1HH2      ARG 114   4.574   2.977  13.123
  842   2HH2  ARG 114          2HH2      ARG 114   5.873   1.918  13.560
  843    H    CYS 115           H        CYS 115   7.642   7.320   4.995
  844    HA   CYS 115           HA       CYS 115   9.707   5.255   4.601
  845   1HB   CYS 115          1HB       CYS 115   7.787   6.515   2.663
  846   2HB   CYS 115          2HB       CYS 115   9.245   5.694   2.116
  847    H    LYS 116           H        LYS 116   8.861   8.611   3.709
  848    HA   LYS 116           HA       LYS 116  11.364   9.242   2.600
  849   1HB   LYS 116          1HB       LYS 116   9.308  10.570   2.242
  850   2HB   LYS 116          2HB       LYS 116   9.376  11.101   3.918
  851   1HG   LYS 116          1HG       LYS 116  10.835  12.705   3.442
  852   2HG   LYS 116          2HG       LYS 116  11.867  11.600   2.533
  853   1HD   LYS 116          1HD       LYS 116  10.462  11.865   0.570
  854   2HD   LYS 116          2HD       LYS 116   9.359  12.904   1.476
  855   1HE   LYS 116          1HE       LYS 116  10.803  14.276   0.125
  856   2HE   LYS 116          2HE       LYS 116  11.215  14.501   1.825
  857   1HZ   LYS 116          1HZ       LYS 116  12.941  12.651   1.323
  858   2HZ   LYS 116          2HZ       LYS 116  12.733  13.128  -0.286
  859   3HZ   LYS 116          3HZ       LYS 116  13.268  14.246   0.865
  860    H    GLY 117           H        GLY 117  12.986   8.472   3.982
  861   1HA   GLY 117          1HA       GLY 117  13.162   9.717   6.634
  862   2HA   GLY 117          2HA       GLY 117  14.469   9.988   5.493
  863    H    THR 118           H        THR 118  13.350   6.944   4.860
  864    HA   THR 118           HA       THR 118  15.241   5.734   6.766
  865    HB   THR 118           HB       THR 118  13.932   3.647   6.563
  866    HG1  THR 118           HG1      THR 118  12.877   4.830   4.483
  867   1HG2  THR 118          1HG2      THR 118  13.179   6.023   7.920
  868   2HG2  THR 118          2HG2      THR 118  11.704   5.217   7.385
  869   3HG2  THR 118          3HG2      THR 118  12.867   4.350   8.386
  870    H    ASP 119           H        ASP 119  14.873   3.146   5.285
  871    HA   ASP 119           HA       ASP 119  16.337   3.764   2.829
  872   1HB   ASP 119          1HB       ASP 119  17.709   2.991   4.903
  873   2HB   ASP 119          2HB       ASP 119  17.149   1.421   4.372
  874    H    VAL 120           H        VAL 120  14.995   3.120   1.274
  875    HA   VAL 120           HA       VAL 120  13.225   0.894   1.564
  876    HB   VAL 120           HB       VAL 120  12.664   1.316  -0.817
  877   1HG1  VAL 120          1HG1      VAL 120  11.844   2.675   1.302
  878   2HG1  VAL 120          2HG1      VAL 120  12.635   4.002   0.451
  879   3HG1  VAL 120          3HG1      VAL 120  11.334   3.104  -0.331
  880   1HG2  VAL 120          1HG2      VAL 120  15.010   2.129  -1.368
  881   2HG2  VAL 120          2HG2      VAL 120  13.671   3.030  -2.080
  882   3HG2  VAL 120          3HG2      VAL 120  14.522   3.676  -0.676
  883    H    GLN 121           H        GLN 121  16.365   1.475   0.151
  884    HA   GLN 121           HA       GLN 121  16.567  -0.780  -1.499
  885   1HB   GLN 121          1HB       GLN 121  18.191   1.283  -1.063
  886   2HB   GLN 121          2HB       GLN 121  18.959   0.142   0.029
  887   1HG   GLN 121          1HG       GLN 121  20.143  -0.211  -1.894
  888   2HG   GLN 121          2HG       GLN 121  18.895  -1.449  -2.029
  889   2HE2  GLN 121          2HE2      GLN 121  19.978   1.666  -3.170
  890   1HE2  GLN 121          1HE2      GLN 121  19.027   1.689  -4.612
  891    H    ALA 122           H        ALA 122  16.633  -0.380   1.911
  892    HA   ALA 122           HA       ALA 122  17.725  -3.031   2.409
  893   1HB   ALA 122          1HB       ALA 122  18.400  -1.171   3.862
  894   2HB   ALA 122          2HB       ALA 122  17.571  -2.438   4.767
  895   3HB   ALA 122          3HB       ALA 122  16.721  -0.950   4.352
  896    H    TRP 123           H        TRP 123  14.694  -1.450   2.034
  897    HA   TRP 123           HA       TRP 123  13.067  -3.143   3.612
  898   1HB   TRP 123          1HB       TRP 123  12.606  -1.247   1.366
  899   2HB   TRP 123          2HB       TRP 123  11.339  -2.421   1.702
  900    HD1  TRP 123           HD1      TRP 123  11.612   0.933   2.293
  901    HE1  TRP 123           HE1      TRP 123  10.741   1.709   4.587
  902    HE3  TRP 123           HE3      TRP 123  11.628  -3.528   4.760
  903    HZ2  TRP 123           HZ2      TRP 123  10.152   0.546   7.080
  904    HZ3  TRP 123           HZ3      TRP 123  10.898  -3.619   7.088
  905    HH2  TRP 123           HH2      TRP 123  10.167  -1.600   8.236
  906    H    ILE 124           H        ILE 124  14.735  -3.679   0.689
  907    HA   ILE 124           HA       ILE 124  13.265  -6.204   0.299
  908    HB   ILE 124           HB       ILE 124  13.922  -6.033  -2.129
  909   1HG1  ILE 124          1HG1      ILE 124  13.987  -3.170  -2.245
  910   2HG1  ILE 124          2HG1      ILE 124  15.267  -3.723  -1.169
  911   1HG2  ILE 124          1HG2      ILE 124  11.766  -4.855  -0.707
  912   2HG2  ILE 124          2HG2      ILE 124  12.164  -3.810  -2.070
  913   3HG2  ILE 124          3HG2      ILE 124  11.779  -5.509  -2.345
  914   1HD1  ILE 124          1HD1      ILE 124  15.098  -5.250  -3.643
  915   2HD1  ILE 124          2HD1      ILE 124  15.433  -3.536  -3.887
  916   3HD1  ILE 124          3HD1      ILE 124  16.489  -4.504  -2.857
  917    H    ARG 125           H        ARG 125  15.946  -5.104   1.538
  918    HA   ARG 125           HA       ARG 125  18.053  -6.374   0.162
  919   1HB   ARG 125          1HB       ARG 125  17.782  -4.786   2.456
  920   2HB   ARG 125          2HB       ARG 125  18.498  -6.289   3.019
  921   1HG   ARG 125          1HG       ARG 125  19.684  -5.141   0.580
  922   2HG   ARG 125          2HG       ARG 125  19.914  -4.216   2.066
  923   1HD   ARG 125          1HD       ARG 125  21.228  -5.805   3.015
  924   2HD   ARG 125          2HD       ARG 125  20.380  -7.133   2.223
  925    HE   ARG 125           HE       ARG 125  22.553  -5.531   1.087
  926   1HH1  ARG 125          1HH1      ARG 125  20.307  -8.181   0.814
  927   2HH1  ARG 125          2HH1      ARG 125  21.134  -8.912  -0.520
  928   1HH2  ARG 125          1HH2      ARG 125  23.648  -6.487  -0.668
  929   2HH2  ARG 125          2HH2      ARG 125  23.033  -7.950  -1.363
  930    H    GLY 126           H        GLY 126  17.708  -8.483  -0.371
  931   1HA   GLY 126          1HA       GLY 126  17.385 -10.354   1.893
  932   2HA   GLY 126          2HA       GLY 126  18.366 -10.695   0.476
  933    H    CYS 127           H        CYS 127  15.671  -9.101  -0.573
  934    HA   CYS 127           HA       CYS 127  13.676 -11.049  -0.499
  935   1HB   CYS 127          1HB       CYS 127  14.171  -8.605  -2.000
  936   2HB   CYS 127          2HB       CYS 127  12.998  -9.705  -2.696
  937    H    ARG 128           H        ARG 128  12.742 -11.623  -2.914
  938    HA   ARG 128           HA       ARG 128  14.906 -12.847  -4.460
  939   1HB   ARG 128          1HB       ARG 128  13.840 -14.443  -2.718
  940   2HB   ARG 128          2HB       ARG 128  12.454 -14.452  -3.799
  941   1HG   ARG 128          1HG       ARG 128  13.598 -15.551  -5.476
  942   2HG   ARG 128          2HG       ARG 128  15.178 -15.056  -4.863
  943   1HD   ARG 128          1HD       ARG 128  15.291 -16.770  -3.399
  944   2HD   ARG 128          2HD       ARG 128  13.567 -16.710  -3.035
  945    HE   ARG 128           HE       ARG 128  13.160 -18.042  -4.974
  946   1HH1  ARG 128          1HH1      ARG 128  16.526 -17.660  -4.159
  947   2HH1  ARG 128          2HH1      ARG 128  17.036 -19.043  -5.070
  948   1HH2  ARG 128          1HH2      ARG 128  13.822 -19.864  -6.176
  949   2HH2  ARG 128          2HH2      ARG 128  15.499 -20.294  -6.217
  950    H    LEU 129           H        LEU 129  14.470 -11.302  -6.063
  951    HA   LEU 129           HA       LEU 129  12.082 -11.907  -7.654
  952   1HB   LEU 129          1HB       LEU 129  11.843  -9.477  -8.161
  953   2HB   LEU 129          2HB       LEU 129  11.461  -9.914  -6.507
  954    HG   LEU 129           HG       LEU 129  14.225  -9.180  -6.659
  955   1HD1  LEU 129          1HD1      LEU 129  13.184  -7.934  -8.692
  956   2HD1  LEU 129          2HD1      LEU 129  12.481  -6.893  -7.453
  957   3HD1  LEU 129          3HD1      LEU 129  14.231  -7.065  -7.570
  958   1HD2  LEU 129          1HD2      LEU 129  11.900  -8.752  -5.045
  959   2HD2  LEU 129          2HD2      LEU 129  13.602  -8.576  -4.618
  960   3HD2  LEU 129          3HD2      LEU 129  12.724  -7.217  -5.320

  No H/Q in entry =         960
  Start of MODEL   11
    1    H1   LYS   1           H1       LYS   1  -7.636  -8.593   0.887
    2    H2   LYS   1           H2       LYS   1  -7.528  -8.861  -0.779
    3    H3   LYS   1           H3       LYS   1  -8.326  -9.980   0.207
    4    HA   LYS   1           HA       LYS   1  -6.315 -10.618   1.273
    5   1HB   LYS   1          1HB       LYS   1  -7.017 -11.259  -1.236
    6   2HB   LYS   1          2HB       LYS   1  -5.448 -10.538  -1.569
    7   1HG   LYS   1          1HG       LYS   1  -4.342 -12.293  -0.753
    8   2HG   LYS   1          2HG       LYS   1  -5.401 -12.422   0.654
    9   1HD   LYS   1          1HD       LYS   1  -6.172 -14.292  -0.303
   10   2HD   LYS   1          2HD       LYS   1  -7.028 -13.221  -1.413
   11   1HE   LYS   1          1HE       LYS   1  -5.928 -14.391  -2.991
   12   2HE   LYS   1          2HE       LYS   1  -4.598 -13.306  -2.586
   13   1HZ   LYS   1          1HZ       LYS   1  -5.030 -15.996  -1.400
   14   2HZ   LYS   1          2HZ       LYS   1  -3.915 -15.638  -2.621
   15   3HZ   LYS   1          3HZ       LYS   1  -3.726 -14.963  -1.082
   16    H    VAL   2           H        VAL   2  -4.219 -10.226   1.859
   17    HA   VAL   2           HA       VAL   2  -3.077  -7.669   0.945
   18    HB   VAL   2           HB       VAL   2  -2.720  -9.110   3.576
   19   1HG1  VAL   2          1HG1      VAL   2  -0.742  -7.716   2.388
   20   2HG1  VAL   2          2HG1      VAL   2  -1.591  -6.410   3.214
   21   3HG1  VAL   2          3HG1      VAL   2  -0.976  -7.781   4.135
   22   1HG2  VAL   2          1HG2      VAL   2  -4.604  -7.204   2.695
   23   2HG2  VAL   2          2HG2      VAL   2  -4.362  -7.823   4.329
   24   3HG2  VAL   2          3HG2      VAL   2  -3.503  -6.376   3.796
   25    H    PHE   3           H        PHE   3  -1.164  -7.700  -0.115
   26    HA   PHE   3           HA       PHE   3   0.119 -10.178  -0.714
   27   1HB   PHE   3          1HB       PHE   3   0.984  -7.318  -1.186
   28   2HB   PHE   3          2HB       PHE   3   1.828  -8.724  -1.813
   29    HD1  PHE   3           HD1      PHE   3  -1.188  -9.992  -2.196
   30    HD2  PHE   3           HD2      PHE   3   0.988  -6.606  -3.567
   31    HE1  PHE   3           HE1      PHE   3  -2.578  -9.920  -4.224
   32    HE2  PHE   3           HE2      PHE   3  -0.390  -6.528  -5.591
   33    HZ   PHE   3           HZ       PHE   3  -2.175  -8.186  -5.929
   34    H    GLY   4           H        GLY   4   2.688 -10.052  -0.546
   35   1HA   GLY   4          1HA       GLY   4   4.118 -10.775   1.242
   36   2HA   GLY   4          2HA       GLY   4   3.265  -9.670   2.314
   37    H    ARG   5           H        ARG   5   6.161  -9.915   1.697
   38    HA   ARG   5           HA       ARG   5   6.604  -7.090   1.143
   39   1HB   ARG   5          1HB       ARG   5   8.527  -9.223   2.091
   40   2HB   ARG   5          2HB       ARG   5   8.899  -7.511   1.943
   41   1HG   ARG   5          1HG       ARG   5   7.797  -6.966   3.836
   42   2HG   ARG   5          2HG       ARG   5   6.559  -8.200   3.602
   43   1HD   ARG   5          1HD       ARG   5   9.192  -9.336   4.074
   44   2HD   ARG   5          2HD       ARG   5   8.657  -8.300   5.398
   45    HE   ARG   5           HE       ARG   5   6.978  -9.813   5.881
   46   1HH1  ARG   5          1HH1      ARG   5   8.565 -10.679   2.902
   47   2HH1  ARG   5          2HH1      ARG   5   7.835 -12.248   2.820
   48   1HH2  ARG   5          1HH2      ARG   5   6.014 -11.876   5.781
   49   2HH2  ARG   5          2HH2      ARG   5   6.385 -12.929   4.456
   50    H    CYS   6           H        CYS   6   8.183 -10.130   0.117
   51    HA   CYS   6           HA       CYS   6   9.244  -8.779  -2.196
   52   1HB   CYS   6          1HB       CYS   6   9.351 -11.740  -1.669
   53   2HB   CYS   6          2HB       CYS   6  10.413 -10.762  -2.678
   54    H    GLU   7           H        GLU   7   6.738 -11.198  -1.551
   55    HA   GLU   7           HA       GLU   7   6.102 -12.038  -4.079
   56   1HB   GLU   7          1HB       GLU   7   4.112 -11.191  -1.958
   57   2HB   GLU   7          2HB       GLU   7   3.763 -12.234  -3.330
   58   1HG   GLU   7          1HG       GLU   7   5.894 -12.970  -1.369
   59   2HG   GLU   7          2HG       GLU   7   4.195 -13.284  -1.015
   60    H    LEU   8           H        LEU   8   4.994  -9.089  -2.487
   61    HA   LEU   8           HA       LEU   8   3.648  -8.024  -4.737
   62   1HB   LEU   8          1HB       LEU   8   3.146  -7.311  -2.453
   63   2HB   LEU   8          2HB       LEU   8   4.761  -6.656  -2.285
   64    HG   LEU   8           HG       LEU   8   2.712  -5.092  -2.779
   65   1HD1  LEU   8          1HD1      LEU   8   5.130  -4.481  -2.587
   66   2HD1  LEU   8          2HD1      LEU   8   5.259  -4.706  -4.332
   67   3HD1  LEU   8          3HD1      LEU   8   4.188  -3.466  -3.679
   68   1HD2  LEU   8          1HD2      LEU   8   2.354  -6.561  -4.952
   69   2HD2  LEU   8          2HD2      LEU   8   2.011  -4.831  -4.932
   70   3HD2  LEU   8          3HD2      LEU   8   3.526  -5.423  -5.617
   71    H    ALA   9           H        ALA   9   6.961  -7.670  -3.468
   72    HA   ALA   9           HA       ALA   9   7.746  -5.585  -5.193
   73   1HB   ALA   9          1HB       ALA   9   8.942  -6.987  -3.151
   74   2HB   ALA   9          2HB       ALA   9   9.904  -7.411  -4.568
   75   3HB   ALA   9          3HB       ALA   9   9.683  -5.718  -4.127
   76    H    ALA  10           H        ALA  10   8.240  -9.116  -5.521
   77    HA   ALA  10           HA       ALA  10   9.538  -9.148  -7.942
   78   1HB   ALA  10          1HB       ALA  10   8.378 -11.383  -8.281
   79   2HB   ALA  10          2HB       ALA  10   9.303 -11.201  -6.791
   80   3HB   ALA  10          3HB       ALA  10   7.545 -11.069  -6.760
   81    H    ALA  11           H        ALA  11   6.101  -8.814  -7.225
   82    HA   ALA  11           HA       ALA  11   5.193  -8.926  -9.880
   83   1HB   ALA  11          1HB       ALA  11   3.864  -9.016  -7.645
   84   2HB   ALA  11          2HB       ALA  11   3.111  -8.327  -9.083
   85   3HB   ALA  11          3HB       ALA  11   3.790  -7.266  -7.849
   86    H    MET  12           H        MET  12   6.441  -6.425  -7.917
   87    HA   MET  12           HA       MET  12   5.796  -4.208  -9.566
   88   1HB   MET  12          1HB       MET  12   8.293  -4.279  -7.909
   89   2HB   MET  12          2HB       MET  12   7.238  -2.926  -8.235
   90   1HG   MET  12          1HG       MET  12   6.356  -5.264  -6.599
   91   2HG   MET  12          2HG       MET  12   7.178  -3.871  -5.902
   92   1HE   MET  12          1HE       MET  12   6.425  -1.440  -6.668
   93   2HE   MET  12          2HE       MET  12   5.635  -1.697  -8.223
   94   3HE   MET  12          3HE       MET  12   4.738  -0.973  -6.888
   95    H    LYS  13           H        LYS  13   8.738  -6.172  -9.271
   96    HA   LYS  13           HA       LYS  13  10.368  -4.920 -11.096
   97   1HB   LYS  13          1HB       LYS  13  10.970  -6.878  -9.639
   98   2HB   LYS  13          2HB       LYS  13  10.135  -7.918 -10.785
   99   1HG   LYS  13          1HG       LYS  13  12.183  -8.141 -11.673
  100   2HG   LYS  13          2HG       LYS  13  11.794  -6.608 -12.455
  101   1HD   LYS  13          1HD       LYS  13  12.803  -5.523 -10.349
  102   2HD   LYS  13          2HD       LYS  13  13.506  -7.113 -10.044
  103   1HE   LYS  13          1HE       LYS  13  13.838  -6.014 -12.769
  104   2HE   LYS  13          2HE       LYS  13  14.734  -5.210 -11.481
  105   1HZ   LYS  13          1HZ       LYS  13  15.455  -7.572 -10.856
  106   2HZ   LYS  13          2HZ       LYS  13  14.947  -8.001 -12.411
  107   3HZ   LYS  13          3HZ       LYS  13  16.172  -6.853 -12.210
  108    H    ARG  14           H        ARG  14   8.029  -7.517 -11.734
  109    HA   ARG  14           HA       ARG  14   8.410  -7.579 -14.522
  110   1HB   ARG  14          1HB       ARG  14   6.809  -8.928 -12.627
  111   2HB   ARG  14          2HB       ARG  14   5.704  -8.257 -13.817
  112   1HG   ARG  14          1HG       ARG  14   7.566  -9.307 -15.449
  113   2HG   ARG  14          2HG       ARG  14   7.693 -10.409 -14.078
  114   1HD   ARG  14          1HD       ARG  14   5.571 -11.214 -14.350
  115   2HD   ARG  14          2HD       ARG  14   4.979  -9.717 -15.067
  116    HE   ARG  14           HE       ARG  14   6.287 -10.413 -17.093
  117   1HH1  ARG  14          1HH1      ARG  14   5.090 -12.750 -14.803
  118   2HH1  ARG  14          2HH1      ARG  14   5.009 -14.035 -15.961
  119   1HH2  ARG  14          1HH2      ARG  14   6.185 -12.099 -18.625
  120   2HH2  ARG  14          2HH2      ARG  14   5.632 -13.665 -18.134
  121    H    HIS  15           H        HIS  15   6.388  -5.622 -12.416
  122    HA   HIS  15           HA       HIS  15   4.834  -4.509 -14.529
  123   1HB   HIS  15          1HB       HIS  15   5.129  -4.023 -11.601
  124   2HB   HIS  15          2HB       HIS  15   4.352  -2.788 -12.584
  125    HD1  HIS  15           HD1      HIS  15   2.900  -4.514 -10.379
  126    HD2  HIS  15           HD2      HIS  15   2.795  -5.215 -14.474
  127    HE1  HIS  15           HE1      HIS  15   0.795  -5.827 -10.783
  128    HE2  HIS  15           HE2      HIS  15   0.710  -6.169 -13.278
  129    H    GLY  16           H        GLY  16   8.062  -4.004 -13.761
  130   1HA   GLY  16          1HA       GLY  16   8.200  -1.780 -15.473
  131   2HA   GLY  16          2HA       GLY  16   9.520  -2.489 -14.574
  132    H    LEU  17           H        LEU  17   8.040  -1.911 -11.918
  133    HA   LEU  17           HA       LEU  17   8.048   0.988 -11.992
  134   1HB   LEU  17          1HB       LEU  17   7.803  -0.623  -9.484
  135   2HB   LEU  17          2HB       LEU  17   7.159   0.967  -9.829
  136    HG   LEU  17           HG       LEU  17   6.029  -1.698 -10.383
  137   1HD1  LEU  17          1HD1      LEU  17   5.311   0.259  -8.765
  138   2HD1  LEU  17          2HD1      LEU  17   4.476   0.834 -10.209
  139   3HD1  LEU  17          3HD1      LEU  17   4.112  -0.764  -9.556
  140   1HD2  LEU  17          1HD2      LEU  17   5.681   0.604 -12.305
  141   2HD2  LEU  17          2HD2      LEU  17   6.325  -0.996 -12.670
  142   3HD2  LEU  17          3HD2      LEU  17   4.627  -0.808 -12.237
  143    H    ASP  18           H        ASP  18  10.345  -1.196 -11.942
  144    HA   ASP  18           HA       ASP  18  12.037  -0.279  -9.836
  145   1HB   ASP  18          1HB       ASP  18  12.644  -2.407 -10.432
  146   2HB   ASP  18          2HB       ASP  18  12.336  -2.139 -12.139
  147    H    ASN  19           H        ASN  19  12.181   1.911  -9.993
  148    HA   ASN  19           HA       ASN  19  13.097   3.905 -10.530
  149   1HB   ASN  19          1HB       ASN  19  15.104   2.157 -10.953
  150   2HB   ASN  19          2HB       ASN  19  14.928   2.791 -12.587
  151   2HD2  ASN  19          2HD2      ASN  19  16.142   3.332  -9.472
  152   1HD2  ASN  19          1HD2      ASN  19  16.726   4.939  -9.716
  153    H    TYR  20           H        TYR  20  10.805   3.070 -11.894
  154    HA   TYR  20           HA       TYR  20  10.972   3.615 -14.692
  155   1HB   TYR  20          1HB       TYR  20   9.107   2.355 -13.575
  156   2HB   TYR  20          2HB       TYR  20   8.570   3.870 -12.861
  157    HD1  TYR  20           HD1      TYR  20   9.374   2.449 -16.229
  158    HD2  TYR  20           HD2      TYR  20   6.884   5.018 -13.927
  159    HE1  TYR  20           HE1      TYR  20   8.002   2.895 -18.220
  160    HE2  TYR  20           HE2      TYR  20   5.505   5.472 -15.911
  161    HH   TYR  20           HH       TYR  20   4.984   4.257 -18.108
  162    H    ARG  21           H        ARG  21   9.489   5.558 -15.512
  163    HA   ARG  21           HA       ARG  21  10.721   7.890 -15.378
  164   1HB   ARG  21          1HB       ARG  21   7.889   7.180 -15.743
  165   2HB   ARG  21          2HB       ARG  21   8.167   8.856 -15.293
  166   1HG   ARG  21          1HG       ARG  21  10.012   8.564 -17.239
  167   2HG   ARG  21          2HG       ARG  21   8.770   7.443 -17.797
  168   1HD   ARG  21          1HD       ARG  21   7.739   9.215 -18.670
  169   2HD   ARG  21          2HD       ARG  21   7.335   9.669 -17.014
  170    HE   ARG  21           HE       ARG  21   8.894  11.354 -17.121
  171   1HH1  ARG  21          1HH1      ARG  21   9.305   9.213 -19.839
  172   2HH1  ARG  21          2HH1      ARG  21  10.424  10.254 -20.654
  173   1HH2  ARG  21          1HH2      ARG  21  10.365  12.731 -18.188
  174   2HH2  ARG  21          2HH2      ARG  21  11.026  12.253 -19.715
  175    H    GLY  22           H        GLY  22   8.884   6.491 -12.851
  176   1HA   GLY  22          1HA       GLY  22   8.162   7.384 -10.783
  177   2HA   GLY  22          2HA       GLY  22   8.999   8.882 -11.169
  178    H    TYR  23           H        TYR  23   9.120   6.011  -9.435
  179    HA   TYR  23           HA       TYR  23  11.983   6.418  -8.882
  180   1HB   TYR  23          1HB       TYR  23   9.734   5.876  -6.963
  181   2HB   TYR  23          2HB       TYR  23  11.425   5.691  -6.517
  182    HD1  TYR  23           HD1      TYR  23   9.087   8.194  -7.997
  183    HD2  TYR  23           HD2      TYR  23  12.553   7.517  -5.623
  184    HE1  TYR  23           HE1      TYR  23   9.193  10.595  -7.481
  185    HE2  TYR  23           HE2      TYR  23  12.668   9.917  -5.100
  186    HH   TYR  23           HH       TYR  23  11.497  11.874  -5.155
  187    H    SER  24           H        SER  24  12.757   4.554  -7.322
  188    HA   SER  24           HA       SER  24  12.772   2.202  -8.957
  189   1HB   SER  24          1HB       SER  24  14.542   1.431  -7.528
  190   2HB   SER  24          2HB       SER  24  14.809   3.145  -7.843
  191    HG   SER  24           HG       SER  24  14.708   3.453  -5.779
  192    H    LEU  25           H        LEU  25  12.530   0.058  -8.085
  193    HA   LEU  25           HA       LEU  25  10.056  -0.572  -7.184
  194   1HB   LEU  25          1HB       LEU  25  12.672  -2.009  -6.846
  195   2HB   LEU  25          2HB       LEU  25  11.176  -2.707  -6.257
  196    HG   LEU  25           HG       LEU  25  12.031  -2.209  -9.082
  197   1HD1  LEU  25          1HD1      LEU  25  12.365  -4.383  -7.713
  198   2HD1  LEU  25          2HD1      LEU  25  10.642  -4.622  -8.004
  199   3HD1  LEU  25          3HD1      LEU  25  11.755  -4.482  -9.365
  200   1HD2  LEU  25          1HD2      LEU  25   9.289  -2.124  -7.994
  201   2HD2  LEU  25          2HD2      LEU  25   9.955  -1.403  -9.459
  202   3HD2  LEU  25          3HD2      LEU  25   9.533  -3.115  -9.432
  203    H    GLY  26           H        GLY  26  12.930  -0.436  -5.046
  204   1HA   GLY  26          1HA       GLY  26  13.100   0.192  -2.840
  205   2HA   GLY  26          2HA       GLY  26  11.801  -0.969  -2.634
  206    H    ASN  27           H        ASN  27  11.559   2.098  -4.368
  207    HA   ASN  27           HA       ASN  27  10.402   3.550  -2.217
  208   1HB   ASN  27          1HB       ASN  27  10.240   4.049  -5.196
  209   2HB   ASN  27          2HB       ASN  27   9.785   5.202  -3.945
  210   2HD2  ASN  27          2HD2      ASN  27  11.631   5.398  -2.220
  211   1HD2  ASN  27          1HD2      ASN  27  13.196   5.699  -2.888
  212    H    TRP  28           H        TRP  28   9.124   1.578  -4.805
  213    HA   TRP  28           HA       TRP  28   6.380   2.245  -4.437
  214   1HB   TRP  28          1HB       TRP  28   7.703  -0.130  -5.732
  215   2HB   TRP  28          2HB       TRP  28   5.976   0.215  -5.802
  216    HD1  TRP  28           HD1      TRP  28   9.297   1.304  -7.237
  217    HE1  TRP  28           HE1      TRP  28   8.890   2.969  -9.142
  218    HE3  TRP  28           HE3      TRP  28   4.289   1.998  -6.606
  219    HZ2  TRP  28           HZ2      TRP  28   6.711   4.385 -10.263
  220    HZ3  TRP  28           HZ3      TRP  28   3.090   3.513  -8.127
  221    HH2  TRP  28           HH2      TRP  28   4.283   4.690  -9.925
  222    H    VAL  29           H        VAL  29   8.456  -0.390  -3.275
  223    HA   VAL  29           HA       VAL  29   6.438  -1.865  -2.016
  224    HB   VAL  29           HB       VAL  29   9.377  -1.702  -1.340
  225   1HG1  VAL  29          1HG1      VAL  29   7.202  -3.569  -0.483
  226   2HG1  VAL  29          2HG1      VAL  29   8.874  -4.120  -0.574
  227   3HG1  VAL  29          3HG1      VAL  29   8.445  -2.779   0.487
  228   1HG2  VAL  29          1HG2      VAL  29   8.206  -2.546  -3.695
  229   2HG2  VAL  29          2HG2      VAL  29   9.825  -2.955  -3.127
  230   3HG2  VAL  29          3HG2      VAL  29   8.477  -4.043  -2.801
  231    H    CYS  30           H        CYS  30   8.725   0.515  -0.712
  232    HA   CYS  30           HA       CYS  30   7.842   0.387   1.933
  233   1HB   CYS  30          1HB       CYS  30   9.939   1.510   1.008
  234   2HB   CYS  30          2HB       CYS  30   8.907   2.889   0.639
  235    H    ALA  31           H        ALA  31   6.816   2.566  -0.713
  236    HA   ALA  31           HA       ALA  31   5.030   4.093   0.818
  237   1HB   ALA  31          1HB       ALA  31   5.974   4.366  -1.633
  238   2HB   ALA  31          2HB       ALA  31   4.448   5.102  -1.143
  239   3HB   ALA  31          3HB       ALA  31   4.447   3.591  -2.051
  240    H    ALA  32           H        ALA  32   4.475   1.215  -1.195
  241    HA   ALA  32           HA       ALA  32   1.683   1.106  -0.736
  242   1HB   ALA  32          1HB       ALA  32   2.237  -0.080  -2.604
  243   2HB   ALA  32          2HB       ALA  32   2.154  -1.397  -1.435
  244   3HB   ALA  32          3HB       ALA  32   3.717  -0.723  -1.895
  245    H    LYS  33           H        LYS  33   4.399  -0.694   0.714
  246    HA   LYS  33           HA       LYS  33   3.121  -2.439   2.339
  247   1HB   LYS  33          1HB       LYS  33   5.520  -2.405   2.192
  248   2HB   LYS  33          2HB       LYS  33   5.590  -0.801   2.907
  249   1HG   LYS  33          1HG       LYS  33   4.563  -1.831   4.981
  250   2HG   LYS  33          2HG       LYS  33   4.894  -3.399   4.241
  251   1HD   LYS  33          1HD       LYS  33   7.178  -3.146   4.410
  252   2HD   LYS  33          2HD       LYS  33   7.087  -1.383   4.429
  253   1HE   LYS  33          1HE       LYS  33   7.706  -2.089   6.618
  254   2HE   LYS  33          2HE       LYS  33   6.030  -1.548   6.691
  255   1HZ   LYS  33          1HZ       LYS  33   6.669  -4.397   6.277
  256   2HZ   LYS  33          2HZ       LYS  33   6.670  -3.736   7.834
  257   3HZ   LYS  33          3HZ       LYS  33   5.258  -3.704   6.901
  258    H    PHE  34           H        PHE  34   4.107   0.828   3.354
  259    HA   PHE  34           HA       PHE  34   2.595   0.628   5.752
  260   1HB   PHE  34          1HB       PHE  34   4.331   2.613   4.534
  261   2HB   PHE  34          2HB       PHE  34   3.154   3.236   5.672
  262    HD1  PHE  34           HD1      PHE  34   3.108   2.185   7.994
  263    HD2  PHE  34           HD2      PHE  34   6.318   1.647   5.252
  264    HE1  PHE  34           HE1      PHE  34   4.579   1.523   9.851
  265    HE2  PHE  34           HE2      PHE  34   7.795   0.983   7.105
  266    HZ   PHE  34           HZ       PHE  34   6.926   0.920   9.408
  267    H    GLU  35           H        GLU  35   1.843   1.686   2.567
  268    HA   GLU  35           HA       GLU  35  -0.141   3.558   3.098
  269   1HB   GLU  35          1HB       GLU  35   0.948   2.242   0.874
  270   2HB   GLU  35          2HB       GLU  35  -0.774   1.894   0.825
  271   1HG   GLU  35          1HG       GLU  35  -1.353   4.108   0.555
  272   2HG   GLU  35          2HG       GLU  35   0.152   4.696   1.259
  273    H    SER  36           H        SER  36  -0.545   0.116   2.327
  274    HA   SER  36           HA       SER  36  -3.094   0.152   3.819
  275   1HB   SER  36          1HB       SER  36  -3.770  -1.614   2.019
  276   2HB   SER  36          2HB       SER  36  -3.793   0.093   1.578
  277    HG   SER  36           HG       SER  36  -1.664  -0.235   0.718
  278    H    ASN  37           H        ASN  37  -0.185  -0.914   4.254
  279    HA   ASN  37           HA       ASN  37   0.787  -2.721   5.270
  280   1HB   ASN  37          1HB       ASN  37  -1.737  -2.441   6.451
  281   2HB   ASN  37          2HB       ASN  37  -1.624  -4.152   6.048
  282   2HD2  ASN  37          2HD2      ASN  37   0.214  -1.534   7.562
  283   1HD2  ASN  37          1HD2      ASN  37   0.956  -2.519   8.771
  284    H    PHE  38           H        PHE  38  -0.052  -2.737   2.519
  285    HA   PHE  38           HA       PHE  38   0.142  -4.017   0.722
  286   1HB   PHE  38          1HB       PHE  38   0.751  -6.094   2.797
  287   2HB   PHE  38          2HB       PHE  38   0.599  -6.528   1.095
  288    HD1  PHE  38           HD1      PHE  38   1.834  -4.523  -0.406
  289    HD2  PHE  38           HD2      PHE  38   2.956  -5.953   3.438
  290    HE1  PHE  38           HE1      PHE  38   4.134  -3.769  -0.811
  291    HE2  PHE  38           HE2      PHE  38   5.263  -5.196   3.044
  292    HZ   PHE  38           HZ       PHE  38   5.859  -4.114   0.914
  293    H    ASN  39           H        ASN  39  -2.398  -3.533   2.209
  294    HA   ASN  39           HA       ASN  39  -4.026  -5.820   1.449
  295   1HB   ASN  39          1HB       ASN  39  -4.327  -4.176   3.508
  296   2HB   ASN  39          2HB       ASN  39  -5.236  -3.235   2.330
  297   2HD2  ASN  39          2HD2      ASN  39  -5.952  -4.868   4.774
  298   1HD2  ASN  39          1HD2      ASN  39  -7.242  -5.883   4.237
  299    H    THR  40           H        THR  40  -4.402  -6.032  -0.637
  300    HA   THR  40           HA       THR  40  -4.544  -3.728  -2.387
  301    HB   THR  40           HB       THR  40  -4.189  -5.177  -4.127
  302    HG1  THR  40           HG1      THR  40  -5.089  -7.217  -4.256
  303   1HG2  THR  40          1HG2      THR  40  -2.755  -5.762  -1.827
  304   2HG2  THR  40          2HG2      THR  40  -3.237  -7.338  -2.455
  305   3HG2  THR  40          3HG2      THR  40  -2.331  -6.222  -3.476
  306    H    GLN  41           H        GLN  41  -6.671  -5.964  -0.847
  307    HA   GLN  41           HA       GLN  41  -8.933  -5.216  -2.521
  308   1HB   GLN  41          1HB       GLN  41  -8.320  -7.362  -0.574
  309   2HB   GLN  41          2HB       GLN  41  -9.994  -6.863  -0.695
  310   1HG   GLN  41          1HG       GLN  41  -8.804  -7.255  -3.298
  311   2HG   GLN  41          2HG       GLN  41  -8.687  -8.698  -2.293
  312   2HE2  GLN  41          2HE2      GLN  41 -10.829  -9.088  -1.030
  313   1HE2  GLN  41          1HE2      GLN  41 -12.258  -9.033  -1.998
  314    H    ALA  42           H        ALA  42  -7.438  -3.808  -0.003
  315    HA   ALA  42           HA       ALA  42  -9.789  -3.183   1.574
  316   1HB   ALA  42          1HB       ALA  42  -8.112  -1.745   2.850
  317   2HB   ALA  42          2HB       ALA  42  -6.883  -2.512   1.845
  318   3HB   ALA  42          3HB       ALA  42  -7.899  -3.495   2.900
  319    H    THR  43           H        THR  43 -10.268  -0.992   2.168
  320    HA   THR  43           HA       THR  43  -9.792   0.999   0.045
  321    HB   THR  43           HB       THR  43 -12.014   1.549  -0.188
  322    HG1  THR  43           HG1      THR  43 -12.505   0.396   2.376
  323   1HG2  THR  43          1HG2      THR  43 -11.582  -0.935  -0.717
  324   2HG2  THR  43          2HG2      THR  43 -12.514  -1.262   0.743
  325   3HG2  THR  43          3HG2      THR  43 -13.255  -0.392  -0.600
  326    H    ASN  44           H        ASN  44  -9.737   3.193   0.805
  327    HA   ASN  44           HA       ASN  44  -9.806   3.497   3.731
  328   1HB   ASN  44          1HB       ASN  44  -7.455   3.324   2.632
  329   2HB   ASN  44          2HB       ASN  44  -7.776   4.963   2.075
  330   2HD2  ASN  44          2HD2      ASN  44  -7.108   6.518   3.351
  331   1HD2  ASN  44          1HD2      ASN  44  -6.842   6.398   5.054
  332    H    ARG  45           H        ARG  45 -11.791   4.529   3.694
  333    HA   ARG  45           HA       ARG  45 -12.415   6.679   1.949
  334   1HB   ARG  45          1HB       ARG  45 -14.054   5.194   3.199
  335   2HB   ARG  45          2HB       ARG  45 -13.687   6.144   4.632
  336   1HG   ARG  45          1HG       ARG  45 -14.565   8.123   3.638
  337   2HG   ARG  45          2HG       ARG  45 -14.723   7.330   2.069
  338   1HD   ARG  45          1HD       ARG  45 -16.877   7.517   3.239
  339   2HD   ARG  45          2HD       ARG  45 -16.413   5.839   2.960
  340    HE   ARG  45           HE       ARG  45 -16.314   5.529   5.224
  341   1HH1  ARG  45          1HH1      ARG  45 -16.323   8.948   4.550
  342   2HH1  ARG  45          2HH1      ARG  45 -16.487   9.406   6.211
  343   1HH2  ARG  45          1HH2      ARG  45 -16.530   6.122   7.414
  344   2HH2  ARG  45          2HH2      ARG  45 -16.604   7.800   7.840
  345    H    ASN  46           H        ASN  46 -12.077   8.808   2.120
  346    HA   ASN  46           HA       ASN  46 -10.666   9.774   4.516
  347   1HB   ASN  46          1HB       ASN  46 -10.693  11.201   1.872
  348   2HB   ASN  46          2HB       ASN  46  -9.525  11.332   3.182
  349   2HD2  ASN  46          2HD2      ASN  46 -10.039  10.105   0.182
  350   1HD2  ASN  46          1HD2      ASN  46  -8.850   8.852   0.173
  351    H    THR  47           H        THR  47 -10.945  12.295   4.669
  352    HA   THR  47           HA       THR  47 -13.777  12.720   5.121
  353    HB   THR  47           HB       THR  47 -13.049  14.849   6.190
  354    HG1  THR  47           HG1      THR  47 -11.097  15.544   5.798
  355   1HG2  THR  47          1HG2      THR  47 -11.975  12.191   7.028
  356   2HG2  THR  47          2HG2      THR  47 -11.550  13.625   7.961
  357   3HG2  THR  47          3HG2      THR  47 -13.243  13.172   7.763
  358    H    ASP  48           H        ASP  48 -11.331  13.717   2.869
  359    HA   ASP  48           HA       ASP  48 -12.615  16.059   1.909
  360   1HB   ASP  48          1HB       ASP  48 -11.115  15.712  -0.097
  361   2HB   ASP  48          2HB       ASP  48 -10.293  15.825   1.456
  362    H    GLY  49           H        GLY  49 -13.398  12.802   1.617
  363   1HA   GLY  49          1HA       GLY  49 -15.170  13.418  -0.663
  364   2HA   GLY  49          2HA       GLY  49 -15.577  12.307   0.635
  365    H    SER  50           H        SER  50 -12.389  12.306  -0.771
  366    HA   SER  50           HA       SER  50 -12.965  10.237  -2.676
  367   1HB   SER  50          1HB       SER  50 -10.293  10.146  -2.559
  368   2HB   SER  50          2HB       SER  50 -11.155  11.402  -3.447
  369    HG   SER  50           HG       SER  50 -10.948  12.734  -1.595
  370    H    THR  51           H        THR  51 -11.020   8.409  -2.501
  371    HA   THR  51           HA       THR  51 -10.800   7.271   0.130
  372    HB   THR  51           HB       THR  51 -12.489   5.818  -1.916
  373    HG1  THR  51           HG1      THR  51 -13.608   6.405   0.523
  374   1HG2  THR  51          1HG2      THR  51 -10.989   4.861   0.290
  375   2HG2  THR  51          2HG2      THR  51 -12.697   4.758   0.720
  376   3HG2  THR  51          3HG2      THR  51 -12.106   3.968  -0.742
  377    H    ASP  52           H        ASP  52  -9.499   5.268   0.107
  378    HA   ASP  52           HA       ASP  52  -7.803   5.122  -2.295
  379   1HB   ASP  52          1HB       ASP  52  -7.136   4.319   0.546
  380   2HB   ASP  52          2HB       ASP  52  -6.035   4.293  -0.827
  381    H    TYR  53           H        TYR  53  -8.916   3.636  -3.463
  382    HA   TYR  53           HA       TYR  53  -9.636   1.128  -2.202
  383   1HB   TYR  53          1HB       TYR  53 -10.134   2.219  -4.966
  384   2HB   TYR  53          2HB       TYR  53 -10.569   0.586  -4.475
  385    HD1  TYR  53           HD1      TYR  53 -12.355   0.201  -2.852
  386    HD2  TYR  53           HD2      TYR  53 -11.398   4.124  -4.188
  387    HE1  TYR  53           HE1      TYR  53 -14.499   1.018  -1.969
  388    HE2  TYR  53           HE2      TYR  53 -13.540   4.951  -3.310
  389    HH   TYR  53           HH       TYR  53 -16.046   2.871  -2.314
  390    H    GLY  54           H        GLY  54  -7.508   0.448  -1.783
  391   1HA   GLY  54          1HA       GLY  54  -5.908  -0.302  -4.132
  392   2HA   GLY  54          2HA       GLY  54  -6.546  -1.619  -3.177
  393    H    ILE  55           H        ILE  55  -4.062  -1.768  -3.539
  394    HA   ILE  55           HA       ILE  55  -2.875  -1.421  -0.931
  395    HB   ILE  55           HB       ILE  55  -2.573  -3.471  -2.412
  396   1HG1  ILE  55          1HG1      ILE  55  -0.033  -2.087  -1.522
  397   2HG1  ILE  55          2HG1      ILE  55  -1.128  -2.962  -0.456
  398   1HG2  ILE  55          1HG2      ILE  55  -0.727  -1.603  -3.893
  399   2HG2  ILE  55          2HG2      ILE  55  -0.831  -3.347  -4.134
  400   3HG2  ILE  55          3HG2      ILE  55  -2.212  -2.320  -4.519
  401   1HD1  ILE  55          1HD1      ILE  55  -0.242  -4.512  -2.764
  402   2HD1  ILE  55          2HD1      ILE  55   1.060  -4.016  -1.683
  403   3HD1  ILE  55          3HD1      ILE  55  -0.302  -4.945  -1.055
  404    H    LEU  56           H        LEU  56  -2.968   0.246  -3.911
  405    HA   LEU  56           HA       LEU  56  -0.692   1.930  -3.107
  406   1HB   LEU  56          1HB       LEU  56  -1.088   0.623  -5.553
  407   2HB   LEU  56          2HB       LEU  56  -1.517   2.292  -5.867
  408    HG   LEU  56           HG       LEU  56   0.751   2.238  -6.420
  409   1HD1  LEU  56          1HD1      LEU  56   0.141   3.973  -4.664
  410   2HD1  LEU  56          2HD1      LEU  56   0.968   2.932  -3.504
  411   3HD1  LEU  56          3HD1      LEU  56   1.855   3.609  -4.870
  412   1HD2  LEU  56          1HD2      LEU  56   0.912  -0.107  -5.263
  413   2HD2  LEU  56          2HD2      LEU  56   2.358   0.872  -5.514
  414   3HD2  LEU  56          3HD2      LEU  56   1.588   0.826  -3.927
  415    H    GLN  57           H        GLN  57  -3.843   1.778  -2.822
  416    HA   GLN  57           HA       GLN  57  -5.465   3.271  -2.360
  417   1HB   GLN  57          1HB       GLN  57  -3.372   5.392  -2.848
  418   2HB   GLN  57          2HB       GLN  57  -4.903   5.608  -2.013
  419   1HG   GLN  57          1HG       GLN  57  -4.100   3.912  -0.337
  420   2HG   GLN  57          2HG       GLN  57  -2.520   4.019  -1.110
  421   2HE2  GLN  57          2HE2      GLN  57  -4.078   4.989   1.491
  422   1HE2  GLN  57          1HE2      GLN  57  -3.368   6.542   1.753
  423    H    ILE  58           H        ILE  58  -6.292   2.419  -4.535
  424    HA   ILE  58           HA       ILE  58  -6.036   4.291  -6.726
  425    HB   ILE  58           HB       ILE  58  -7.946   1.964  -6.596
  426   1HG1  ILE  58          1HG1      ILE  58  -5.885   0.934  -6.066
  427   2HG1  ILE  58          2HG1      ILE  58  -6.068   0.712  -7.804
  428   1HG2  ILE  58          1HG2      ILE  58  -6.648   3.506  -8.828
  429   2HG2  ILE  58          2HG2      ILE  58  -7.487   1.974  -9.073
  430   3HG2  ILE  58          3HG2      ILE  58  -8.365   3.372  -8.452
  431   1HD1  ILE  58          1HD1      ILE  58  -4.657   3.154  -7.224
  432   2HD1  ILE  58          2HD1      ILE  58  -3.878   1.768  -6.462
  433   3HD1  ILE  58          3HD1      ILE  58  -4.166   1.771  -8.202
  434    H    ASN  59           H        ASN  59  -6.955   6.185  -5.996
  435    HA   ASN  59           HA       ASN  59  -9.364   6.396  -4.611
  436   1HB   ASN  59          1HB       ASN  59  -7.690   8.198  -4.777
  437   2HB   ASN  59          2HB       ASN  59  -8.072   8.391  -6.486
  438   2HD2  ASN  59          2HD2      ASN  59  -8.402  10.630  -5.606
  439   1HD2  ASN  59          1HD2      ASN  59  -9.992  11.031  -5.062
  440    H    SER  60           H        SER  60 -11.108   5.314  -5.445
  441    HA   SER  60           HA       SER  60 -11.747   5.223  -8.199
  442   1HB   SER  60          1HB       SER  60 -13.576   3.963  -7.577
  443   2HB   SER  60          2HB       SER  60 -12.566   3.761  -6.145
  444    HG   SER  60           HG       SER  60 -14.857   5.346  -6.502
  445    H    ARG  61           H        ARG  61 -12.026   7.717  -5.927
  446    HA   ARG  61           HA       ARG  61 -14.276   8.989  -7.292
  447   1HB   ARG  61          1HB       ARG  61 -13.796   8.945  -4.697
  448   2HB   ARG  61          2HB       ARG  61 -12.741  10.298  -5.080
  449   1HG   ARG  61          1HG       ARG  61 -14.938  11.115  -6.354
  450   2HG   ARG  61          2HG       ARG  61 -15.690  10.121  -5.104
  451   1HD   ARG  61          1HD       ARG  61 -14.817  11.425  -3.376
  452   2HD   ARG  61          2HD       ARG  61 -13.588  12.144  -4.415
  453    HE   ARG  61           HE       ARG  61 -16.197  12.819  -5.306
  454   1HH1  ARG  61          1HH1      ARG  61 -13.835  13.563  -2.855
  455   2HH1  ARG  61          2HH1      ARG  61 -14.406  15.180  -2.613
  456   1HH2  ARG  61          1HH2      ARG  61 -16.956  14.946  -4.994
  457   2HH2  ARG  61          2HH2      ARG  61 -16.181  15.966  -3.829
  458    H    TRP  62           H        TRP  62 -11.523   8.518  -8.368
  459    HA   TRP  62           HA       TRP  62 -11.236  11.055  -9.673
  460   1HB   TRP  62          1HB       TRP  62  -9.831  10.822  -7.321
  461   2HB   TRP  62          2HB       TRP  62  -8.633  10.372  -8.530
  462    HD1  TRP  62           HD1      TRP  62  -8.260  12.266 -10.552
  463    HE1  TRP  62           HE1      TRP  62  -8.273  14.832 -10.362
  464    HE3  TRP  62           HE3      TRP  62 -10.769  12.739  -6.123
  465    HZ2  TRP  62           HZ2      TRP  62  -9.222  16.797  -8.572
  466    HZ3  TRP  62           HZ3      TRP  62 -11.188  14.998  -5.241
  467    HH2  TRP  62           HH2      TRP  62 -10.430  16.984  -6.441
  468    H    TRP  63           H        TRP  63 -10.700   7.702  -9.547
  469    HA   TRP  63           HA       TRP  63  -9.238   7.865 -12.086
  470   1HB   TRP  63          1HB       TRP  63  -8.726   5.912  -9.836
  471   2HB   TRP  63          2HB       TRP  63  -8.008   5.800 -11.441
  472    HD1  TRP  63           HD1      TRP  63  -6.944   6.854  -8.196
  473    HE1  TRP  63           HE1      TRP  63  -5.150   8.703  -8.313
  474    HE3  TRP  63           HE3      TRP  63  -7.598   8.281 -13.023
  475    HZ2  TRP  63           HZ2      TRP  63  -4.162  10.552 -10.237
  476    HZ3  TRP  63           HZ3      TRP  63  -6.259  10.089 -13.942
  477    HH2  TRP  63           HH2      TRP  63  -4.542  11.208 -12.581
  478    H    CYS  64           H        CYS  64 -10.606   5.218 -10.166
  479    HA   CYS  64           HA       CYS  64 -11.843   4.219 -12.615
  480   1HB   CYS  64          1HB       CYS  64 -11.799   2.111 -11.700
  481   2HB   CYS  64          2HB       CYS  64 -10.466   2.838 -10.817
  482    H    ASN  65           H        ASN  65 -13.981   3.350 -12.631
  483    HA   ASN  65           HA       ASN  65 -15.827   5.076 -11.143
  484   1HB   ASN  65          1HB       ASN  65 -15.937   4.965 -13.654
  485   2HB   ASN  65          2HB       ASN  65 -16.443   3.285 -13.500
  486   2HD2  ASN  65          2HD2      ASN  65 -18.530   3.061 -13.765
  487   1HD2  ASN  65          1HD2      ASN  65 -19.754   4.158 -13.235
  488    H    ASP  66           H        ASP  66 -16.429   4.208  -9.266
  489    HA   ASP  66           HA       ASP  66 -16.931   1.324  -9.114
  490   1HB   ASP  66          1HB       ASP  66 -16.768   1.537  -6.727
  491   2HB   ASP  66          2HB       ASP  66 -15.407   2.396  -7.441
  492    H    GLY  67           H        GLY  67 -18.543   4.334  -9.254
  493   1HA   GLY  67          1HA       GLY  67 -21.107   3.035  -9.233
  494   2HA   GLY  67          2HA       GLY  67 -20.806   4.748  -9.477
  495    H    ARG  68           H        ARG  68 -19.367   3.430  -6.668
  496    HA   ARG  68           HA       ARG  68 -21.644   3.897  -4.953
  497   1HB   ARG  68          1HB       ARG  68 -19.654   2.172  -4.708
  498   2HB   ARG  68          2HB       ARG  68 -18.884   3.518  -3.879
  499   1HG   ARG  68          1HG       ARG  68 -21.246   3.543  -2.629
  500   2HG   ARG  68          2HG       ARG  68 -21.163   1.833  -3.057
  501   1HD   ARG  68          1HD       ARG  68 -19.507   1.422  -1.594
  502   2HD   ARG  68          2HD       ARG  68 -18.679   2.935  -1.958
  503    HE   ARG  68           HE       ARG  68 -21.075   3.330  -0.448
  504   1HH1  ARG  68          1HH1      ARG  68 -17.704   2.476  -0.222
  505   2HH1  ARG  68          2HH1      ARG  68 -17.547   3.004   1.419
  506   1HH2  ARG  68          1HH2      ARG  68 -20.878   4.028   1.714
  507   2HH2  ARG  68          2HH2      ARG  68 -19.351   3.886   2.521
  508    H    THR  69           H        THR  69 -19.460   5.878  -6.426
  509    HA   THR  69           HA       THR  69 -19.918   7.984  -4.439
  510    HB   THR  69           HB       THR  69 -17.255   7.936  -5.782
  511    HG1  THR  69           HG1      THR  69 -17.467   6.687  -3.284
  512   1HG2  THR  69          1HG2      THR  69 -18.290   8.896  -3.115
  513   2HG2  THR  69          2HG2      THR  69 -16.601   8.985  -3.614
  514   3HG2  THR  69          3HG2      THR  69 -17.830   9.887  -4.500
  515    HA   PRO  70           HA       PRO  70 -21.149   9.889  -8.320
  516   1HB   PRO  70          1HB       PRO  70 -22.078  12.195  -7.233
  517   2HB   PRO  70          2HB       PRO  70 -22.995  10.684  -7.204
  518   1HG   PRO  70          1HG       PRO  70 -21.319  11.924  -5.056
  519   2HG   PRO  70          2HG       PRO  70 -22.912  11.156  -4.928
  520   1HD   PRO  70          1HD       PRO  70 -20.623   9.877  -4.254
  521   2HD   PRO  70          2HD       PRO  70 -22.026   9.027  -4.932
  522    H    GLY  71           H        GLY  71 -20.437  11.632  -9.612
  523   1HA   GLY  71          1HA       GLY  71 -18.498  13.508  -8.571
  524   2HA   GLY  71          2HA       GLY  71 -19.086  13.421 -10.224
  525    H    SER  72           H        SER  72 -18.381  10.399  -9.962
  526    HA   SER  72           HA       SER  72 -15.596  10.179  -9.710
  527   1HB   SER  72          1HB       SER  72 -15.932   8.062 -11.101
  528   2HB   SER  72          2HB       SER  72 -16.856   8.171  -9.603
  529    HG   SER  72           HG       SER  72 -18.487   9.190 -11.197
  530    H    ARG  73           H        ARG  73 -13.991  10.796 -10.983
  531    HA   ARG  73           HA       ARG  73 -14.490  12.150 -13.446
  532   1HB   ARG  73          1HB       ARG  73 -12.069  11.469 -11.838
  533   2HB   ARG  73          2HB       ARG  73 -11.853  11.945 -13.517
  534   1HG   ARG  73          1HG       ARG  73 -13.638  13.769 -12.221
  535   2HG   ARG  73          2HG       ARG  73 -12.155  13.604 -11.278
  536   1HD   ARG  73          1HD       ARG  73 -10.861  14.534 -12.895
  537   2HD   ARG  73          2HD       ARG  73 -11.846  13.888 -14.207
  538    HE   ARG  73           HE       ARG  73 -12.227  16.404 -12.806
  539   1HH1  ARG  73          1HH1      ARG  73 -13.518  14.043 -15.020
  540   2HH1  ARG  73          2HH1      ARG  73 -14.657  15.139 -15.727
  541   1HH2  ARG  73          1HH2      ARG  73 -13.722  17.854 -13.731
  542   2HH2  ARG  73          2HH2      ARG  73 -14.773  17.306 -14.995
  543    H    ASN  74           H        ASN  74 -13.110   9.019 -12.570
  544    HA   ASN  74           HA       ASN  74 -12.773   7.091 -13.755
  545   1HB   ASN  74          1HB       ASN  74 -15.164   7.895 -14.619
  546   2HB   ASN  74          2HB       ASN  74 -14.279   8.142 -16.122
  547   2HD2  ASN  74          2HD2      ASN  74 -15.201   6.520 -17.271
  548   1HD2  ASN  74          1HD2      ASN  74 -15.005   4.845 -16.897
  549    H    LEU  75           H        LEU  75 -11.030   9.389 -13.949
  550    HA   LEU  75           HA       LEU  75 -10.013  10.058 -16.398
  551   1HB   LEU  75          1HB       LEU  75  -9.045   9.705 -13.643
  552   2HB   LEU  75          2HB       LEU  75  -7.801   9.766 -14.871
  553    HG   LEU  75           HG       LEU  75  -9.960  11.861 -14.477
  554   1HD1  LEU  75          1HD1      LEU  75  -8.352  11.601 -12.545
  555   2HD1  LEU  75          2HD1      LEU  75  -7.084  12.135 -13.649
  556   3HD1  LEU  75          3HD1      LEU  75  -8.439  13.202 -13.279
  557   1HD2  LEU  75          1HD2      LEU  75  -7.914  11.438 -16.490
  558   2HD2  LEU  75          2HD2      LEU  75  -9.285  12.549 -16.486
  559   3HD2  LEU  75          3HD2      LEU  75  -7.768  13.017 -15.717
  560    H    CYS  76           H        CYS  76  -9.449   7.321 -14.406
  561    HA   CYS  76           HA       CYS  76  -7.556   6.090 -16.189
  562   1HB   CYS  76          1HB       CYS  76  -8.010   6.140 -13.505
  563   2HB   CYS  76          2HB       CYS  76  -8.637   4.562 -13.962
  564    H    ASN  77           H        ASN  77 -10.926   5.930 -15.398
  565    HA   ASN  77           HA       ASN  77 -12.645   4.567 -16.063
  566   1HB   ASN  77          1HB       ASN  77 -11.916   5.808 -18.182
  567   2HB   ASN  77          2HB       ASN  77 -11.099   4.318 -18.645
  568   2HD2  ASN  77          2HD2      ASN  77 -13.039   5.368 -20.234
  569   1HD2  ASN  77          1HD2      ASN  77 -14.443   4.363 -20.194
  570    H    ILE  78           H        ILE  78 -11.361   3.095 -14.464
  571    HA   ILE  78           HA       ILE  78 -10.819   0.588 -15.878
  572    HB   ILE  78           HB       ILE  78  -8.961   0.108 -14.681
  573   1HG1  ILE  78          1HG1      ILE  78 -10.416   1.415 -12.461
  574   2HG1  ILE  78          2HG1      ILE  78  -9.454  -0.057 -12.463
  575   1HG2  ILE  78          1HG2      ILE  78  -8.627   2.236 -15.883
  576   2HG2  ILE  78          2HG2      ILE  78  -8.992   3.104 -14.392
  577   3HG2  ILE  78          3HG2      ILE  78  -7.572   2.063 -14.479
  578   1HD1  ILE  78          1HD1      ILE  78  -7.414   1.404 -12.515
  579   2HD1  ILE  78          2HD1      ILE  78  -8.486   2.777 -12.239
  580   3HD1  ILE  78          3HD1      ILE  78  -8.376   1.490 -11.039
  581    HA   PRO  79           HA       PRO  79 -13.964  -1.117 -13.213
  582   1HB   PRO  79          1HB       PRO  79 -13.520  -3.747 -13.639
  583   2HB   PRO  79          2HB       PRO  79 -14.246  -2.715 -14.878
  584   1HG   PRO  79          1HG       PRO  79 -11.422  -3.668 -14.622
  585   2HG   PRO  79          2HG       PRO  79 -12.435  -3.542 -16.071
  586   1HD   PRO  79          1HD       PRO  79 -10.533  -1.699 -15.381
  587   2HD   PRO  79          2HD       PRO  79 -11.971  -1.313 -16.346
  588    H    CYS  80           H        CYS  80 -13.373  -0.679 -11.104
  589    HA   CYS  80           HA       CYS  80 -10.974  -1.592  -9.938
  590   1HB   CYS  80          1HB       CYS  80 -13.400  -0.182  -8.989
  591   2HB   CYS  80          2HB       CYS  80 -12.438  -1.002  -7.765
  592    H    SER  81           H        SER  81 -14.331  -2.680  -9.327
  593    HA   SER  81           HA       SER  81 -13.865  -4.648  -7.505
  594   1HB   SER  81          1HB       SER  81 -15.882  -5.800  -8.440
  595   2HB   SER  81          2HB       SER  81 -16.110  -4.075  -8.159
  596    HG   SER  81           HG       SER  81 -16.835  -4.992 -10.256
  597    H    ALA  82           H        ALA  82 -13.517  -5.013 -11.035
  598    HA   ALA  82           HA       ALA  82 -12.763  -7.795 -10.765
  599   1HB   ALA  82          1HB       ALA  82 -13.915  -6.392 -12.775
  600   2HB   ALA  82          2HB       ALA  82 -13.119  -7.953 -12.978
  601   3HB   ALA  82          3HB       ALA  82 -12.243  -6.463 -13.330
  602    H    LEU  83           H        LEU  83 -11.200  -4.790 -10.747
  603    HA   LEU  83           HA       LEU  83  -8.597  -5.963 -11.411
  604   1HB   LEU  83          1HB       LEU  83  -9.493  -3.115 -11.063
  605   2HB   LEU  83          2HB       LEU  83  -7.801  -3.556 -11.212
  606    HG   LEU  83           HG       LEU  83  -9.876  -4.254 -13.288
  607   1HD1  LEU  83          1HD1      LEU  83  -8.333  -1.767 -12.847
  608   2HD1  LEU  83          2HD1      LEU  83  -8.460  -2.362 -14.501
  609   3HD1  LEU  83          3HD1      LEU  83  -9.920  -2.007 -13.577
  610   1HD2  LEU  83          1HD2      LEU  83  -6.941  -4.599 -13.020
  611   2HD2  LEU  83          2HD2      LEU  83  -8.145  -5.658 -13.754
  612   3HD2  LEU  83          3HD2      LEU  83  -7.588  -4.224 -14.618
  613    H    LEU  84           H        LEU  84 -10.430  -5.668  -8.734
  614    HA   LEU  84           HA       LEU  84  -8.185  -5.138  -6.919
  615   1HB   LEU  84          1HB       LEU  84 -11.159  -5.317  -6.451
  616   2HB   LEU  84          2HB       LEU  84  -9.987  -5.122  -5.163
  617    HG   LEU  84           HG       LEU  84 -10.093  -3.180  -7.433
  618   1HD1  LEU  84          1HD1      LEU  84 -11.866  -3.264  -5.007
  619   2HD1  LEU  84          2HD1      LEU  84 -11.535  -1.775  -5.893
  620   3HD1  LEU  84          3HD1      LEU  84 -12.333  -3.123  -6.702
  621   1HD2  LEU  84          1HD2      LEU  84  -8.585  -3.474  -5.027
  622   2HD2  LEU  84          2HD2      LEU  84  -8.436  -2.250  -6.288
  623   3HD2  LEU  84          3HD2      LEU  84  -9.537  -1.992  -4.936
  624    H    SER  85           H        SER  85  -9.436  -7.634  -8.497
  625    HA   SER  85           HA       SER  85  -9.727  -9.598  -6.453
  626   1HB   SER  85          1HB       SER  85 -10.486  -9.502  -9.046
  627   2HB   SER  85          2HB       SER  85  -9.063 -10.535  -9.178
  628    HG   SER  85           HG       SER  85 -11.406 -10.953  -7.654
  629    H    SER  86           H        SER  86  -7.422  -8.473  -5.824
  630    HA   SER  86           HA       SER  86  -5.336  -9.000  -5.082
  631   1HB   SER  86          1HB       SER  86  -6.463 -11.577  -5.786
  632   2HB   SER  86          2HB       SER  86  -4.733 -11.535  -6.121
  633    HG   SER  86           HG       SER  86  -4.479 -10.740  -3.939
  634    H    ASP  87           H        ASP  87  -5.911  -7.738  -7.543
  635    HA   ASP  87           HA       ASP  87  -3.527  -8.436  -9.115
  636   1HB   ASP  87          1HB       ASP  87  -5.765  -8.922 -10.146
  637   2HB   ASP  87          2HB       ASP  87  -6.093  -7.197 -10.095
  638    H    ILE  88           H        ILE  88  -1.992  -6.872  -8.957
  639    HA   ILE  88           HA       ILE  88  -2.824  -4.177  -8.212
  640    HB   ILE  88           HB       ILE  88  -0.181  -3.915  -8.287
  641   1HG1  ILE  88          1HG1      ILE  88  -0.284  -6.716  -7.282
  642   2HG1  ILE  88          2HG1      ILE  88  -0.234  -6.477  -9.026
  643   1HG2  ILE  88          1HG2      ILE  88  -1.830  -5.149  -6.099
  644   2HG2  ILE  88          2HG2      ILE  88  -0.182  -4.563  -5.870
  645   3HG2  ILE  88          3HG2      ILE  88  -1.457  -3.443  -6.349
  646   1HD1  ILE  88          1HD1      ILE  88   1.730  -4.947  -7.449
  647   2HD1  ILE  88          2HD1      ILE  88   1.948  -6.696  -7.499
  648   3HD1  ILE  88          3HD1      ILE  88   1.903  -5.770  -9.000
  649    H    THR  89           H        THR  89  -2.142  -5.899 -11.019
  650    HA   THR  89           HA       THR  89  -0.613  -4.294 -12.608
  651    HB   THR  89           HB       THR  89  -3.183  -5.295 -13.770
  652    HG1  THR  89           HG1      THR  89  -2.453  -7.413 -13.638
  653   1HG2  THR  89          1HG2      THR  89  -0.715  -4.419 -14.766
  654   2HG2  THR  89          2HG2      THR  89  -0.737  -6.164 -15.019
  655   3HG2  THR  89          3HG2      THR  89  -2.031  -5.161 -15.675
  656    H    ALA  90           H        ALA  90  -4.096  -3.912 -11.998
  657    HA   ALA  90           HA       ALA  90  -4.402  -1.596 -13.513
  658   1HB   ALA  90          1HB       ALA  90  -6.107  -3.316 -12.351
  659   2HB   ALA  90          2HB       ALA  90  -6.216  -1.952 -11.238
  660   3HB   ALA  90          3HB       ALA  90  -6.572  -1.724 -12.950
  661    H    SER  91           H        SER  91  -3.851  -2.127 -10.058
  662    HA   SER  91           HA       SER  91  -4.060   0.542  -9.222
  663   1HB   SER  91          1HB       SER  91  -3.283  -0.193  -7.171
  664   2HB   SER  91          2HB       SER  91  -3.817  -1.721  -7.868
  665    HG   SER  91           HG       SER  91  -1.832  -2.384  -7.821
  666    H    VAL  92           H        VAL  92  -1.499  -1.254 -10.682
  667    HA   VAL  92           HA       VAL  92   0.383   0.923 -10.291
  668    HB   VAL  92           HB       VAL  92   0.748  -1.752 -11.643
  669   1HG1  VAL  92          1HG1      VAL  92   2.686   0.542 -11.308
  670   2HG1  VAL  92          2HG1      VAL  92   3.163  -1.095 -11.758
  671   3HG1  VAL  92          3HG1      VAL  92   2.111  -0.159 -12.820
  672   1HG2  VAL  92          1HG2      VAL  92   0.607  -1.592  -9.108
  673   2HG2  VAL  92          2HG2      VAL  92   2.053  -2.355  -9.769
  674   3HG2  VAL  92          3HG2      VAL  92   2.122  -0.693  -9.183
  675    H    ASN  93           H        ASN  93  -1.644  -0.380 -12.824
  676    HA   ASN  93           HA       ASN  93  -0.385   0.879 -14.935
  677   1HB   ASN  93          1HB       ASN  93  -1.823  -0.464 -15.957
  678   2HB   ASN  93          2HB       ASN  93  -2.756  -0.620 -14.492
  679   2HD2  ASN  93          2HD2      ASN  93  -2.280   1.331 -17.355
  680   1HD2  ASN  93          1HD2      ASN  93  -3.862   2.023 -17.381
  681    H    CYS  94           H        CYS  94  -2.999   1.747 -12.811
  682    HA   CYS  94           HA       CYS  94  -3.540   4.278 -13.953
  683   1HB   CYS  94          1HB       CYS  94  -4.880   2.764 -12.210
  684   2HB   CYS  94          2HB       CYS  94  -4.045   3.798 -11.055
  685    H    ALA  95           H        ALA  95  -1.619   3.220 -11.130
  686    HA   ALA  95           HA       ALA  95  -0.737   5.839 -10.481
  687   1HB   ALA  95          1HB       ALA  95  -0.213   4.699  -8.676
  688   2HB   ALA  95          2HB       ALA  95   1.246   4.212  -9.541
  689   3HB   ALA  95          3HB       ALA  95  -0.175   3.166  -9.546
  690    H    LYS  96           H        LYS  96   0.426   3.366 -12.667
  691    HA   LYS  96           HA       LYS  96   2.992   4.300 -13.191
  692   1HB   LYS  96          1HB       LYS  96   2.133   2.214 -14.169
  693   2HB   LYS  96          2HB       LYS  96   0.991   3.128 -15.146
  694   1HG   LYS  96          1HG       LYS  96   2.499   3.267 -16.754
  695   2HG   LYS  96          2HG       LYS  96   3.561   4.171 -15.674
  696   1HD   LYS  96          1HD       LYS  96   4.974   2.449 -15.960
  697   2HD   LYS  96          2HD       LYS  96   3.935   1.616 -14.802
  698   1HE   LYS  96          1HE       LYS  96   2.735   1.368 -17.352
  699   2HE   LYS  96          2HE       LYS  96   4.445   0.981 -17.536
  700   1HZ   LYS  96          1HZ       LYS  96   3.700  -0.311 -15.250
  701   2HZ   LYS  96          2HZ       LYS  96   2.372  -0.524 -16.275
  702   3HZ   LYS  96          3HZ       LYS  96   3.911  -1.020 -16.771
  703    H    LYS  97           H        LYS  97  -0.150   5.224 -14.262
  704    HA   LYS  97           HA       LYS  97   0.720   7.352 -16.012
  705   1HB   LYS  97          1HB       LYS  97  -1.558   5.896 -15.931
  706   2HB   LYS  97          2HB       LYS  97  -2.080   7.320 -15.041
  707   1HG   LYS  97          1HG       LYS  97  -1.877   8.703 -16.863
  708   2HG   LYS  97          2HG       LYS  97  -0.683   7.669 -17.650
  709   1HD   LYS  97          1HD       LYS  97  -2.279   6.229 -18.480
  710   2HD   LYS  97          2HD       LYS  97  -3.450   6.636 -17.224
  711   1HE   LYS  97          1HE       LYS  97  -4.240   7.575 -19.265
  712   2HE   LYS  97          2HE       LYS  97  -3.651   8.902 -18.266
  713   1HZ   LYS  97          1HZ       LYS  97  -1.497   8.638 -19.553
  714   2HZ   LYS  97          2HZ       LYS  97  -2.379   7.697 -20.647
  715   3HZ   LYS  97          3HZ       LYS  97  -2.804   9.314 -20.386
  716    H    ILE  98           H        ILE  98  -0.189   6.943 -12.694
  717    HA   ILE  98           HA       ILE  98  -0.721   9.647 -12.089
  718    HB   ILE  98           HB       ILE  98   0.101   7.363 -10.329
  719   1HG1  ILE  98          1HG1      ILE  98  -2.538   8.838 -10.587
  720   2HG1  ILE  98          2HG1      ILE  98  -2.175   7.313 -11.390
  721   1HG2  ILE  98          1HG2      ILE  98  -0.545  10.208  -9.597
  722   2HG2  ILE  98          2HG2      ILE  98  -0.628   8.874  -8.446
  723   3HG2  ILE  98          3HG2      ILE  98   0.908   9.287  -9.208
  724   1HD1  ILE  98          1HD1      ILE  98  -2.248   7.760  -8.413
  725   2HD1  ILE  98          2HD1      ILE  98  -3.499   6.978  -9.380
  726   3HD1  ILE  98          3HD1      ILE  98  -1.909   6.230  -9.225
  727    H    VAL  99           H        VAL  99   2.104   7.626 -11.657
  728    HA   VAL  99           HA       VAL  99   3.812   9.713 -10.756
  729    HB   VAL  99           HB       VAL  99   4.057   7.183 -10.361
  730   1HG1  VAL  99          1HG1      VAL  99   4.183   6.894 -12.972
  731   2HG1  VAL  99          2HG1      VAL  99   5.895   7.218 -12.700
  732   3HG1  VAL  99          3HG1      VAL  99   5.117   5.855 -11.897
  733   1HG2  VAL  99          1HG2      VAL  99   5.600   8.848  -9.502
  734   2HG2  VAL  99          2HG2      VAL  99   6.479   7.423 -10.059
  735   3HG2  VAL  99          3HG2      VAL  99   6.448   8.883 -11.048
  736    H    SER 100           H        SER 100   2.845   8.607 -13.874
  737    HA   SER 100           HA       SER 100   5.123   9.781 -15.238
  738   1HB   SER 100          1HB       SER 100   3.936   7.722 -16.081
  739   2HB   SER 100          2HB       SER 100   2.552   8.748 -16.457
  740    HG   SER 100           HG       SER 100   3.989   8.413 -18.246
  741    H    ASP 101           H        ASP 101   2.000  10.686 -14.166
  742    HA   ASP 101           HA       ASP 101   1.713  12.931 -15.965
  743   1HB   ASP 101          1HB       ASP 101  -0.214  11.592 -14.972
  744   2HB   ASP 101          2HB       ASP 101   0.117  12.420 -13.454
  745    H    GLY 102           H        GLY 102   3.532  12.340 -13.250
  746   1HA   GLY 102          1HA       GLY 102   3.734  15.232 -12.696
  747   2HA   GLY 102          2HA       GLY 102   5.062  14.093 -12.544
  748    H    ASN 103           H        ASN 103   4.206  12.113 -11.032
  749    HA   ASN 103           HA       ASN 103   3.877  13.356  -8.450
  750   1HB   ASN 103          1HB       ASN 103   1.685  11.813  -9.750
  751   2HB   ASN 103          2HB       ASN 103   1.961  11.547  -8.032
  752   2HD2  ASN 103          2HD2      ASN 103   0.656  13.602 -10.402
  753   1HD2  ASN 103          1HD2      ASN 103   0.121  14.864  -9.351
  754    H    GLY 104           H        GLY 104   5.799  12.472  -7.802
  755   1HA   GLY 104          1HA       GLY 104   7.341  10.855  -7.226
  756   2HA   GLY 104          2HA       GLY 104   6.486   9.734  -8.274
  757    H    MET 105           H        MET 105   7.604   9.543  -5.476
  758    HA   MET 105           HA       MET 105   5.440   8.011  -4.369
  759   1HB   MET 105          1HB       MET 105   7.902   8.607  -2.796
  760   2HB   MET 105          2HB       MET 105   7.008   7.100  -2.947
  761   1HG   MET 105          1HG       MET 105   8.834   8.294  -5.020
  762   2HG   MET 105          2HG       MET 105   9.203   6.931  -3.965
  763   1HE   MET 105          1HE       MET 105   7.030   5.327  -3.654
  764   2HE   MET 105          2HE       MET 105   5.643   5.814  -4.627
  765   3HE   MET 105          3HE       MET 105   6.541   4.353  -5.041
  766    H    ASN 106           H        ASN 106   6.110  11.192  -4.455
  767    HA   ASN 106           HA       ASN 106   5.685  11.963  -1.751
  768   1HB   ASN 106          1HB       ASN 106   5.095  13.813  -4.013
  769   2HB   ASN 106          2HB       ASN 106   5.975  14.101  -2.520
  770   2HD2  ASN 106          2HD2      ASN 106   6.231  13.504  -5.804
  771   1HD2  ASN 106          1HD2      ASN 106   7.931  13.213  -5.878
  772    H    ALA 107           H        ALA 107   3.644  11.577  -4.611
  773    HA   ALA 107           HA       ALA 107   1.319  12.808  -3.788
  774   1HB   ALA 107          1HB       ALA 107   2.028  10.731  -5.699
  775   2HB   ALA 107          2HB       ALA 107   0.396  10.543  -5.058
  776   3HB   ALA 107          3HB       ALA 107   0.868  12.051  -5.841
  777    H    TRP 108           H        TRP 108   2.339   9.469  -3.159
  778    HA   TRP 108           HA       TRP 108   0.103   8.982  -1.410
  779   1HB   TRP 108          1HB       TRP 108   2.574   7.317  -1.966
  780   2HB   TRP 108          2HB       TRP 108   1.157   6.772  -1.070
  781    HD1  TRP 108           HD1      TRP 108  -1.112   6.365  -2.492
  782    HE1  TRP 108           HE1      TRP 108  -1.489   5.864  -4.989
  783    HE3  TRP 108           HE3      TRP 108   3.458   7.771  -4.302
  784    HZ2  TRP 108           HZ2      TRP 108  -0.040   6.044  -7.423
  785    HZ3  TRP 108           HZ3      TRP 108   3.880   7.579  -6.716
  786    HH2  TRP 108           HH2      TRP 108   2.172   6.731  -8.239
  787    H    VAL 109           H        VAL 109   0.010   9.423   0.673
  788    HA   VAL 109           HA       VAL 109   2.098  10.798   2.000
  789    HB   VAL 109           HB       VAL 109   0.012   9.766   3.685
  790   1HG1  VAL 109          1HG1      VAL 109   1.736  11.751   3.917
  791   2HG1  VAL 109          2HG1      VAL 109   0.419  12.647   3.159
  792   3HG1  VAL 109          3HG1      VAL 109   0.150  11.805   4.686
  793   1HG2  VAL 109          1HG2      VAL 109  -0.650  11.103   1.129
  794   2HG2  VAL 109          2HG2      VAL 109  -1.558   9.893   2.035
  795   3HG2  VAL 109          3HG2      VAL 109  -1.559  11.575   2.563
  796    H    ALA 110           H        ALA 110   1.162   7.439   2.032
  797    HA   ALA 110           HA       ALA 110   2.302   6.769   4.529
  798   1HB   ALA 110          1HB       ALA 110   2.192   4.855   2.227
  799   2HB   ALA 110          2HB       ALA 110   1.969   4.540   3.948
  800   3HB   ALA 110          3HB       ALA 110   0.720   5.389   3.037
  801    H    TRP 111           H        TRP 111   3.708   7.601   1.562
  802    HA   TRP 111           HA       TRP 111   6.216   6.251   2.179
  803   1HB   TRP 111          1HB       TRP 111   5.518   6.232  -0.154
  804   2HB   TRP 111          2HB       TRP 111   5.481   7.986  -0.184
  805    HD1  TRP 111           HD1      TRP 111   7.843   5.044  -0.443
  806    HE1  TRP 111           HE1      TRP 111  10.195   5.890  -1.056
  807    HE3  TRP 111           HE3      TRP 111   7.081  10.067   0.143
  808    HZ2  TRP 111           HZ2      TRP 111  11.548   8.358  -1.265
  809    HZ3  TRP 111           HZ3      TRP 111   8.957  11.601  -0.283
  810    HH2  TRP 111           HH2      TRP 111  11.145  10.762  -0.971
  811    H    ARG 112           H        ARG 112   4.834   9.523   2.182
  812    HA   ARG 112           HA       ARG 112   7.407  10.637   2.967
  813   1HB   ARG 112          1HB       ARG 112   4.924  11.635   1.818
  814   2HB   ARG 112          2HB       ARG 112   5.528  12.640   3.127
  815   1HG   ARG 112          1HG       ARG 112   7.751  12.648   1.924
  816   2HG   ARG 112          2HG       ARG 112   6.904  11.926   0.554
  817   1HD   ARG 112          1HD       ARG 112   5.745  13.834   0.088
  818   2HD   ARG 112          2HD       ARG 112   5.731  14.365   1.769
  819    HE   ARG 112           HE       ARG 112   8.277  14.427   0.343
  820   1HH1  ARG 112          1HH1      ARG 112   5.543  16.152   1.646
  821   2HH1  ARG 112          2HH1      ARG 112   6.332  17.693   1.604
  822   1HH2  ARG 112          1HH2      ARG 112   9.323  16.453   0.285
  823   2HH2  ARG 112          2HH2      ARG 112   8.480  17.864   0.830
  824    H    ASN 113           H        ASN 113   6.417   8.826   4.793
  825    HA   ASN 113           HA       ASN 113   6.071  10.544   7.104
  826   1HB   ASN 113          1HB       ASN 113   3.804   9.417   5.971
  827   2HB   ASN 113          2HB       ASN 113   4.205   8.308   7.279
  828   2HD2  ASN 113          2HD2      ASN 113   2.267  10.726   6.624
  829   1HD2  ASN 113          1HD2      ASN 113   2.198  11.537   8.148
  830    H    ARG 114           H        ARG 114   5.672   7.099   6.360
  831    HA   ARG 114           HA       ARG 114   7.546   6.464   8.518
  832   1HB   ARG 114          1HB       ARG 114   5.287   5.062   7.204
  833   2HB   ARG 114          2HB       ARG 114   6.610   4.069   7.787
  834   1HG   ARG 114          1HG       ARG 114   5.819   4.186   9.852
  835   2HG   ARG 114          2HG       ARG 114   5.917   5.947   9.813
  836   1HD   ARG 114          1HD       ARG 114   3.655   4.743   8.353
  837   2HD   ARG 114          2HD       ARG 114   3.616   4.575  10.107
  838    HE   ARG 114           HE       ARG 114   3.889   7.190   8.775
  839   1HH1  ARG 114          1HH1      ARG 114   2.434   5.102  11.156
  840   2HH1  ARG 114          2HH1      ARG 114   1.485   6.363  11.869
  841   1HH2  ARG 114          1HH2      ARG 114   2.642   8.856   9.709
  842   2HH2  ARG 114          2HH2      ARG 114   1.602   8.496  11.046
  843    H    CYS 115           H        CYS 115   7.788   7.079   5.349
  844    HA   CYS 115           HA       CYS 115   9.805   4.977   4.914
  845   1HB   CYS 115          1HB       CYS 115   7.979   6.388   2.991
  846   2HB   CYS 115          2HB       CYS 115   9.436   5.568   2.440
  847    H    LYS 116           H        LYS 116   9.092   8.415   4.269
  848    HA   LYS 116           HA       LYS 116  11.632   9.033   3.225
  849   1HB   LYS 116          1HB       LYS 116   9.355  10.381   3.286
  850   2HB   LYS 116          2HB       LYS 116  10.067  11.082   4.732
  851   1HG   LYS 116          1HG       LYS 116  12.116  11.542   3.250
  852   2HG   LYS 116          2HG       LYS 116  11.019  11.245   1.899
  853   1HD   LYS 116          1HD       LYS 116   9.830  13.150   2.268
  854   2HD   LYS 116          2HD       LYS 116  10.087  13.101   4.014
  855   1HE   LYS 116          1HE       LYS 116  11.273  14.984   3.118
  856   2HE   LYS 116          2HE       LYS 116  12.446  13.771   3.629
  857   1HZ   LYS 116          1HZ       LYS 116  11.899  13.194   0.998
  858   2HZ   LYS 116          2HZ       LYS 116  12.022  14.880   1.048
  859   3HZ   LYS 116          3HZ       LYS 116  13.301  13.921   1.603
  860    H    GLY 117           H        GLY 117  13.198   8.093   4.569
  861   1HA   GLY 117          1HA       GLY 117  13.366   9.074   7.323
  862   2HA   GLY 117          2HA       GLY 117  14.680   9.483   6.232
  863    H    THR 118           H        THR 118  13.535   6.497   5.308
  864    HA   THR 118           HA       THR 118  15.490   5.122   7.028
  865    HB   THR 118           HB       THR 118  14.158   3.054   6.660
  866    HG1  THR 118           HG1      THR 118  12.894   4.633   4.894
  867   1HG2  THR 118          1HG2      THR 118  12.642   5.360   7.890
  868   2HG2  THR 118          2HG2      THR 118  12.305   3.651   8.167
  869   3HG2  THR 118          3HG2      THR 118  13.835   4.346   8.702
  870    H    ASP 119           H        ASP 119  15.058   2.671   5.351
  871    HA   ASP 119           HA       ASP 119  16.400   3.493   2.888
  872   1HB   ASP 119          1HB       ASP 119  17.884   2.590   4.831
  873   2HB   ASP 119          2HB       ASP 119  17.319   1.057   4.208
  874    H    VAL 120           H        VAL 120  15.140   2.868   1.267
  875    HA   VAL 120           HA       VAL 120  13.332   0.654   1.500
  876    HB   VAL 120           HB       VAL 120  12.749   1.176  -0.856
  877   1HG1  VAL 120          1HG1      VAL 120  12.266   2.700   1.439
  878   2HG1  VAL 120          2HG1      VAL 120  12.575   3.864   0.151
  879   3HG1  VAL 120          3HG1      VAL 120  11.306   2.654  -0.039
  880   1HG2  VAL 120          1HG2      VAL 120  14.953   3.205  -0.548
  881   2HG2  VAL 120          2HG2      VAL 120  14.812   1.930  -1.758
  882   3HG2  VAL 120          3HG2      VAL 120  13.712   3.308  -1.798
  883    H    GLN 121           H        GLN 121  16.480   1.258   0.138
  884    HA   GLN 121           HA       GLN 121  16.666  -0.898  -1.642
  885   1HB   GLN 121          1HB       GLN 121  18.321   1.103  -1.051
  886   2HB   GLN 121          2HB       GLN 121  19.051  -0.123  -0.022
  887   1HG   GLN 121          1HG       GLN 121  19.582  -1.496  -1.847
  888   2HG   GLN 121          2HG       GLN 121  18.511  -0.610  -2.931
  889   2HE2  GLN 121          2HE2      GLN 121  19.257   1.149  -3.984
  890   1HE2  GLN 121          1HE2      GLN 121  20.873   1.746  -3.857
  891    H    ALA 122           H        ALA 122  16.735  -0.699   1.796
  892    HA   ALA 122           HA       ALA 122  17.733  -3.411   2.130
  893   1HB   ALA 122          1HB       ALA 122  18.439  -1.593   3.671
  894   2HB   ALA 122          2HB       ALA 122  17.693  -2.963   4.494
  895   3HB   ALA 122          3HB       ALA 122  16.774  -1.479   4.239
  896    H    TRP 123           H        TRP 123  14.764  -1.728   1.812
  897    HA   TRP 123           HA       TRP 123  13.079  -3.444   3.316
  898   1HB   TRP 123          1HB       TRP 123  12.681  -1.401   1.193
  899   2HB   TRP 123          2HB       TRP 123  11.374  -2.548   1.462
  900    HD1  TRP 123           HD1      TRP 123  11.705   0.745   2.234
  901    HE1  TRP 123           HE1      TRP 123  10.889   1.415   4.581
  902    HE3  TRP 123           HE3      TRP 123  11.712  -3.834   4.475
  903    HZ2  TRP 123           HZ2      TRP 123  10.333   0.135   7.024
  904    HZ3  TRP 123           HZ3      TRP 123  11.027  -4.033   6.809
  905    HH2  TRP 123           HH2      TRP 123  10.344  -2.065   8.071
  906    H    ILE 124           H        ILE 124  14.719  -3.864   0.357
  907    HA   ILE 124           HA       ILE 124  13.144  -6.298  -0.177
  908    HB   ILE 124           HB       ILE 124  13.749  -6.020  -2.588
  909   1HG1  ILE 124          1HG1      ILE 124  14.194  -3.117  -2.189
  910   2HG1  ILE 124          2HG1      ILE 124  15.533  -4.171  -1.745
  911   1HG2  ILE 124          1HG2      ILE 124  11.690  -4.879  -1.116
  912   2HG2  ILE 124          2HG2      ILE 124  12.231  -3.592  -2.195
  913   3HG2  ILE 124          3HG2      ILE 124  11.723  -5.145  -2.859
  914   1HD1  ILE 124          1HD1      ILE 124  14.370  -4.826  -4.330
  915   2HD1  ILE 124          2HD1      ILE 124  15.023  -3.190  -4.245
  916   3HD1  ILE 124          3HD1      ILE 124  16.053  -4.571  -3.870
  917    H    ARG 125           H        ARG 125  15.907  -5.383   1.092
  918    HA   ARG 125           HA       ARG 125  17.901  -6.728  -0.395
  919   1HB   ARG 125          1HB       ARG 125  17.858  -5.100   1.836
  920   2HB   ARG 125          2HB       ARG 125  18.356  -6.653   2.491
  921   1HG   ARG 125          1HG       ARG 125  20.035  -6.640   0.497
  922   2HG   ARG 125          2HG       ARG 125  19.736  -4.901   0.514
  923   1HD   ARG 125          1HD       ARG 125  21.542  -5.073   1.933
  924   2HD   ARG 125          2HD       ARG 125  20.194  -5.128   3.069
  925    HE   ARG 125           HE       ARG 125  21.275  -7.664   2.108
  926   1HH1  ARG 125          1HH1      ARG 125  20.982  -5.320   4.671
  927   2HH1  ARG 125          2HH1      ARG 125  21.514  -6.414   5.905
  928   1HH2  ARG 125          1HH2      ARG 125  21.976  -9.109   3.726
  929   2HH2  ARG 125          2HH2      ARG 125  22.079  -8.566   5.368
  930    H    GLY 126           H        GLY 126  17.679  -8.825  -0.890
  931   1HA   GLY 126          1HA       GLY 126  17.239 -10.697   1.347
  932   2HA   GLY 126          2HA       GLY 126  18.155 -11.067  -0.106
  933    H    CYS 127           H        CYS 127  15.502  -9.333  -1.032
  934    HA   CYS 127           HA       CYS 127  13.452 -11.246  -0.935
  935   1HB   CYS 127          1HB       CYS 127  13.905  -8.711  -2.288
  936   2HB   CYS 127          2HB       CYS 127  12.679  -9.744  -2.994
  937    H    ARG 128           H        ARG 128  13.124 -13.028  -2.088
  938    HA   ARG 128           HA       ARG 128  14.927 -13.673  -4.257
  939   1HB   ARG 128          1HB       ARG 128  13.763 -15.186  -2.323
  940   2HB   ARG 128          2HB       ARG 128  12.684 -15.500  -3.674
  941   1HG   ARG 128          1HG       ARG 128  14.288 -16.584  -4.888
  942   2HG   ARG 128          2HG       ARG 128  15.615 -15.705  -4.126
  943   1HD   ARG 128          1HD       ARG 128  15.821 -17.214  -2.481
  944   2HD   ARG 128          2HD       ARG 128  14.077 -17.359  -2.271
  945    HE   ARG 128           HE       ARG 128  15.040 -18.634  -4.653
  946   1HH1  ARG 128          1HH1      ARG 128  14.548 -19.009  -1.224
  947   2HH1  ARG 128          2HH1      ARG 128  14.463 -20.737  -1.294
  948   1HH2  ARG 128          1HH2      ARG 128  14.929 -20.909  -4.755
  949   2HH2  ARG 128          2HH2      ARG 128  14.680 -21.818  -3.302
  950    H    LEU 129           H        LEU 129  14.417 -12.486  -6.036
  951    HA   LEU 129           HA       LEU 129  11.958 -13.207  -7.404
  952   1HB   LEU 129          1HB       LEU 129  11.205 -10.991  -7.790
  953   2HB   LEU 129          2HB       LEU 129  11.465 -11.150  -6.064
  954    HG   LEU 129           HG       LEU 129  13.854 -10.146  -7.308
  955   1HD1  LEU 129          1HD1      LEU 129  11.565  -9.310  -8.660
  956   2HD1  LEU 129          2HD1      LEU 129  11.975  -7.980  -7.577
  957   3HD1  LEU 129          3HD1      LEU 129  13.169  -8.582  -8.726
  958   1HD2  LEU 129          1HD2      LEU 129  12.370  -9.847  -4.954
  959   2HD2  LEU 129          2HD2      LEU 129  13.921  -9.105  -5.349
  960   3HD2  LEU 129          3HD2      LEU 129  12.419  -8.247  -5.697

  No H/Q in entry =         960
  Start of MODEL   12
    1    H1   LYS   1           H1       LYS   1  -7.386  -8.316   0.829
    2    H2   LYS   1           H2       LYS   1  -8.109  -9.287  -0.353
    3    H3   LYS   1           H3       LYS   1  -8.136  -9.768   1.268
    4    HA   LYS   1           HA       LYS   1  -6.203 -10.785   1.101
    5   1HB   LYS   1          1HB       LYS   1  -7.308 -10.966  -1.278
    6   2HB   LYS   1          2HB       LYS   1  -5.954  -9.958  -1.769
    7   1HG   LYS   1          1HG       LYS   1  -4.919 -11.914  -2.093
    8   2HG   LYS   1          2HG       LYS   1  -4.674 -11.873  -0.346
    9   1HD   LYS   1          1HD       LYS   1  -5.638 -13.917  -0.452
   10   2HD   LYS   1          2HD       LYS   1  -7.128 -12.969  -0.441
   11   1HE   LYS   1          1HE       LYS   1  -7.351 -13.134  -2.798
   12   2HE   LYS   1          2HE       LYS   1  -5.719 -13.774  -2.975
   13   1HZ   LYS   1          1HZ       LYS   1  -7.962 -15.162  -1.612
   14   2HZ   LYS   1          2HZ       LYS   1  -7.408 -15.503  -3.173
   15   3HZ   LYS   1          3HZ       LYS   1  -6.404 -15.781  -1.841
   16    H    VAL   2           H        VAL   2  -4.247 -10.263   1.827
   17    HA   VAL   2           HA       VAL   2  -3.079  -7.695   0.970
   18    HB   VAL   2           HB       VAL   2  -2.759  -9.155   3.597
   19   1HG1  VAL   2          1HG1      VAL   2  -0.781  -7.734   2.431
   20   2HG1  VAL   2          2HG1      VAL   2  -1.642  -6.446   3.274
   21   3HG1  VAL   2          3HG1      VAL   2  -1.020  -7.829   4.175
   22   1HG2  VAL   2          1HG2      VAL   2  -4.696  -7.347   2.746
   23   2HG2  VAL   2          2HG2      VAL   2  -4.343  -7.819   4.409
   24   3HG2  VAL   2          3HG2      VAL   2  -3.576  -6.390   3.717
   25    H    PHE   3           H        PHE   3  -1.217  -7.780  -0.148
   26    HA   PHE   3           HA       PHE   3   0.082 -10.264  -0.673
   27   1HB   PHE   3          1HB       PHE   3   0.973  -7.424  -1.227
   28   2HB   PHE   3          2HB       PHE   3   1.769  -8.863  -1.845
   29    HD1  PHE   3           HD1      PHE   3  -1.321 -10.028  -2.111
   30    HD2  PHE   3           HD2      PHE   3   0.974  -6.794  -3.644
   31    HE1  PHE   3           HE1      PHE   3  -2.756  -9.956  -4.108
   32    HE2  PHE   3           HE2      PHE   3  -0.449  -6.714  -5.636
   33    HZ   PHE   3           HZ       PHE   3  -2.317  -8.296  -5.877
   34    H    GLY   4           H        GLY   4   2.666 -10.079  -0.543
   35   1HA   GLY   4          1HA       GLY   4   4.124 -10.764   1.236
   36   2HA   GLY   4          2HA       GLY   4   3.251  -9.679   2.312
   37    H    ARG   5           H        ARG   5   6.148  -9.857   1.686
   38    HA   ARG   5           HA       ARG   5   6.524  -7.023   1.125
   39   1HB   ARG   5          1HB       ARG   5   8.968  -7.660   1.747
   40   2HB   ARG   5          2HB       ARG   5   7.753  -7.587   3.014
   41   1HG   ARG   5          1HG       ARG   5   7.547  -9.968   3.050
   42   2HG   ARG   5          2HG       ARG   5   8.578 -10.126   1.626
   43   1HD   ARG   5          1HD       ARG   5   9.914 -10.651   3.522
   44   2HD   ARG   5          2HD       ARG   5  10.416  -9.059   2.957
   45    HE   ARG   5           HE       ARG   5   8.454  -9.175   5.112
   46   1HH1  ARG   5          1HH1      ARG   5  11.741  -8.621   4.100
   47   2HH1  ARG   5          2HH1      ARG   5  12.183  -7.786   5.552
   48   1HH2  ARG   5          1HH2      ARG   5   9.027  -8.078   7.027
   49   2HH2  ARG   5          2HH2      ARG   5  10.641  -7.478   7.217
   50    H    CYS   6           H        CYS   6   8.136 -10.042   0.084
   51    HA   CYS   6           HA       CYS   6   9.172  -8.670  -2.228
   52   1HB   CYS   6          1HB       CYS   6   9.316 -11.633  -1.746
   53   2HB   CYS   6          2HB       CYS   6  10.380 -10.616  -2.713
   54    H    GLU   7           H        GLU   7   6.685 -11.095  -1.562
   55    HA   GLU   7           HA       GLU   7   6.041 -11.960  -4.078
   56   1HB   GLU   7          1HB       GLU   7   4.374 -11.328  -1.674
   57   2HB   GLU   7          2HB       GLU   7   3.559 -11.705  -3.185
   58   1HG   GLU   7          1HG       GLU   7   5.498 -13.683  -2.895
   59   2HG   GLU   7          2HG       GLU   7   4.812 -13.463  -1.286
   60    H    LEU   8           H        LEU   8   4.911  -9.000  -2.511
   61    HA   LEU   8           HA       LEU   8   3.573  -7.969  -4.783
   62   1HB   LEU   8          1HB       LEU   8   3.062  -7.261  -2.487
   63   2HB   LEU   8          2HB       LEU   8   4.651  -6.539  -2.351
   64    HG   LEU   8           HG       LEU   8   2.521  -5.078  -2.868
   65   1HD1  LEU   8          1HD1      LEU   8   5.281  -4.799  -3.989
   66   2HD1  LEU   8          2HD1      LEU   8   4.060  -3.551  -4.233
   67   3HD1  LEU   8          3HD1      LEU   8   4.554  -3.991  -2.599
   68   1HD2  LEU   8          1HD2      LEU   8   1.968  -6.425  -4.913
   69   2HD2  LEU   8          2HD2      LEU   8   2.095  -4.686  -5.174
   70   3HD2  LEU   8          3HD2      LEU   8   3.413  -5.751  -5.665
   71    H    ALA   9           H        ALA   9   6.875  -7.573  -3.489
   72    HA   ALA   9           HA       ALA   9   7.645  -5.483  -5.215
   73   1HB   ALA   9          1HB       ALA   9   9.170  -7.527  -3.665
   74   2HB   ALA   9          2HB       ALA   9   9.081  -5.779  -3.438
   75   3HB   ALA   9          3HB       ALA   9   9.997  -6.448  -4.789
   76    H    ALA  10           H        ALA  10   8.199  -9.005  -5.534
   77    HA   ALA  10           HA       ALA  10   9.490  -9.020  -7.958
   78   1HB   ALA  10          1HB       ALA  10   8.851 -11.285  -8.180
   79   2HB   ALA  10          2HB       ALA  10   7.384 -11.047  -7.230
   80   3HB   ALA  10          3HB       ALA  10   8.963 -10.995  -6.444
   81    H    ALA  11           H        ALA  11   6.050  -8.740  -7.230
   82    HA   ALA  11           HA       ALA  11   5.131  -8.879  -9.881
   83   1HB   ALA  11          1HB       ALA  11   3.923  -7.579  -7.461
   84   2HB   ALA  11          2HB       ALA  11   3.562  -9.182  -8.100
   85   3HB   ALA  11          3HB       ALA  11   3.089  -7.745  -9.006
   86    H    MET  12           H        MET  12   6.333  -6.345  -7.929
   87    HA   MET  12           HA       MET  12   5.657  -4.146  -9.583
   88   1HB   MET  12          1HB       MET  12   8.160  -4.196  -7.928
   89   2HB   MET  12          2HB       MET  12   7.111  -2.844  -8.271
   90   1HG   MET  12          1HG       MET  12   6.247  -5.167  -6.600
   91   2HG   MET  12          2HG       MET  12   7.026  -3.736  -5.931
   92   1HE   MET  12          1HE       MET  12   6.271  -1.395  -6.852
   93   2HE   MET  12          2HE       MET  12   5.333  -1.630  -8.325
   94   3HE   MET  12          3HE       MET  12   4.576  -0.912  -6.905
   95    H    LYS  13           H        LYS  13   8.628  -6.065  -9.295
   96    HA   LYS  13           HA       LYS  13  10.235  -4.801 -11.131
   97   1HB   LYS  13          1HB       LYS  13  10.498  -7.030  -9.642
   98   2HB   LYS  13          2HB       LYS  13  10.261  -7.766 -11.221
   99   1HG   LYS  13          1HG       LYS  13  12.234  -5.566 -11.025
  100   2HG   LYS  13          2HG       LYS  13  12.657  -7.117 -10.297
  101   1HD   LYS  13          1HD       LYS  13  11.508  -7.567 -12.877
  102   2HD   LYS  13          2HD       LYS  13  12.800  -6.373 -13.015
  103   1HE   LYS  13          1HE       LYS  13  13.488  -8.624 -11.295
  104   2HE   LYS  13          2HE       LYS  13  13.125  -9.102 -12.953
  105   1HZ   LYS  13          1HZ       LYS  13  14.816  -6.785 -12.773
  106   2HZ   LYS  13          2HZ       LYS  13  15.506  -8.164 -12.078
  107   3HZ   LYS  13          3HZ       LYS  13  15.006  -8.190 -13.693
  108    H    ARG  14           H        ARG  14   7.979  -7.474 -11.771
  109    HA   ARG  14           HA       ARG  14   8.338  -7.523 -14.553
  110   1HB   ARG  14          1HB       ARG  14   5.996  -8.355 -12.833
  111   2HB   ARG  14          2HB       ARG  14   6.079  -8.654 -14.564
  112   1HG   ARG  14          1HG       ARG  14   8.390  -9.752 -13.900
  113   2HG   ARG  14          2HG       ARG  14   7.577  -9.923 -12.344
  114   1HD   ARG  14          1HD       ARG  14   7.122 -11.914 -13.515
  115   2HD   ARG  14          2HD       ARG  14   5.648 -10.953 -13.623
  116    HE   ARG  14           HE       ARG  14   6.214 -10.452 -15.902
  117   1HH1  ARG  14          1HH1      ARG  14   8.157 -12.917 -14.389
  118   2HH1  ARG  14          2HH1      ARG  14   8.681 -13.606 -15.887
  119   1HH2  ARG  14          1HH2      ARG  14   6.899 -11.354 -17.882
  120   2HH2  ARG  14          2HH2      ARG  14   7.966 -12.718 -17.873
  121    H    HIS  15           H        HIS  15   6.283  -5.582 -12.460
  122    HA   HIS  15           HA       HIS  15   4.722  -4.500 -14.583
  123   1HB   HIS  15          1HB       HIS  15   4.972  -4.074 -11.655
  124   2HB   HIS  15          2HB       HIS  15   4.283  -2.759 -12.600
  125    HD1  HIS  15           HD1      HIS  15   2.798  -4.709 -10.496
  126    HD2  HIS  15           HD2      HIS  15   2.544  -4.808 -14.642
  127    HE1  HIS  15           HE1      HIS  15   0.612  -5.840 -11.008
  128    HE2  HIS  15           HE2      HIS  15   0.518  -5.964 -13.523
  129    H    GLY  16           H        GLY  16   7.942  -3.953 -13.816
  130   1HA   GLY  16          1HA       GLY  16   8.038  -1.719 -15.529
  131   2HA   GLY  16          2HA       GLY  16   9.378  -2.431 -14.660
  132    H    LEU  17           H        LEU  17   7.961  -1.876 -11.967
  133    HA   LEU  17           HA       LEU  17   8.007   1.033 -12.040
  134   1HB   LEU  17          1HB       LEU  17   7.669  -0.567  -9.537
  135   2HB   LEU  17          2HB       LEU  17   7.067   1.035  -9.905
  136    HG   LEU  17           HG       LEU  17   5.899  -1.610 -10.484
  137   1HD1  LEU  17          1HD1      LEU  17   5.181   0.316  -8.849
  138   2HD1  LEU  17          2HD1      LEU  17   4.412   0.968 -10.297
  139   3HD1  LEU  17          3HD1      LEU  17   3.969  -0.635  -9.709
  140   1HD2  LEU  17          1HD2      LEU  17   5.617   0.716 -12.392
  141   2HD2  LEU  17          2HD2      LEU  17   6.248  -0.889 -12.760
  142   3HD2  LEU  17          3HD2      LEU  17   4.545  -0.684 -12.355
  143    H    ASP  18           H        ASP  18  10.255  -1.175 -12.003
  144    HA   ASP  18           HA       ASP  18  11.927  -0.343  -9.841
  145   1HB   ASP  18          1HB       ASP  18  12.505  -2.469 -10.470
  146   2HB   ASP  18          2HB       ASP  18  12.222  -2.163 -12.174
  147    H    ASN  19           H        ASN  19  12.119   1.845  -9.948
  148    HA   ASN  19           HA       ASN  19  13.084   3.831 -10.433
  149   1HB   ASN  19          1HB       ASN  19  15.091   2.158 -10.759
  150   2HB   ASN  19          2HB       ASN  19  14.895   2.568 -12.460
  151   2HD2  ASN  19          2HD2      ASN  19  14.882   4.287  -9.350
  152   1HD2  ASN  19          1HD2      ASN  19  15.943   5.553  -9.855
  153    H    TYR  20           H        TYR  20  10.792   3.038 -11.849
  154    HA   TYR  20           HA       TYR  20  11.011   3.658 -14.629
  155   1HB   TYR  20          1HB       TYR  20   9.125   2.363 -13.604
  156   2HB   TYR  20          2HB       TYR  20   8.581   3.841 -12.825
  157    HD1  TYR  20           HD1      TYR  20   9.437   2.605 -16.254
  158    HD2  TYR  20           HD2      TYR  20   6.891   5.021 -13.847
  159    HE1  TYR  20           HE1      TYR  20   8.089   3.150 -18.236
  160    HE2  TYR  20           HE2      TYR  20   5.535   5.572 -15.823
  161    HH   TYR  20           HH       TYR  20   5.264   5.296 -18.006
  162    H    ARG  21           H        ARG  21   9.566   5.618 -15.439
  163    HA   ARG  21           HA       ARG  21  10.772   7.946 -15.239
  164   1HB   ARG  21          1HB       ARG  21   7.785   7.533 -15.247
  165   2HB   ARG  21          2HB       ARG  21   8.531   9.106 -15.490
  166   1HG   ARG  21          1HG       ARG  21   9.298   6.782 -17.208
  167   2HG   ARG  21          2HG       ARG  21   7.836   7.711 -17.543
  168   1HD   ARG  21          1HD       ARG  21   9.010   9.621 -18.069
  169   2HD   ARG  21          2HD       ARG  21  10.411   9.151 -17.108
  170    HE   ARG  21           HE       ARG  21  10.681   7.376 -18.947
  171   1HH1  ARG  21          1HH1      ARG  21   9.439  10.595 -19.437
  172   2HH1  ARG  21          2HH1      ARG  21   9.973  10.689 -21.082
  173   1HH2  ARG  21          1HH2      ARG  21  11.387   7.491 -21.112
  174   2HH2  ARG  21          2HH2      ARG  21  11.079   8.924 -22.035
  175    H    GLY  22           H        GLY  22   8.890   6.519 -12.747
  176   1HA   GLY  22          1HA       GLY  22   8.164   7.387 -10.674
  177   2HA   GLY  22          2HA       GLY  22   9.013   8.885 -11.033
  178    H    TYR  23           H        TYR  23   9.116   5.954  -9.378
  179    HA   TYR  23           HA       TYR  23  11.976   6.341  -8.792
  180   1HB   TYR  23          1HB       TYR  23   9.706   5.843  -6.890
  181   2HB   TYR  23          2HB       TYR  23  11.383   5.574  -6.432
  182    HD1  TYR  23           HD1      TYR  23   9.173   8.206  -7.887
  183    HD2  TYR  23           HD2      TYR  23  12.588   7.333  -5.506
  184    HE1  TYR  23           HE1      TYR  23   9.385  10.590  -7.332
  185    HE2  TYR  23           HE2      TYR  23  12.811   9.716  -4.944
  186    HH   TYR  23           HH       TYR  23  11.985  11.756  -5.205
  187    H    SER  24           H        SER  24  12.739   4.462  -7.261
  188    HA   SER  24           HA       SER  24  12.738   2.124  -8.908
  189   1HB   SER  24          1HB       SER  24  14.467   1.310  -7.440
  190   2HB   SER  24          2HB       SER  24  14.773   3.016  -7.765
  191    HG   SER  24           HG       SER  24  14.842   2.148  -5.475
  192    H    LEU  25           H        LEU  25  12.443  -0.024  -8.075
  193    HA   LEU  25           HA       LEU  25   9.951  -0.628  -7.211
  194   1HB   LEU  25          1HB       LEU  25  12.537  -2.112  -6.853
  195   2HB   LEU  25          2HB       LEU  25  11.018  -2.793  -6.309
  196    HG   LEU  25           HG       LEU  25  11.939  -2.254  -9.106
  197   1HD1  LEU  25          1HD1      LEU  25  12.380  -4.435  -8.011
  198   2HD1  LEU  25          2HD1      LEU  25  10.639  -4.660  -7.849
  199   3HD1  LEU  25          3HD1      LEU  25  11.368  -4.555  -9.451
  200   1HD2  LEU  25          1HD2      LEU  25   9.136  -2.350  -8.087
  201   2HD2  LEU  25          2HD2      LEU  25   9.843  -1.333  -9.343
  202   3HD2  LEU  25          3HD2      LEU  25   9.517  -3.036  -9.667
  203    H    GLY  26           H        GLY  26  12.802  -0.537  -5.045
  204   1HA   GLY  26          1HA       GLY  26  12.956   0.062  -2.830
  205   2HA   GLY  26          2HA       GLY  26  11.653  -1.099  -2.650
  206    H    ASN  27           H        ASN  27  11.479   2.031  -4.307
  207    HA   ASN  27           HA       ASN  27  10.304   3.439  -2.149
  208   1HB   ASN  27          1HB       ASN  27  10.370   3.925  -5.122
  209   2HB   ASN  27          2HB       ASN  27   9.532   5.012  -4.017
  210   2HD2  ASN  27          2HD2      ASN  27  12.671   3.412  -4.417
  211   1HD2  ASN  27          1HD2      ASN  27  13.616   4.754  -3.879
  212    H    TRP  28           H        TRP  28   9.022   1.479  -4.735
  213    HA   TRP  28           HA       TRP  28   6.279   2.154  -4.372
  214   1HB   TRP  28          1HB       TRP  28   7.590  -0.230  -5.666
  215   2HB   TRP  28          2HB       TRP  28   5.867   0.139  -5.748
  216    HD1  TRP  28           HD1      TRP  28   9.210   1.176  -7.168
  217    HE1  TRP  28           HE1      TRP  28   8.840   2.862  -9.063
  218    HE3  TRP  28           HE3      TRP  28   4.213   1.965  -6.547
  219    HZ2  TRP  28           HZ2      TRP  28   6.694   4.329 -10.179
  220    HZ3  TRP  28           HZ3      TRP  28   3.050   3.514  -8.058
  221    HH2  TRP  28           HH2      TRP  28   4.271   4.681  -9.846
  222    H    VAL  29           H        VAL  29   8.369  -0.447  -3.173
  223    HA   VAL  29           HA       VAL  29   6.341  -1.928  -1.922
  224    HB   VAL  29           HB       VAL  29   9.285  -1.766  -1.271
  225   1HG1  VAL  29          1HG1      VAL  29   7.103  -3.290  -0.088
  226   2HG1  VAL  29          2HG1      VAL  29   8.442  -4.299  -0.634
  227   3HG1  VAL  29          3HG1      VAL  29   8.734  -2.991   0.512
  228   1HG2  VAL  29          1HG2      VAL  29   8.623  -2.410  -3.627
  229   2HG2  VAL  29          2HG2      VAL  29   9.624  -3.571  -2.754
  230   3HG2  VAL  29          3HG2      VAL  29   7.892  -3.854  -2.926
  231    H    CYS  30           H        CYS  30   8.635   0.451  -0.625
  232    HA   CYS  30           HA       CYS  30   7.745   0.336   2.018
  233   1HB   CYS  30          1HB       CYS  30   9.849   1.446   1.113
  234   2HB   CYS  30          2HB       CYS  30   8.827   2.821   0.704
  235    H    ALA  31           H        ALA  31   6.734   2.511  -0.637
  236    HA   ALA  31           HA       ALA  31   4.951   4.053   0.875
  237   1HB   ALA  31          1HB       ALA  31   4.998   3.408  -2.066
  238   2HB   ALA  31          2HB       ALA  31   3.928   4.603  -1.335
  239   3HB   ALA  31          3HB       ALA  31   5.676   4.825  -1.265
  240    H    ALA  32           H        ALA  32   4.387   1.149  -1.094
  241    HA   ALA  32           HA       ALA  32   1.598   1.045  -0.627
  242   1HB   ALA  32          1HB       ALA  32   1.933  -0.287  -2.388
  243   2HB   ALA  32          2HB       ALA  32   2.301  -1.538  -1.201
  244   3HB   ALA  32          3HB       ALA  32   3.608  -0.611  -1.937
  245    H    LYS  33           H        LYS  33   4.328  -0.696   0.869
  246    HA   LYS  33           HA       LYS  33   3.058  -2.431   2.513
  247   1HB   LYS  33          1HB       LYS  33   5.469  -2.339   2.347
  248   2HB   LYS  33          2HB       LYS  33   5.495  -0.755   3.108
  249   1HG   LYS  33          1HG       LYS  33   4.685  -1.719   5.188
  250   2HG   LYS  33          2HG       LYS  33   4.606  -3.310   4.428
  251   1HD   LYS  33          1HD       LYS  33   7.206  -2.236   3.997
  252   2HD   LYS  33          2HD       LYS  33   6.814  -2.071   5.710
  253   1HE   LYS  33          1HE       LYS  33   6.255  -4.446   5.814
  254   2HE   LYS  33          2HE       LYS  33   6.619  -4.614   4.098
  255   1HZ   LYS  33          1HZ       LYS  33   8.912  -3.741   4.735
  256   2HZ   LYS  33          2HZ       LYS  33   8.483  -4.105   6.330
  257   3HZ   LYS  33          3HZ       LYS  33   8.536  -5.331   5.168
  258    H    PHE  34           H        PHE  34   4.017   0.855   3.492
  259    HA   PHE  34           HA       PHE  34   2.500   0.678   5.884
  260   1HB   PHE  34          1HB       PHE  34   4.200   2.671   4.632
  261   2HB   PHE  34          2HB       PHE  34   3.013   3.292   5.760
  262    HD1  PHE  34           HD1      PHE  34   3.030   2.423   8.112
  263    HD2  PHE  34           HD2      PHE  34   6.165   1.615   5.350
  264    HE1  PHE  34           HE1      PHE  34   4.515   1.822   9.980
  265    HE2  PHE  34           HE2      PHE  34   7.656   1.011   7.213
  266    HZ   PHE  34           HZ       PHE  34   6.831   1.115   9.532
  267    H    GLU  35           H        GLU  35   1.759   1.722   2.684
  268    HA   GLU  35           HA       GLU  35  -0.274   3.542   3.200
  269   1HB   GLU  35          1HB       GLU  35   0.867   2.260   0.983
  270   2HB   GLU  35          2HB       GLU  35  -0.848   1.877   0.913
  271   1HG   GLU  35          1HG       GLU  35  -1.468   4.082   0.653
  272   2HG   GLU  35          2HG       GLU  35   0.022   4.694   1.369
  273    H    SER  36           H        SER  36  -0.597   0.095   2.415
  274    HA   SER  36           HA       SER  36  -3.164   0.075   3.876
  275   1HB   SER  36          1HB       SER  36  -3.833  -1.656   2.072
  276   2HB   SER  36          2HB       SER  36  -3.793   0.041   1.598
  277    HG   SER  36           HG       SER  36  -2.081  -0.320   0.387
  278    H    ASN  37           H        ASN  37  -0.227  -0.964   4.299
  279    HA   ASN  37           HA       ASN  37   0.758  -2.767   5.308
  280   1HB   ASN  37          1HB       ASN  37  -1.788  -2.525   6.479
  281   2HB   ASN  37          2HB       ASN  37  -1.613  -4.237   6.101
  282   2HD2  ASN  37          2HD2      ASN  37   0.718  -5.034   6.649
  283   1HD2  ASN  37          1HD2      ASN  37   1.260  -4.622   8.237
  284    H    PHE  38           H        PHE  38  -0.104  -2.777   2.557
  285    HA   PHE  38           HA       PHE  38   0.104  -4.049   0.757
  286   1HB   PHE  38          1HB       PHE  38   0.695  -6.157   2.813
  287   2HB   PHE  38          2HB       PHE  38   0.597  -6.543   1.095
  288    HD1  PHE  38           HD1      PHE  38   1.839  -4.446  -0.293
  289    HD2  PHE  38           HD2      PHE  38   2.890  -6.043   3.505
  290    HE1  PHE  38           HE1      PHE  38   4.139  -3.649  -0.610
  291    HE2  PHE  38           HE2      PHE  38   5.197  -5.243   3.200
  292    HZ   PHE  38           HZ       PHE  38   5.828  -4.056   1.138
  293    H    ASN  39           H        ASN  39  -2.434  -3.581   2.246
  294    HA   ASN  39           HA       ASN  39  -4.063  -5.863   1.478
  295   1HB   ASN  39          1HB       ASN  39  -4.360  -4.229   3.544
  296   2HB   ASN  39          2HB       ASN  39  -5.270  -3.283   2.372
  297   2HD2  ASN  39          2HD2      ASN  39  -5.985  -4.921   4.810
  298   1HD2  ASN  39          1HD2      ASN  39  -7.276  -5.934   4.273
  299    H    THR  40           H        THR  40  -4.433  -6.065  -0.611
  300    HA   THR  40           HA       THR  40  -4.595  -3.757  -2.353
  301    HB   THR  40           HB       THR  40  -4.256  -5.200  -4.103
  302    HG1  THR  40           HG1      THR  40  -4.995  -7.622  -3.203
  303   1HG2  THR  40          1HG2      THR  40  -2.792  -5.787  -1.829
  304   2HG2  THR  40          2HG2      THR  40  -3.296  -7.366  -2.432
  305   3HG2  THR  40          3HG2      THR  40  -2.398  -6.267  -3.480
  306    H    GLN  41           H        GLN  41  -6.707  -5.956  -0.765
  307    HA   GLN  41           HA       GLN  41  -8.986  -5.224  -2.428
  308   1HB   GLN  41          1HB       GLN  41  -8.353  -7.366  -0.481
  309   2HB   GLN  41          2HB       GLN  41 -10.028  -6.865  -0.584
  310   1HG   GLN  41          1HG       GLN  41  -8.697  -7.364  -3.155
  311   2HG   GLN  41          2HG       GLN  41  -8.916  -8.774  -2.119
  312   2HE2  GLN  41          2HE2      GLN  41 -10.751  -9.819  -2.349
  313   1HE2  GLN  41          1HE2      GLN  41 -12.226  -9.167  -2.968
  314    H    ALA  42           H        ALA  42  -7.460  -3.816   0.077
  315    HA   ALA  42           HA       ALA  42  -9.792  -3.183   1.677
  316   1HB   ALA  42          1HB       ALA  42  -8.033  -1.679   2.853
  317   2HB   ALA  42          2HB       ALA  42  -6.875  -2.621   1.916
  318   3HB   ALA  42          3HB       ALA  42  -7.962  -3.430   3.044
  319    H    THR  43           H        THR  43 -10.247  -0.977   2.276
  320    HA   THR  43           HA       THR  43  -9.817   0.993   0.122
  321    HB   THR  43           HB       THR  43 -12.044   1.538  -0.065
  322    HG1  THR  43           HG1      THR  43 -12.633   2.042   1.984
  323   1HG2  THR  43          1HG2      THR  43 -11.626  -0.955  -0.564
  324   2HG2  THR  43          2HG2      THR  43 -12.525  -1.257   0.923
  325   3HG2  THR  43          3HG2      THR  43 -13.296  -0.407  -0.417
  326    H    ASN  44           H        ASN  44  -9.716   3.191   0.861
  327    HA   ASN  44           HA       ASN  44  -9.835   3.570   3.770
  328   1HB   ASN  44          1HB       ASN  44  -7.449   3.185   2.804
  329   2HB   ASN  44          2HB       ASN  44  -7.613   4.828   2.190
  330   2HD2  ASN  44          2HD2      ASN  44  -7.752   6.544   3.647
  331   1HD2  ASN  44          1HD2      ASN  44  -7.253   6.382   5.293
  332    H    ARG  45           H        ARG  45 -11.677   4.790   3.688
  333    HA   ARG  45           HA       ARG  45 -12.217   6.824   1.826
  334   1HB   ARG  45          1HB       ARG  45 -13.872   5.671   3.345
  335   2HB   ARG  45          2HB       ARG  45 -13.273   6.686   4.650
  336   1HG   ARG  45          1HG       ARG  45 -13.835   8.637   3.019
  337   2HG   ARG  45          2HG       ARG  45 -14.872   7.436   2.248
  338   1HD   ARG  45          1HD       ARG  45 -15.908   7.012   4.481
  339   2HD   ARG  45          2HD       ARG  45 -14.973   8.367   5.113
  340    HE   ARG  45           HE       ARG  45 -16.346   9.330   2.919
  341   1HH1  ARG  45          1HH1      ARG  45 -17.136   7.911   6.001
  342   2HH1  ARG  45          2HH1      ARG  45 -18.640   8.757   6.150
  343   1HH2  ARG  45          1HH2      ARG  45 -18.323  10.448   3.106
  344   2HH2  ARG  45          2HH2      ARG  45 -19.315  10.199   4.504
  345    H    ASN  46           H        ASN  46 -11.516   8.843   1.638
  346    HA   ASN  46           HA       ASN  46  -9.771   9.931   3.716
  347   1HB   ASN  46          1HB       ASN  46 -10.269  11.137   1.002
  348   2HB   ASN  46          2HB       ASN  46  -8.889  11.381   2.067
  349   2HD2  ASN  46          2HD2      ASN  46  -9.929   9.852  -0.648
  350   1HD2  ASN  46          1HD2      ASN  46  -8.757   8.585  -0.733
  351    H    THR  47           H        THR  47  -9.903  12.494   3.665
  352    HA   THR  47           HA       THR  47 -12.626  13.107   4.534
  353    HB   THR  47           HB       THR  47 -11.591  15.149   5.542
  354    HG1  THR  47           HG1      THR  47  -9.142  14.779   5.702
  355   1HG2  THR  47          1HG2      THR  47 -11.901  12.978   6.769
  356   2HG2  THR  47          2HG2      THR  47 -10.216  12.608   6.405
  357   3HG2  THR  47          3HG2      THR  47 -10.615  14.007   7.401
  358    H    ASP  48           H        ASP  48 -10.366  13.904   2.031
  359    HA   ASP  48           HA       ASP  48 -11.517  16.393   1.272
  360   1HB   ASP  48          1HB       ASP  48 -10.137  16.259  -0.687
  361   2HB   ASP  48          2HB       ASP  48  -9.204  15.643   0.672
  362    H    GLY  49           H        GLY  49 -12.719  13.304   1.098
  363   1HA   GLY  49          1HA       GLY  49 -14.661  14.137  -0.952
  364   2HA   GLY  49          2HA       GLY  49 -14.949  12.934   0.295
  365    H    SER  50           H        SER  50 -12.631  11.393  -0.028
  366    HA   SER  50           HA       SER  50 -13.345   9.991  -2.480
  367   1HB   SER  50          1HB       SER  50 -10.699   9.696  -2.740
  368   2HB   SER  50          2HB       SER  50 -11.578  11.013  -3.515
  369    HG   SER  50           HG       SER  50  -9.612  11.187  -1.763
  370    H    THR  51           H        THR  51 -11.154   8.189  -2.409
  371    HA   THR  51           HA       THR  51 -10.972   7.008   0.202
  372    HB   THR  51           HB       THR  51 -12.378   5.343  -1.877
  373    HG1  THR  51           HG1      THR  51 -14.238   6.182  -1.301
  374   1HG2  THR  51          1HG2      THR  51 -11.125   4.579   0.384
  375   2HG2  THR  51          2HG2      THR  51 -12.738   4.900   1.019
  376   3HG2  THR  51          3HG2      THR  51 -12.521   3.736  -0.289
  377    H    ASP  52           H        ASP  52  -9.684   4.952   0.123
  378    HA   ASP  52           HA       ASP  52  -7.888   4.943  -2.214
  379   1HB   ASP  52          1HB       ASP  52  -7.229   4.175   0.638
  380   2HB   ASP  52          2HB       ASP  52  -6.106   4.211  -0.716
  381    H    TYR  53           H        TYR  53  -9.135   3.428  -3.319
  382    HA   TYR  53           HA       TYR  53  -9.676   0.886  -2.063
  383   1HB   TYR  53          1HB       TYR  53 -10.264   2.005  -4.789
  384   2HB   TYR  53          2HB       TYR  53 -10.538   0.314  -4.392
  385    HD1  TYR  53           HD1      TYR  53 -11.556   3.773  -3.578
  386    HD2  TYR  53           HD2      TYR  53 -12.426  -0.368  -3.141
  387    HE1  TYR  53           HE1      TYR  53 -13.770   4.338  -2.669
  388    HE2  TYR  53           HE2      TYR  53 -14.643   0.186  -2.234
  389    HH   TYR  53           HH       TYR  53 -15.975   3.309  -2.415
  390    H    GLY  54           H        GLY  54  -7.443   0.344  -1.679
  391   1HA   GLY  54          1HA       GLY  54  -5.860  -0.313  -4.046
  392   2HA   GLY  54          2HA       GLY  54  -6.472  -1.696  -3.168
  393    H    ILE  55           H        ILE  55  -4.005  -1.815  -3.483
  394    HA   ILE  55           HA       ILE  55  -2.842  -1.526  -0.857
  395    HB   ILE  55           HB       ILE  55  -2.510  -3.533  -2.392
  396   1HG1  ILE  55          1HG1      ILE  55   0.018  -2.152  -1.461
  397   2HG1  ILE  55          2HG1      ILE  55  -1.077  -3.050  -0.413
  398   1HG2  ILE  55          1HG2      ILE  55  -1.389  -1.426  -4.051
  399   2HG2  ILE  55          2HG2      ILE  55  -0.287  -2.787  -3.844
  400   3HG2  ILE  55          3HG2      ILE  55  -1.908  -3.054  -4.484
  401   1HD1  ILE  55          1HD1      ILE  55  -0.209  -4.574  -2.735
  402   2HD1  ILE  55          2HD1      ILE  55   1.119  -4.066  -1.691
  403   3HD1  ILE  55          3HD1      ILE  55  -0.215  -5.009  -1.026
  404    H    LEU  56           H        LEU  56  -2.943   0.191  -3.801
  405    HA   LEU  56           HA       LEU  56  -0.723   1.921  -2.948
  406   1HB   LEU  56          1HB       LEU  56  -1.051   0.620  -5.414
  407   2HB   LEU  56          2HB       LEU  56  -1.492   2.288  -5.720
  408    HG   LEU  56           HG       LEU  56   0.790   2.251  -6.232
  409   1HD1  LEU  56          1HD1      LEU  56   0.000   3.832  -4.229
  410   2HD1  LEU  56          2HD1      LEU  56   1.247   2.915  -3.384
  411   3HD1  LEU  56          3HD1      LEU  56   1.653   3.815  -4.845
  412   1HD2  LEU  56          1HD2      LEU  56   0.811   0.024  -4.438
  413   2HD2  LEU  56          2HD2      LEU  56   2.011   0.498  -5.640
  414   3HD2  LEU  56          3HD2      LEU  56   2.107   1.139  -3.999
  415    H    GLN  57           H        GLN  57  -3.848   1.700  -2.654
  416    HA   GLN  57           HA       GLN  57  -5.511   3.152  -2.212
  417   1HB   GLN  57          1HB       GLN  57  -3.484   5.318  -2.773
  418   2HB   GLN  57          2HB       GLN  57  -5.023   5.522  -1.948
  419   1HG   GLN  57          1HG       GLN  57  -4.169   3.879  -0.229
  420   2HG   GLN  57          2HG       GLN  57  -2.589   4.053  -0.989
  421   2HE2  GLN  57          2HE2      GLN  57  -2.219   6.578  -1.468
  422   1HE2  GLN  57          1HE2      GLN  57  -2.366   7.556  -0.052
  423    H    ILE  58           H        ILE  58  -6.334   2.209  -4.352
  424    HA   ILE  58           HA       ILE  58  -6.150   4.034  -6.592
  425    HB   ILE  58           HB       ILE  58  -7.902   1.589  -6.372
  426   1HG1  ILE  58          1HG1      ILE  58  -5.784   0.676  -5.994
  427   2HG1  ILE  58          2HG1      ILE  58  -5.945   0.565  -7.744
  428   1HG2  ILE  58          1HG2      ILE  58  -7.814   3.554  -8.284
  429   2HG2  ILE  58          2HG2      ILE  58  -6.764   2.305  -8.957
  430   3HG2  ILE  58          3HG2      ILE  58  -8.427   1.916  -8.518
  431   1HD1  ILE  58          1HD1      ILE  58  -4.444   2.703  -6.249
  432   2HD1  ILE  58          2HD1      ILE  58  -3.729   1.328  -7.090
  433   3HD1  ILE  58          3HD1      ILE  58  -4.587   2.571  -8.001
  434    H    ASN  59           H        ASN  59  -7.122   5.892  -5.835
  435    HA   ASN  59           HA       ASN  59  -9.537   6.095  -4.498
  436   1HB   ASN  59          1HB       ASN  59  -7.909   7.936  -4.814
  437   2HB   ASN  59          2HB       ASN  59  -8.378   8.038  -6.509
  438   2HD2  ASN  59          2HD2      ASN  59  -8.650  10.306  -5.432
  439   1HD2  ASN  59          1HD2      ASN  59 -10.263  10.675  -4.934
  440    H    SER  60           H        SER  60 -11.237   4.884  -5.250
  441    HA   SER  60           HA       SER  60 -11.899   4.564  -7.966
  442   1HB   SER  60          1HB       SER  60 -13.736   3.358  -7.222
  443   2HB   SER  60          2HB       SER  60 -12.661   3.240  -5.829
  444    HG   SER  60           HG       SER  60 -15.040   3.998  -5.654
  445    H    ARG  61           H        ARG  61 -12.171   7.269  -5.992
  446    HA   ARG  61           HA       ARG  61 -14.415   8.359  -7.545
  447   1HB   ARG  61          1HB       ARG  61 -14.173   8.420  -4.900
  448   2HB   ARG  61          2HB       ARG  61 -13.199   9.839  -5.256
  449   1HG   ARG  61          1HG       ARG  61 -15.662   9.915  -6.737
  450   2HG   ARG  61          2HG       ARG  61 -15.973   9.699  -5.014
  451   1HD   ARG  61          1HD       ARG  61 -14.372  11.616  -4.619
  452   2HD   ARG  61          2HD       ARG  61 -14.427  11.903  -6.357
  453    HE   ARG  61           HE       ARG  61 -17.046  11.791  -5.299
  454   1HH1  ARG  61          1HH1      ARG  61 -14.232  13.843  -5.423
  455   2HH1  ARG  61          2HH1      ARG  61 -15.134  15.310  -5.238
  456   1HH2  ARG  61          1HH2      ARG  61 -18.242  13.718  -5.057
  457   2HH2  ARG  61          2HH2      ARG  61 -17.413  15.238  -5.031
  458    H    TRP  62           H        TRP  62 -11.627   7.968  -8.431
  459    HA   TRP  62           HA       TRP  62 -11.285  10.535  -9.666
  460   1HB   TRP  62          1HB       TRP  62  -9.930  10.102  -7.242
  461   2HB   TRP  62          2HB       TRP  62  -8.715   9.977  -8.509
  462    HD1  TRP  62           HD1      TRP  62 -11.051  12.477  -6.834
  463    HE1  TRP  62           HE1      TRP  62 -10.400  14.853  -7.580
  464    HE3  TRP  62           HE3      TRP  62  -7.661  11.287 -10.471
  465    HZ2  TRP  62           HZ2      TRP  62  -8.678  16.062  -9.461
  466    HZ3  TRP  62           HZ3      TRP  62  -6.557  13.113 -11.697
  467    HH2  TRP  62           HH2      TRP  62  -7.056  15.450 -11.202
  468    H    TRP  63           H        TRP  63 -10.656   7.168  -9.576
  469    HA   TRP  63           HA       TRP  63  -9.171   7.460 -12.086
  470   1HB   TRP  63          1HB       TRP  63  -8.409   5.557  -9.870
  471   2HB   TRP  63          2HB       TRP  63  -7.675   5.609 -11.469
  472    HD1  TRP  63           HD1      TRP  63  -6.892   6.715  -8.133
  473    HE1  TRP  63           HE1      TRP  63  -5.284   8.725  -8.146
  474    HE3  TRP  63           HE3      TRP  63  -7.407   8.111 -13.000
  475    HZ2  TRP  63           HZ2      TRP  63  -4.362  10.664  -9.998
  476    HZ3  TRP  63           HZ3      TRP  63  -6.171  10.049 -13.823
  477    HH2  TRP  63           HH2      TRP  63  -4.661  11.304 -12.356
  478    H    CYS  64           H        CYS  64 -11.605   5.739 -10.309
  479    HA   CYS  64           HA       CYS  64 -12.078   4.201 -12.743
  480   1HB   CYS  64          1HB       CYS  64 -11.968   2.106 -11.815
  481   2HB   CYS  64          2HB       CYS  64 -10.729   2.915 -10.869
  482    H    ASN  65           H        ASN  65 -14.164   3.353 -13.006
  483    HA   ASN  65           HA       ASN  65 -16.182   4.941 -11.622
  484   1HB   ASN  65          1HB       ASN  65 -16.170   4.786 -14.111
  485   2HB   ASN  65          2HB       ASN  65 -16.507   3.064 -13.973
  486   2HD2  ASN  65          2HD2      ASN  65 -17.755   6.279 -13.393
  487   1HD2  ASN  65          1HD2      ASN  65 -19.421   5.828 -13.328
  488    H    ASP  66           H        ASP  66 -16.690   4.062  -9.701
  489    HA   ASP  66           HA       ASP  66 -17.157   1.175  -9.534
  490   1HB   ASP  66          1HB       ASP  66 -17.017   1.408  -7.152
  491   2HB   ASP  66          2HB       ASP  66 -15.676   2.307  -7.855
  492    H    GLY  67           H        GLY  67 -18.815   4.184  -9.633
  493   1HA   GLY  67          1HA       GLY  67 -21.357   2.844  -9.703
  494   2HA   GLY  67          2HA       GLY  67 -21.081   4.570  -9.885
  495    H    ARG  68           H        ARG  68 -19.692   3.133  -7.094
  496    HA   ARG  68           HA       ARG  68 -22.015   3.606  -5.424
  497   1HB   ARG  68          1HB       ARG  68 -20.141   1.744  -5.224
  498   2HB   ARG  68          2HB       ARG  68 -19.326   2.988  -4.287
  499   1HG   ARG  68          1HG       ARG  68 -21.550   3.140  -2.984
  500   2HG   ARG  68          2HG       ARG  68 -21.888   1.564  -3.705
  501   1HD   ARG  68          1HD       ARG  68 -19.537   0.930  -2.829
  502   2HD   ARG  68          2HD       ARG  68 -19.719   2.344  -1.791
  503    HE   ARG  68           HE       ARG  68 -21.816   1.228  -0.986
  504   1HH1  ARG  68          1HH1      ARG  68 -19.170  -0.615  -2.308
  505   2HH1  ARG  68          2HH1      ARG  68 -19.566  -2.054  -1.430
  506   1HH2  ARG  68          1HH2      ARG  68 -22.343  -0.662   0.174
  507   2HH2  ARG  68          2HH2      ARG  68 -21.369  -2.081  -0.019
  508    H    THR  69           H        THR  69 -19.591   5.498  -6.678
  509    HA   THR  69           HA       THR  69 -20.097   7.570  -4.687
  510    HB   THR  69           HB       THR  69 -17.261   7.197  -5.576
  511    HG1  THR  69           HG1      THR  69 -18.504   5.905  -3.356
  512   1HG2  THR  69          1HG2      THR  69 -18.573   8.404  -3.138
  513   2HG2  THR  69          2HG2      THR  69 -16.831   8.302  -3.396
  514   3HG2  THR  69          3HG2      THR  69 -17.828   9.277  -4.476
  515    HA   PRO  70           HA       PRO  70 -20.420   9.511  -8.767
  516   1HB   PRO  70          1HB       PRO  70 -21.782  11.693  -7.918
  517   2HB   PRO  70          2HB       PRO  70 -22.561  10.129  -8.186
  518   1HG   PRO  70          1HG       PRO  70 -21.636  11.368  -5.622
  519   2HG   PRO  70          2HG       PRO  70 -23.146  10.504  -5.966
  520   1HD   PRO  70          1HD       PRO  70 -21.041   9.336  -4.718
  521   2HD   PRO  70          2HD       PRO  70 -22.154   8.434  -5.767
  522    H    GLY  71           H        GLY  71 -20.034  11.916  -9.430
  523   1HA   GLY  71          1HA       GLY  71 -18.357  13.548  -7.840
  524   2HA   GLY  71          2HA       GLY  71 -18.590  13.698  -9.576
  525    H    SER  72           H        SER  72 -17.696  10.739  -9.674
  526    HA   SER  72           HA       SER  72 -14.885  10.939  -9.022
  527   1HB   SER  72          1HB       SER  72 -15.906   8.805  -8.625
  528   2HB   SER  72          2HB       SER  72 -16.549   8.742 -10.266
  529    HG   SER  72           HG       SER  72 -14.660   8.116 -10.992
  530    H    ARG  73           H        ARG  73 -13.247  11.279 -10.408
  531    HA   ARG  73           HA       ARG  73 -13.731  12.496 -12.904
  532   1HB   ARG  73          1HB       ARG  73 -11.603  12.394 -11.221
  533   2HB   ARG  73          2HB       ARG  73 -11.064  11.295 -12.484
  534   1HG   ARG  73          1HG       ARG  73 -10.479  13.016 -13.739
  535   2HG   ARG  73          2HG       ARG  73 -12.147  13.597 -13.737
  536   1HD   ARG  73          1HD       ARG  73 -11.450  14.465 -11.334
  537   2HD   ARG  73          2HD       ARG  73  -9.839  14.415 -12.051
  538    HE   ARG  73           HE       ARG  73 -12.088  16.049 -13.021
  539   1HH1  ARG  73          1HH1      ARG  73  -8.680  15.338 -12.856
  540   2HH1  ARG  73          2HH1      ARG  73  -8.207  16.792 -13.668
  541   1HH2  ARG  73          1HH2      ARG  73 -11.473  17.966 -14.091
  542   2HH2  ARG  73          2HH2      ARG  73  -9.793  18.286 -14.370
  543    H    ASN  74           H        ASN  74 -12.793   9.233 -11.991
  544    HA   ASN  74           HA       ASN  74 -12.668   7.262 -13.140
  545   1HB   ASN  74          1HB       ASN  74 -15.105   7.981 -13.514
  546   2HB   ASN  74          2HB       ASN  74 -14.591   8.499 -15.117
  547   2HD2  ASN  74          2HD2      ASN  74 -16.071   6.955 -15.959
  548   1HD2  ASN  74          1HD2      ASN  74 -15.643   5.283 -16.037
  549    H    LEU  75           H        LEU  75 -10.814   9.347 -13.749
  550    HA   LEU  75           HA       LEU  75 -10.252   9.763 -16.419
  551   1HB   LEU  75          1HB       LEU  75  -8.760   9.597 -13.870
  552   2HB   LEU  75          2HB       LEU  75  -7.799   9.509 -15.333
  553    HG   LEU  75           HG       LEU  75  -9.654  11.737 -14.443
  554   1HD1  LEU  75          1HD1      LEU  75  -6.670  11.512 -14.735
  555   2HD1  LEU  75          2HD1      LEU  75  -7.494  13.069 -14.684
  556   3HD1  LEU  75          3HD1      LEU  75  -7.610  11.966 -13.314
  557   1HD2  LEU  75          1HD2      LEU  75  -8.173  11.422 -17.054
  558   2HD2  LEU  75          2HD2      LEU  75  -9.917  11.524 -16.818
  559   3HD2  LEU  75          3HD2      LEU  75  -8.901  12.929 -16.496
  560    H    CYS  76           H        CYS  76  -8.306   7.690 -14.491
  561    HA   CYS  76           HA       CYS  76  -7.100   6.088 -16.216
  562   1HB   CYS  76          1HB       CYS  76  -7.764   6.097 -13.499
  563   2HB   CYS  76          2HB       CYS  76  -8.067   4.471 -14.088
  564    H    ASN  77           H        ASN  77 -10.483   5.949 -15.387
  565    HA   ASN  77           HA       ASN  77 -12.204   4.574 -16.005
  566   1HB   ASN  77          1HB       ASN  77 -11.474   5.838 -18.134
  567   2HB   ASN  77          2HB       ASN  77 -10.764   4.306 -18.637
  568   2HD2  ASN  77          2HD2      ASN  77 -12.009   3.072 -19.827
  569   1HD2  ASN  77          1HD2      ASN  77 -13.736   3.078 -19.848
  570    H    ILE  78           H        ILE  78 -11.023   3.028 -14.456
  571    HA   ILE  78           HA       ILE  78 -10.437   0.569 -15.935
  572    HB   ILE  78           HB       ILE  78  -8.508   0.252 -14.901
  573   1HG1  ILE  78          1HG1      ILE  78 -10.188   0.060 -12.674
  574   2HG1  ILE  78          2HG1      ILE  78  -8.504  -0.425 -12.760
  575   1HG2  ILE  78          1HG2      ILE  78  -9.026   3.021 -13.851
  576   2HG2  ILE  78          2HG2      ILE  78  -7.455   2.221 -13.853
  577   3HG2  ILE  78          3HG2      ILE  78  -8.261   2.586 -15.380
  578   1HD1  ILE  78          1HD1      ILE  78  -9.398   2.334 -11.972
  579   2HD1  ILE  78          2HD1      ILE  78  -9.101   1.027 -10.825
  580   3HD1  ILE  78          3HD1      ILE  78  -7.784   1.637 -11.828
  581    HA   PRO  79           HA       PRO  79 -13.777  -1.141 -13.526
  582   1HB   PRO  79          1HB       PRO  79 -13.265  -3.785 -13.908
  583   2HB   PRO  79          2HB       PRO  79 -13.987  -2.768 -15.161
  584   1HG   PRO  79          1HG       PRO  79 -11.148  -3.655 -14.842
  585   2HG   PRO  79          2HG       PRO  79 -12.129  -3.549 -16.314
  586   1HD   PRO  79          1HD       PRO  79 -10.290  -1.671 -15.625
  587   2HD   PRO  79          2HD       PRO  79 -11.758  -1.290 -16.548
  588    H    CYS  80           H        CYS  80 -13.394  -0.749 -11.379
  589    HA   CYS  80           HA       CYS  80 -11.068  -1.591 -10.030
  590   1HB   CYS  80          1HB       CYS  80 -13.613  -0.272  -9.280
  591   2HB   CYS  80          2HB       CYS  80 -12.720  -1.057  -7.982
  592    H    SER  81           H        SER  81 -14.428  -2.750  -9.574
  593    HA   SER  81           HA       SER  81 -14.003  -4.724  -7.761
  594   1HB   SER  81          1HB       SER  81 -15.934  -5.941  -8.979
  595   2HB   SER  81          2HB       SER  81 -16.231  -4.328  -8.330
  596    HG   SER  81           HG       SER  81 -16.591  -5.109 -10.789
  597    H    ALA  82           H        ALA  82 -13.597  -5.115 -11.285
  598    HA   ALA  82           HA       ALA  82 -12.852  -7.886 -11.009
  599   1HB   ALA  82          1HB       ALA  82 -13.679  -7.768 -13.080
  600   2HB   ALA  82          2HB       ALA  82 -13.383  -6.034 -13.201
  601   3HB   ALA  82          3HB       ALA  82 -12.083  -7.176 -13.538
  602    H    LEU  83           H        LEU  83 -11.234  -4.929 -10.829
  603    HA   LEU  83           HA       LEU  83  -8.628  -6.184 -11.342
  604   1HB   LEU  83          1HB       LEU  83  -9.494  -3.316 -11.255
  605   2HB   LEU  83          2HB       LEU  83  -7.797  -3.767 -11.199
  606    HG   LEU  83           HG       LEU  83  -9.616  -4.712 -13.400
  607   1HD1  LEU  83          1HD1      LEU  83  -9.359  -2.120 -13.073
  608   2HD1  LEU  83          2HD1      LEU  83  -7.781  -2.407 -13.805
  609   3HD1  LEU  83          3HD1      LEU  83  -9.251  -2.850 -14.674
  610   1HD2  LEU  83          1HD2      LEU  83  -7.378  -5.806 -12.914
  611   2HD2  LEU  83          2HD2      LEU  83  -7.635  -5.224 -14.559
  612   3HD2  LEU  83          3HD2      LEU  83  -6.641  -4.293 -13.439
  613    H    LEU  84           H        LEU  84 -10.571  -5.723  -8.769
  614    HA   LEU  84           HA       LEU  84  -8.401  -5.104  -6.892
  615   1HB   LEU  84          1HB       LEU  84 -11.389  -5.308  -6.522
  616   2HB   LEU  84          2HB       LEU  84 -10.262  -5.038  -5.206
  617    HG   LEU  84           HG       LEU  84 -10.347  -3.200  -7.567
  618   1HD1  LEU  84          1HD1      LEU  84 -12.611  -3.585  -6.278
  619   2HD1  LEU  84          2HD1      LEU  84 -11.849  -2.529  -5.089
  620   3HD1  LEU  84          3HD1      LEU  84 -12.088  -1.967  -6.744
  621   1HD2  LEU  84          1HD2      LEU  84  -8.876  -3.363  -5.115
  622   2HD2  LEU  84          2HD2      LEU  84  -8.691  -2.229  -6.453
  623   3HD2  LEU  84          3HD2      LEU  84  -9.821  -1.875  -5.145
  624    H    SER  85           H        SER  85  -9.664  -7.687  -8.384
  625    HA   SER  85           HA       SER  85  -9.930  -9.552  -6.247
  626   1HB   SER  85          1HB       SER  85 -10.537  -9.542  -8.967
  627   2HB   SER  85          2HB       SER  85  -9.316 -10.803  -8.792
  628    HG   SER  85           HG       SER  85 -11.906 -10.682  -7.810
  629    H    SER  86           H        SER  86  -7.623  -8.437  -5.661
  630    HA   SER  86           HA       SER  86  -5.540  -8.964  -4.909
  631   1HB   SER  86          1HB       SER  86  -6.694 -11.404  -5.032
  632   2HB   SER  86          2HB       SER  86  -5.420 -11.616  -6.233
  633    HG   SER  86           HG       SER  86  -4.265 -10.439  -4.223
  634    H    ASP  87           H        ASP  87  -6.113  -7.715  -7.380
  635    HA   ASP  87           HA       ASP  87  -3.728  -8.425  -8.946
  636   1HB   ASP  87          1HB       ASP  87  -5.969  -8.892  -9.981
  637   2HB   ASP  87          2HB       ASP  87  -6.285  -7.164  -9.927
  638    H    ILE  88           H        ILE  88  -2.180  -6.868  -8.790
  639    HA   ILE  88           HA       ILE  88  -2.969  -4.190  -7.978
  640    HB   ILE  88           HB       ILE  88  -0.343  -3.912  -8.178
  641   1HG1  ILE  88          1HG1      ILE  88  -0.388  -6.776  -7.338
  642   2HG1  ILE  88          2HG1      ILE  88  -0.385  -6.413  -9.061
  643   1HG2  ILE  88          1HG2      ILE  88  -1.821  -5.304  -5.959
  644   2HG2  ILE  88          2HG2      ILE  88  -0.189  -4.655  -5.805
  645   3HG2  ILE  88          3HG2      ILE  88  -1.539  -3.573  -6.147
  646   1HD1  ILE  88          1HD1      ILE  88   1.608  -4.939  -7.500
  647   2HD1  ILE  88          2HD1      ILE  88   1.832  -6.688  -7.535
  648   3HD1  ILE  88          3HD1      ILE  88   1.760  -5.778  -9.044
  649    H    THR  89           H        THR  89  -2.436  -5.838 -10.861
  650    HA   THR  89           HA       THR  89  -1.001  -4.225 -12.509
  651    HB   THR  89           HB       THR  89  -3.694  -5.248 -13.396
  652    HG1  THR  89           HG1      THR  89  -2.490  -6.860 -12.148
  653   1HG2  THR  89          1HG2      THR  89  -1.169  -4.425 -14.675
  654   2HG2  THR  89          2HG2      THR  89  -1.908  -5.888 -15.327
  655   3HG2  THR  89          3HG2      THR  89  -2.820  -4.378 -15.292
  656    H    ALA  90           H        ALA  90  -4.471  -3.779 -11.800
  657    HA   ALA  90           HA       ALA  90  -4.777  -1.421 -13.213
  658   1HB   ALA  90          1HB       ALA  90  -6.441  -3.074 -11.834
  659   2HB   ALA  90          2HB       ALA  90  -6.442  -1.625 -10.829
  660   3HB   ALA  90          3HB       ALA  90  -6.902  -1.521 -12.529
  661    H    SER  91           H        SER  91  -3.891  -2.028  -9.858
  662    HA   SER  91           HA       SER  91  -3.938   0.633  -8.959
  663   1HB   SER  91          1HB       SER  91  -2.205  -1.632  -7.950
  664   2HB   SER  91          2HB       SER  91  -2.630  -0.167  -7.067
  665    HG   SER  91           HG       SER  91  -4.913  -1.086  -7.705
  666    H    VAL  92           H        VAL  92  -1.465  -1.266 -10.534
  667    HA   VAL  92           HA       VAL  92   0.485   0.831 -10.196
  668    HB   VAL  92           HB       VAL  92   0.648  -1.766 -11.722
  669   1HG1  VAL  92          1HG1      VAL  92   2.636   0.500 -11.499
  670   2HG1  VAL  92          2HG1      VAL  92   3.084  -1.132 -11.993
  671   3HG1  VAL  92          3HG1      VAL  92   1.951  -0.195 -12.967
  672   1HG2  VAL  92          1HG2      VAL  92   1.259  -0.921  -9.016
  673   2HG2  VAL  92          2HG2      VAL  92   1.200  -2.545  -9.701
  674   3HG2  VAL  92          3HG2      VAL  92   2.678  -1.590  -9.824
  675    H    ASN  93           H        ASN  93  -1.222  -0.591 -12.996
  676    HA   ASN  93           HA       ASN  93  -0.157   0.945 -14.930
  677   1HB   ASN  93          1HB       ASN  93  -1.583  -0.269 -16.103
  678   2HB   ASN  93          2HB       ASN  93  -2.405  -0.706 -14.628
  679   2HD2  ASN  93          2HD2      ASN  93  -4.292   0.324 -14.055
  680   1HD2  ASN  93          1HD2      ASN  93  -5.145   1.379 -15.127
  681    H    CYS  94           H        CYS  94  -2.779   1.697 -12.753
  682    HA   CYS  94           HA       CYS  94  -3.384   4.235 -13.832
  683   1HB   CYS  94          1HB       CYS  94  -4.661   2.699 -12.079
  684   2HB   CYS  94          2HB       CYS  94  -3.793   3.711 -10.926
  685    H    ALA  95           H        ALA  95  -1.379   3.225 -11.048
  686    HA   ALA  95           HA       ALA  95  -0.538   5.869 -10.445
  687   1HB   ALA  95          1HB       ALA  95  -0.409   3.804  -8.955
  688   2HB   ALA  95          2HB       ALA  95   1.116   3.483  -9.783
  689   3HB   ALA  95          3HB       ALA  95   0.900   4.986  -8.885
  690    H    LYS  96           H        LYS  96   0.585   3.439 -12.655
  691    HA   LYS  96           HA       LYS  96   3.142   4.322 -13.226
  692   1HB   LYS  96          1HB       LYS  96   1.323   2.499 -14.355
  693   2HB   LYS  96          2HB       LYS  96   1.711   3.620 -15.652
  694   1HG   LYS  96          1HG       LYS  96   3.974   3.069 -15.617
  695   2HG   LYS  96          2HG       LYS  96   3.866   2.343 -14.012
  696   1HD   LYS  96          1HD       LYS  96   3.654   0.368 -15.021
  697   2HD   LYS  96          2HD       LYS  96   2.064   0.900 -15.572
  698   1HE   LYS  96          1HE       LYS  96   4.401   1.805 -17.146
  699   2HE   LYS  96          2HE       LYS  96   3.995   0.091 -17.239
  700   1HZ   LYS  96          1HZ       LYS  96   1.598   1.350 -17.515
  701   2HZ   LYS  96          2HZ       LYS  96   2.653   2.343 -18.389
  702   3HZ   LYS  96          3HZ       LYS  96   2.524   0.700 -18.772
  703    H    LYS  97           H        LYS  97  -0.009   5.305 -14.221
  704    HA   LYS  97           HA       LYS  97   0.862   7.472 -15.926
  705   1HB   LYS  97          1HB       LYS  97  -1.318   6.098 -16.153
  706   2HB   LYS  97          2HB       LYS  97  -1.934   7.128 -14.867
  707   1HG   LYS  97          1HG       LYS  97  -1.001   9.012 -16.524
  708   2HG   LYS  97          2HG       LYS  97  -1.382   7.749 -17.696
  709   1HD   LYS  97          1HD       LYS  97  -3.519   7.957 -15.808
  710   2HD   LYS  97          2HD       LYS  97  -3.152   9.560 -16.449
  711   1HE   LYS  97          1HE       LYS  97  -3.866   9.038 -18.524
  712   2HE   LYS  97          2HE       LYS  97  -3.239   7.392 -18.437
  713   1HZ   LYS  97          1HZ       LYS  97  -5.726   8.356 -17.128
  714   2HZ   LYS  97          2HZ       LYS  97  -5.656   7.432 -18.545
  715   3HZ   LYS  97          3HZ       LYS  97  -5.131   6.773 -17.078
  716    H    ILE  98           H        ILE  98  -0.190   7.011 -12.621
  717    HA   ILE  98           HA       ILE  98  -0.670   9.691 -11.961
  718    HB   ILE  98           HB       ILE  98   0.246   7.429 -10.205
  719   1HG1  ILE  98          1HG1      ILE  98  -2.481   8.725 -10.492
  720   2HG1  ILE  98          2HG1      ILE  98  -2.015   7.226 -11.286
  721   1HG2  ILE  98          1HG2      ILE  98   0.111  10.245  -9.661
  722   2HG2  ILE  98          2HG2      ILE  98  -1.058   9.376  -8.667
  723   3HG2  ILE  98          3HG2      ILE  98   0.647   8.929  -8.616
  724   1HD1  ILE  98          1HD1      ILE  98  -1.850   7.520  -8.313
  725   2HD1  ILE  98          2HD1      ILE  98  -3.359   7.090  -9.119
  726   3HD1  ILE  98          3HD1      ILE  98  -1.946   6.050  -9.283
  727    H    VAL  99           H        VAL  99   2.178   7.695 -11.543
  728    HA   VAL  99           HA       VAL  99   3.870   9.802 -10.668
  729    HB   VAL  99           HB       VAL  99   4.124   7.255 -10.296
  730   1HG1  VAL  99          1HG1      VAL  99   4.404   7.129 -12.964
  731   2HG1  VAL  99          2HG1      VAL  99   6.096   7.281 -12.488
  732   3HG1  VAL  99          3HG1      VAL  99   5.118   5.957 -11.856
  733   1HG2  VAL  99          1HG2      VAL  99   6.386   9.166 -10.802
  734   2HG2  VAL  99          2HG2      VAL  99   5.620   8.759  -9.266
  735   3HG2  VAL  99          3HG2      VAL  99   6.625   7.569 -10.091
  736    H    SER 100           H        SER 100   2.884   8.688 -13.780
  737    HA   SER 100           HA       SER 100   5.137   9.939 -15.141
  738   1HB   SER 100          1HB       SER 100   2.808   8.264 -15.995
  739   2HB   SER 100          2HB       SER 100   3.590   9.299 -17.189
  740    HG   SER 100           HG       SER 100   5.092   7.565 -15.546
  741    H    ASP 101           H        ASP 101   2.249  10.862 -13.806
  742    HA   ASP 101           HA       ASP 101   1.713  13.006 -15.722
  743   1HB   ASP 101          1HB       ASP 101  -0.137  11.589 -14.694
  744   2HB   ASP 101          2HB       ASP 101   0.187  12.432 -13.182
  745    H    GLY 102           H        GLY 102   3.531  12.482 -12.962
  746   1HA   GLY 102          1HA       GLY 102   3.634  15.387 -12.431
  747   2HA   GLY 102          2HA       GLY 102   5.022  14.317 -12.318
  748    H    ASN 103           H        ASN 103   3.922  12.203 -10.892
  749    HA   ASN 103           HA       ASN 103   3.750  13.415  -8.252
  750   1HB   ASN 103          1HB       ASN 103   1.594  11.701  -9.464
  751   2HB   ASN 103          2HB       ASN 103   1.834  11.762  -7.721
  752   2HD2  ASN 103          2HD2      ASN 103   0.303  13.158 -10.331
  753   1HD2  ASN 103          1HD2      ASN 103  -0.208  14.629  -9.585
  754    H    GLY 104           H        GLY 104   5.677  12.531  -7.640
  755   1HA   GLY 104          1HA       GLY 104   7.236  10.911  -7.115
  756   2HA   GLY 104          2HA       GLY 104   6.376   9.805  -8.175
  757    H    MET 105           H        MET 105   7.528   9.542  -5.405
  758    HA   MET 105           HA       MET 105   5.392   7.980  -4.299
  759   1HB   MET 105          1HB       MET 105   7.856   8.590  -2.735
  760   2HB   MET 105          2HB       MET 105   6.984   7.074  -2.900
  761   1HG   MET 105          1HG       MET 105   8.753   8.319  -4.991
  762   2HG   MET 105          2HG       MET 105   9.190   6.978  -3.933
  763   1HE   MET 105          1HE       MET 105   7.159   5.067  -3.677
  764   2HE   MET 105          2HE       MET 105   5.750   5.923  -4.304
  765   3HE   MET 105          3HE       MET 105   6.303   4.442  -5.087
  766    H    ASN 106           H        ASN 106   6.083  11.162  -4.334
  767    HA   ASN 106           HA       ASN 106   5.626  11.911  -1.636
  768   1HB   ASN 106          1HB       ASN 106   5.927  13.247  -4.266
  769   2HB   ASN 106          2HB       ASN 106   5.085  14.140  -3.019
  770   2HD2  ASN 106          2HD2      ASN 106   6.230  15.130  -1.471
  771   1HD2  ASN 106          1HD2      ASN 106   7.941  14.991  -1.272
  772    H    ALA 107           H        ALA 107   3.595  11.550  -4.510
  773    HA   ALA 107           HA       ALA 107   1.276  12.794  -3.684
  774   1HB   ALA 107          1HB       ALA 107   1.996  11.202  -5.807
  775   2HB   ALA 107          2HB       ALA 107   0.395  11.886  -5.529
  776   3HB   ALA 107          3HB       ALA 107   0.755  10.243  -4.998
  777    H    TRP 108           H        TRP 108   2.296   9.455  -3.068
  778    HA   TRP 108           HA       TRP 108   0.047   8.944  -1.341
  779   1HB   TRP 108          1HB       TRP 108   2.538   7.302  -1.867
  780   2HB   TRP 108          2HB       TRP 108   1.111   6.744  -0.994
  781    HD1  TRP 108           HD1      TRP 108  -1.140   6.343  -2.457
  782    HE1  TRP 108           HE1      TRP 108  -1.468   5.836  -4.960
  783    HE3  TRP 108           HE3      TRP 108   3.467   7.736  -4.180
  784    HZ2  TRP 108           HZ2      TRP 108   0.029   6.007  -7.365
  785    HZ3  TRP 108           HZ3      TRP 108   3.937   7.537  -6.584
  786    HH2  TRP 108           HH2      TRP 108   2.258   6.688  -8.139
  787    H    VAL 109           H        VAL 109  -0.073   9.379   0.741
  788    HA   VAL 109           HA       VAL 109   1.985  10.771   2.096
  789    HB   VAL 109           HB       VAL 109  -0.114   9.702   3.747
  790   1HG1  VAL 109          1HG1      VAL 109   1.332  12.223   3.322
  791   2HG1  VAL 109          2HG1      VAL 109  -0.320  12.370   3.922
  792   3HG1  VAL 109          3HG1      VAL 109   0.865  11.424   4.823
  793   1HG2  VAL 109          1HG2      VAL 109  -1.309   9.863   1.597
  794   2HG2  VAL 109          2HG2      VAL 109  -1.919  11.002   2.797
  795   3HG2  VAL 109          3HG2      VAL 109  -0.857  11.565   1.506
  796    H    ALA 110           H        ALA 110   1.107   7.399   2.093
  797    HA   ALA 110           HA       ALA 110   2.244   6.751   4.606
  798   1HB   ALA 110          1HB       ALA 110   2.117   4.824   2.313
  799   2HB   ALA 110          2HB       ALA 110   1.922   4.513   4.038
  800   3HB   ALA 110          3HB       ALA 110   0.655   5.352   3.145
  801    H    TRP 111           H        TRP 111   3.613   7.523   1.597
  802    HA   TRP 111           HA       TRP 111   6.137   6.213   2.221
  803   1HB   TRP 111          1HB       TRP 111   5.356   6.191  -0.115
  804   2HB   TRP 111          2HB       TRP 111   5.434   7.945  -0.155
  805    HD1  TRP 111           HD1      TRP 111   7.576   4.861  -0.488
  806    HE1  TRP 111           HE1      TRP 111   9.982   5.546  -1.093
  807    HE3  TRP 111           HE3      TRP 111   7.198   9.907   0.252
  808    HZ2  TRP 111           HZ2      TRP 111  11.516   7.910  -1.238
  809    HZ3  TRP 111           HZ3      TRP 111   9.182  11.308  -0.142
  810    HH2  TRP 111           HH2      TRP 111  11.295  10.330  -0.871
  811    H    ARG 112           H        ARG 112   4.718   9.466   2.200
  812    HA   ARG 112           HA       ARG 112   7.289  10.621   2.929
  813   1HB   ARG 112          1HB       ARG 112   4.666  11.635   2.006
  814   2HB   ARG 112          2HB       ARG 112   5.591  12.676   3.077
  815   1HG   ARG 112          1HG       ARG 112   6.971  11.487   0.730
  816   2HG   ARG 112          2HG       ARG 112   5.844  12.818   0.461
  817   1HD   ARG 112          1HD       ARG 112   8.230  12.841   2.307
  818   2HD   ARG 112          2HD       ARG 112   8.113  13.651   0.745
  819    HE   ARG 112           HE       ARG 112   6.347  15.043   1.755
  820   1HH1  ARG 112          1HH1      ARG 112   8.571  13.357   3.842
  821   2HH1  ARG 112          2HH1      ARG 112   8.362  14.455   5.166
  822   1HH2  ARG 112          1HH2      ARG 112   6.067  16.493   3.491
  823   2HH2  ARG 112          2HH2      ARG 112   6.938  16.238   4.966
  824    H    ASN 113           H        ASN 113   6.367   8.817   4.793
  825    HA   ASN 113           HA       ASN 113   6.010  10.561   7.088
  826   1HB   ASN 113          1HB       ASN 113   3.829   9.077   6.007
  827   2HB   ASN 113          2HB       ASN 113   4.277   8.343   7.543
  828   2HD2  ASN 113          2HD2      ASN 113   4.535   9.865   9.377
  829   1HD2  ASN 113          1HD2      ASN 113   3.430  11.189   9.483
  830    H    ARG 114           H        ARG 114   5.774   7.092   6.390
  831    HA   ARG 114           HA       ARG 114   7.779   6.597   8.475
  832   1HB   ARG 114          1HB       ARG 114   5.459   5.092   7.405
  833   2HB   ARG 114          2HB       ARG 114   6.845   4.153   7.929
  834   1HG   ARG 114          1HG       ARG 114   5.791   6.254   9.747
  835   2HG   ARG 114          2HG       ARG 114   4.886   4.748   9.575
  836   1HD   ARG 114          1HD       ARG 114   6.825   3.464  10.234
  837   2HD   ARG 114          2HD       ARG 114   7.811   4.925  10.287
  838    HE   ARG 114           HE       ARG 114   6.215   5.639  12.120
  839   1HH1  ARG 114          1HH1      ARG 114   6.952   2.299  11.449
  840   2HH1  ARG 114          2HH1      ARG 114   6.642   1.772  13.071
  841   1HH2  ARG 114          1HH2      ARG 114   5.806   4.953  14.256
  842   2HH2  ARG 114          2HH2      ARG 114   5.991   3.280  14.665
  843    H    CYS 115           H        CYS 115   7.850   7.123   5.310
  844    HA   CYS 115           HA       CYS 115   9.816   4.990   4.799
  845   1HB   CYS 115          1HB       CYS 115   7.898   6.382   2.951
  846   2HB   CYS 115          2HB       CYS 115   9.314   5.532   2.338
  847    H    LYS 116           H        LYS 116   9.087   8.409   4.052
  848    HA   LYS 116           HA       LYS 116  11.595   8.969   2.902
  849   1HB   LYS 116          1HB       LYS 116   9.350  10.327   2.916
  850   2HB   LYS 116          2HB       LYS 116  10.030  11.065   4.359
  851   1HG   LYS 116          1HG       LYS 116  12.064  11.104   2.422
  852   2HG   LYS 116          2HG       LYS 116  10.583  11.617   1.610
  853   1HD   LYS 116          1HD       LYS 116  10.215  13.323   3.291
  854   2HD   LYS 116          2HD       LYS 116  11.627  12.772   4.195
  855   1HE   LYS 116          1HE       LYS 116  12.146  14.763   2.887
  856   2HE   LYS 116          2HE       LYS 116  13.068  13.373   2.318
  857   1HZ   LYS 116          1HZ       LYS 116  10.540  13.752   0.981
  858   2HZ   LYS 116          2HZ       LYS 116  11.642  15.014   0.741
  859   3HZ   LYS 116          3HZ       LYS 116  12.069  13.429   0.334
  860    H    GLY 117           H        GLY 117  13.238   8.150   4.204
  861   1HA   GLY 117          1HA       GLY 117  13.475   9.234   6.917
  862   2HA   GLY 117          2HA       GLY 117  14.751   9.600   5.768
  863    H    THR 118           H        THR 118  13.638   6.582   4.974
  864    HA   THR 118           HA       THR 118  15.646   5.292   6.700
  865    HB   THR 118           HB       THR 118  14.305   3.196   6.443
  866    HG1  THR 118           HG1      THR 118  12.104   4.775   5.680
  867   1HG2  THR 118          1HG2      THR 118  14.060   5.099   8.298
  868   2HG2  THR 118          2HG2      THR 118  12.423   5.152   7.643
  869   3HG2  THR 118          3HG2      THR 118  13.062   3.645   8.300
  870    H    ASP 119           H        ASP 119  15.157   2.768   5.146
  871    HA   ASP 119           HA       ASP 119  16.422   3.491   2.611
  872   1HB   ASP 119          1HB       ASP 119  17.953   2.630   4.535
  873   2HB   ASP 119          2HB       ASP 119  17.349   1.086   3.981
  874    H    VAL 120           H        VAL 120  15.032   2.876   1.093
  875    HA   VAL 120           HA       VAL 120  13.233   0.677   1.437
  876    HB   VAL 120           HB       VAL 120  12.576   1.150  -0.916
  877   1HG1  VAL 120          1HG1      VAL 120  12.294   2.838   1.371
  878   2HG1  VAL 120          2HG1      VAL 120  12.324   3.832  -0.086
  879   3HG1  VAL 120          3HG1      VAL 120  11.145   2.530   0.068
  880   1HG2  VAL 120          1HG2      VAL 120  15.085   2.568  -0.890
  881   2HG2  VAL 120          2HG2      VAL 120  14.055   2.135  -2.255
  882   3HG2  VAL 120          3HG2      VAL 120  13.768   3.636  -1.374
  883    H    GLN 121           H        GLN 121  16.322   1.219  -0.095
  884    HA   GLN 121           HA       GLN 121  16.401  -1.000  -1.806
  885   1HB   GLN 121          1HB       GLN 121  18.559   0.520  -0.345
  886   2HB   GLN 121          2HB       GLN 121  18.933  -0.834  -1.402
  887   1HG   GLN 121          1HG       GLN 121  17.320   1.506  -2.351
  888   2HG   GLN 121          2HG       GLN 121  19.083   1.515  -2.374
  889   2HE2  GLN 121          2HE2      GLN 121  20.142   0.444  -3.947
  890   1HE2  GLN 121          1HE2      GLN 121  19.372  -0.443  -5.213
  891    H    ALA 122           H        ALA 122  16.611  -0.680   1.608
  892    HA   ALA 122           HA       ALA 122  17.651  -3.368   2.006
  893   1HB   ALA 122          1HB       ALA 122  18.002  -1.115   3.443
  894   2HB   ALA 122          2HB       ALA 122  16.653  -1.837   4.321
  895   3HB   ALA 122          3HB       ALA 122  18.156  -2.738   4.116
  896    H    TRP 123           H        TRP 123  14.653  -1.704   1.769
  897    HA   TRP 123           HA       TRP 123  13.040  -3.394   3.371
  898   1HB   TRP 123          1HB       TRP 123  12.549  -1.418   1.202
  899   2HB   TRP 123          2HB       TRP 123  11.262  -2.567   1.552
  900    HD1  TRP 123           HD1      TRP 123  11.651   0.760   2.230
  901    HE1  TRP 123           HE1      TRP 123  10.891   1.488   4.579
  902    HE3  TRP 123           HE3      TRP 123  11.637  -3.774   4.563
  903    HZ2  TRP 123           HZ2      TRP 123  10.365   0.266   7.058
  904    HZ3  TRP 123           HZ3      TRP 123  10.994  -3.916   6.913
  905    HH2  TRP 123           HH2      TRP 123  10.364  -1.914   8.149
  906    H    ILE 124           H        ILE 124  14.613  -3.918   0.408
  907    HA   ILE 124           HA       ILE 124  13.056  -6.384   0.001
  908    HB   ILE 124           HB       ILE 124  13.537  -6.160  -2.447
  909   1HG1  ILE 124          1HG1      ILE 124  13.906  -3.232  -2.120
  910   2HG1  ILE 124          2HG1      ILE 124  15.301  -4.247  -1.769
  911   1HG2  ILE 124          1HG2      ILE 124  11.831  -4.056  -1.130
  912   2HG2  ILE 124          2HG2      ILE 124  11.758  -4.469  -2.843
  913   3HG2  ILE 124          3HG2      ILE 124  11.338  -5.675  -1.627
  914   1HD1  ILE 124          1HD1      ILE 124  15.004  -5.280  -4.024
  915   2HD1  ILE 124          2HD1      ILE 124  13.780  -4.055  -4.351
  916   3HD1  ILE 124          3HD1      ILE 124  15.447  -3.573  -4.036
  917    H    ARG 125           H        ARG 125  15.822  -5.386   1.136
  918    HA   ARG 125           HA       ARG 125  17.819  -6.652  -0.403
  919   1HB   ARG 125          1HB       ARG 125  17.709  -5.136   1.960
  920   2HB   ARG 125          2HB       ARG 125  18.445  -6.666   2.416
  921   1HG   ARG 125          1HG       ARG 125  19.717  -5.983   0.052
  922   2HG   ARG 125          2HG       ARG 125  19.548  -4.455   0.918
  923   1HD   ARG 125          1HD       ARG 125  20.337  -6.271   2.864
  924   2HD   ARG 125          2HD       ARG 125  21.294  -6.705   1.449
  925    HE   ARG 125           HE       ARG 125  21.340  -4.129   2.849
  926   1HH1  ARG 125          1HH1      ARG 125  22.633  -6.277   0.430
  927   2HH1  ARG 125          2HH1      ARG 125  24.073  -5.348   0.188
  928   1HH2  ARG 125          1HH2      ARG 125  23.234  -2.897   2.537
  929   2HH2  ARG 125          2HH2      ARG 125  24.415  -3.426   1.386
  930    H    GLY 126           H        GLY 126  17.648  -8.746  -0.934
  931   1HA   GLY 126          1HA       GLY 126  17.348 -10.672   1.278
  932   2HA   GLY 126          2HA       GLY 126  18.209 -10.985  -0.222
  933    H    CYS 127           H        CYS 127  15.503  -9.330  -1.066
  934    HA   CYS 127           HA       CYS 127  13.465 -11.235  -0.872
  935   1HB   CYS 127          1HB       CYS 127  13.906  -8.774  -2.360
  936   2HB   CYS 127          2HB       CYS 127  12.663  -9.835  -2.989
  937    H    ARG 128           H        ARG 128  12.359 -11.720  -3.251
  938    HA   ARG 128           HA       ARG 128  14.415 -13.171  -4.782
  939   1HB   ARG 128          1HB       ARG 128  12.303 -14.282  -3.274
  940   2HB   ARG 128          2HB       ARG 128  11.858 -14.472  -4.963
  941   1HG   ARG 128          1HG       ARG 128  13.070 -16.345  -4.840
  942   2HG   ARG 128          2HG       ARG 128  14.451 -15.262  -5.017
  943   1HD   ARG 128          1HD       ARG 128  14.314 -15.078  -2.433
  944   2HD   ARG 128          2HD       ARG 128  13.367 -16.561  -2.548
  945    HE   ARG 128           HE       ARG 128  15.793 -16.783  -4.006
  946   1HH1  ARG 128          1HH1      ARG 128  14.499 -16.815  -0.770
  947   2HH1  ARG 128          2HH1      ARG 128  15.766 -17.813  -0.137
  948   1HH2  ARG 128          1HH2      ARG 128  17.462 -18.096  -3.180
  949   2HH2  ARG 128          2HH2      ARG 128  17.450 -18.540  -1.506
  950    H    LEU 129           H        LEU 129  14.352 -11.216  -6.122
  951    HA   LEU 129           HA       LEU 129  12.555 -11.572  -8.336
  952   1HB   LEU 129          1HB       LEU 129  11.925  -9.054  -8.209
  953   2HB   LEU 129          2HB       LEU 129  11.012 -10.228  -7.280
  954    HG   LEU 129           HG       LEU 129  13.225  -9.213  -5.726
  955   1HD1  LEU 129          1HD1      LEU 129  11.426  -7.226  -7.065
  956   2HD1  LEU 129          2HD1      LEU 129  12.110  -6.914  -5.469
  957   3HD1  LEU 129          3HD1      LEU 129  13.176  -7.176  -6.849
  958   1HD2  LEU 129          1HD2      LEU 129  11.101 -10.367  -4.982
  959   2HD2  LEU 129          2HD2      LEU 129  11.558  -8.923  -4.079
  960   3HD2  LEU 129          3HD2      LEU 129  10.274  -8.838  -5.284

  No H/Q in entry =         960
  Start of MODEL   13
    1    H1   LYS   1           H1       LYS   1  -7.907  -8.343   0.337
    2    H2   LYS   1           H2       LYS   1  -7.560  -8.659  -1.288
    3    H3   LYS   1           H3       LYS   1  -8.506  -9.742  -0.398
    4    HA   LYS   1           HA       LYS   1  -6.658 -10.314   0.998
    5   1HB   LYS   1          1HB       LYS   1  -6.850 -10.760  -1.835
    6   2HB   LYS   1          2HB       LYS   1  -5.157 -10.751  -1.361
    7   1HG   LYS   1          1HG       LYS   1  -6.999 -12.328   0.327
    8   2HG   LYS   1          2HG       LYS   1  -6.675 -12.939  -1.296
    9   1HD   LYS   1          1HD       LYS   1  -4.343 -12.043   0.295
   10   2HD   LYS   1          2HD       LYS   1  -5.138 -13.531   0.810
   11   1HE   LYS   1          1HE       LYS   1  -4.671 -13.332  -2.078
   12   2HE   LYS   1          2HE       LYS   1  -3.203 -13.372  -1.101
   13   1HZ   LYS   1          1HZ       LYS   1  -5.043 -15.313  -0.181
   14   2HZ   LYS   1          2HZ       LYS   1  -4.786 -15.516  -1.841
   15   3HZ   LYS   1          3HZ       LYS   1  -3.473 -15.532  -0.773
   16    H    VAL   2           H        VAL   2  -4.450 -10.101   1.553
   17    HA   VAL   2           HA       VAL   2  -3.275  -7.516   0.766
   18    HB   VAL   2           HB       VAL   2  -2.981  -9.040   3.357
   19   1HG1  VAL   2          1HG1      VAL   2  -0.977  -7.621   2.254
   20   2HG1  VAL   2          2HG1      VAL   2  -1.837  -6.333   3.093
   21   3HG1  VAL   2          3HG1      VAL   2  -1.247  -7.730   3.993
   22   1HG2  VAL   2          1HG2      VAL   2  -4.926  -7.254   2.564
   23   2HG2  VAL   2          2HG2      VAL   2  -4.516  -7.675   4.227
   24   3HG2  VAL   2          3HG2      VAL   2  -3.793  -6.255   3.472
   25    H    PHE   3           H        PHE   3  -1.456  -7.628  -0.443
   26    HA   PHE   3           HA       PHE   3  -0.150 -10.086  -0.985
   27   1HB   PHE   3          1HB       PHE   3   0.637  -7.210  -1.476
   28   2HB   PHE   3          2HB       PHE   3   1.624  -8.569  -1.995
   29    HD1  PHE   3           HD1      PHE   3  -2.046  -8.671  -2.103
   30    HD2  PHE   3           HD2      PHE   3   1.536  -7.988  -4.289
   31    HE1  PHE   3           HE1      PHE   3  -3.318  -8.752  -4.203
   32    HE2  PHE   3           HE2      PHE   3   0.276  -8.066  -6.390
   33    HZ   PHE   3           HZ       PHE   3  -2.153  -8.458  -6.356
   34    H    GLY   4           H        GLY   4   2.431  -9.936  -0.835
   35   1HA   GLY   4          1HA       GLY   4   3.859 -10.709   0.939
   36   2HA   GLY   4          2HA       GLY   4   3.019  -9.613   2.031
   37    H    ARG   5           H        ARG   5   5.906  -9.854   1.438
   38    HA   ARG   5           HA       ARG   5   6.362  -7.029   0.894
   39   1HB   ARG   5          1HB       ARG   5   8.788  -7.760   1.538
   40   2HB   ARG   5          2HB       ARG   5   7.560  -7.600   2.786
   41   1HG   ARG   5          1HG       ARG   5   7.180 -10.032   2.686
   42   2HG   ARG   5          2HG       ARG   5   8.477 -10.161   1.495
   43   1HD   ARG   5          1HD       ARG   5   9.674  -8.749   3.507
   44   2HD   ARG   5          2HD       ARG   5   8.610  -9.833   4.400
   45    HE   ARG   5           HE       ARG   5   9.774 -11.554   2.761
   46   1HH1  ARG   5          1HH1      ARG   5  11.169  -8.941   4.595
   47   2HH1  ARG   5          2HH1      ARG   5  12.707  -9.717   4.775
   48   1HH2  ARG   5          1HH2      ARG   5  11.794 -12.584   2.993
   49   2HH2  ARG   5          2HH2      ARG   5  13.062 -11.788   3.863
   50    H    CYS   6           H        CYS   6   8.049 -10.027  -0.091
   51    HA   CYS   6           HA       CYS   6   9.113  -8.675  -2.389
   52   1HB   CYS   6          1HB       CYS   6   9.198 -11.646  -1.950
   53   2HB   CYS   6          2HB       CYS   6  10.318 -10.622  -2.843
   54    H    GLU   7           H        GLU   7   6.637 -11.152  -1.826
   55    HA   GLU   7           HA       GLU   7   6.026 -11.930  -4.375
   56   1HB   GLU   7          1HB       GLU   7   4.813 -12.316  -2.016
   57   2HB   GLU   7          2HB       GLU   7   3.704 -11.130  -2.690
   58   1HG   GLU   7          1HG       GLU   7   2.729 -13.072  -3.381
   59   2HG   GLU   7          2HG       GLU   7   3.749 -12.705  -4.771
   60    H    LEU   8           H        LEU   8   4.905  -9.018  -2.724
   61    HA   LEU   8           HA       LEU   8   3.522  -7.927  -4.938
   62   1HB   LEU   8          1HB       LEU   8   3.081  -7.260  -2.612
   63   2HB   LEU   8          2HB       LEU   8   4.679  -6.552  -2.510
   64    HG   LEU   8           HG       LEU   8   2.579  -5.044  -2.916
   65   1HD1  LEU   8          1HD1      LEU   8   5.024  -4.410  -2.901
   66   2HD1  LEU   8          2HD1      LEU   8   4.984  -4.579  -4.656
   67   3HD1  LEU   8          3HD1      LEU   8   3.957  -3.385  -3.861
   68   1HD2  LEU   8          1HD2      LEU   8   2.242  -6.582  -5.104
   69   2HD2