*HEADER    CYTOKINE                                08-FEB-92   1ITL      1ITL   2
*COMPND    INTERLEUKIN 4 (IL-4) MUTANT WITH ADDITIONAL MET AT            1ITL   3
*COMPND   2 N-TERMINUS (NMR, ENERGY-MINIMIZED STRUCTURE)                 1ITL   4
*SOURCE    HUMAN (HOMO $SAPIENS) EXPRESSED IN (ESCHERICHIA $COLI)        1ITL   5
*EXPDTA    NMR                                                           1ITL   6
*AUTHOR    L.J.SMITH,C.REDFIELD,J.BOYD,G.M.P.LAWRENCE,R.G.EDWARDS,       1ITL   7
*AUTHOR   2 R.A.G.SMITH,C.M.DOBSON                                       1ITL   8
*REVDAT   1   15-APR-93 1ITL    0                                        1ITL   9
! This file contains the NOE, H-bond and phi restraints used in the
! calculation of human interleukin 4 structures using XPLOR.
!
! NOE effects between i,i
!
! residue  3 CYS
assign (resid    3 and  name HA   )(resid    3 and  name HN  ) 0.0 0.0 4.0
assign (resid    3 and  name HN   )(resid    3 and  name HB1  ) 0.0 0.0 4.0
assign (resid    3 and  name HN   )(resid    3 and  name HB2 ) 0.0 0.0 4.0
! residue  4 ASP
assign (resid    4 and  name HA   )(resid    4 and  name HN  ) 0.0 0.0 3.0
assign (resid    4 and  name HB1   )(resid    4 and  name HN  ) 0.0 0.0 3.0
assign (resid    4 and  name HB2   )(resid    4 and  name HN  ) 0.0 0.0 3.0
! residue  5 ILE 
assign (resid    5 and  name HN   )(resid    5 and  name HA  ) 0.0 0.0 3.0
assign (resid    5 and  name HN   )(resid    5 and  name HB  ) 0.0 0.0 2.5
assign (resid    5 and  name HN   )(resid    5 and  name HG11  ) 0.0 0.0 4.0
assign (resid    5 and  name HN   )(resid    5 and  name HG12  ) 0.0 0.0 4.0
assign (resid    5 and  name HN   )(resid    5 and  name HG2#  ) 0.0 0.0 4.5
assign (resid    5 and  name HN   )(resid    5 and  name HD1#  ) 0.0 0.0 6.5
! residue  6 THR
assign (resid    6 and  name HN   )(resid    6 and  name HA  ) 0.0 0.0 3.0
assign (resid    6 and  name HN   )(resid    6 and  name HB  ) 0.0 0.0 3.0
assign (resid    6 and  name HN   )(resid    6 and  name HG2# ) 0.0 0.0 4.5
! residue  7 LEU
assign (resid    7 and  name HA   )(resid    7 and  name HN  ) 0.0 0.0 4.0 
! residue  8 GLN
assign (resid    8 and  name HA   )(resid    8 and  name HN  ) 0.0 0.0 3.0
assign (resid    8 and  name HG1#  )(resid    8 and  name HN  ) 0.0 0.0 4.0
assign (resid    8 and  name HB#   )(resid    8 and  name HN  ) 0.0 0.0 3.5
! residue  9 GLU
assign (resid    9 and  name HN   )(resid    9 and  name HA  ) 0.0 0.0 3.0
assign (resid    9 and  name HN   )(resid    9 and  name HB#  ) 0.0 0.0 4.0
assign (resid    9 and  name HN   )(resid    9 and  name HG#  ) 0.0 0.0 4.0
! residue  10 ILE
assign (resid    10 and  name HN   )(resid    10 and  name HA  ) 0.0 0.0 3.0
assign (resid    10 and  name HN   )(resid    10 and  name HG2#  ) 0.0 0.0 4.5
assign (resid    10 and  name HN   )(resid    10 and  name HD1#  ) 0.0 0.0 5.5
! residue  11 ILE
assign (resid    11 and  name HA   )(resid    11 and  name HN  ) 0.0 0.0 3.0
assign (resid    11 and  name HN   )(resid    11 and  name HB  ) 0.0 0.0 2.5
assign (resid    11 and  name HN   )(resid    11 and  name HG11  ) 0.0 0.0 3.0
assign (resid    11 and  name HN   )(resid    11 and  name HG12  ) 0.0 0.0 3.0
assign (resid    11 and  name HN   )(resid    11 and  name HG2#  ) 0.0 0.0 4.5
assign (resid    11 and  name HN   )(resid    11 and  name HD1#  ) 0.0 0.0 5.5
! residue  12 LYS
assign (resid    12 and  name HN   )(resid    12 and  name HA  ) 0.0 0.0 3.0
! residue  13 THR
assign (resid    13 and  name HN   )(resid    13 and  name HA  ) 0.0 0.0 3.0
assign (resid    13 and  name HN   )(resid    13 and  name HB  ) 0.0 0.0 3.0
assign (resid    13 and  name HN   )(resid    13 and  name HG2#  ) 0.0 0.0 5.5 
! residue  14 LEU
assign (resid    14 and  name HN   )(resid    14 and  name HA  ) 0.0 0.0 3.0
! residue  15 ASN
assign (resid    15 and  name HN   )(resid    15 and  name HD21  ) 0.0 0.0 5.0 
assign (resid    15 and  name HN   )(resid    15 and  name HD22  ) 0.0 0.0 5.0
assign (resid    15 and  name HN   )(resid    15 and  name HB1  ) 0.0 0.0 3.0
assign (resid    15 and  name HN   )(resid    15 and  name HB2  ) 0.0 0.0 3.0
assign (resid    15 and  name HB1   )(resid    15 and  name HD21  ) 0.0 0.0 5.0 
assign (resid    15 and  name HB1   )(resid    15 and  name HD22  ) 0.0 0.0 5.0
assign (resid    15 and  name HB2   )(resid    15 and  name HD21  ) 0.0 0.0 5.0
assign (resid    15 and  name HB2   )(resid    15 and  name HD22  ) 0.0 0.0 5.0
assign (resid    15 and  name HN   )(resid    15 and  name HA  ) 0.0 0.0 3.0
! residue  16 SER
assign (resid    16 and  name HN   )(resid    16 and  name HA  ) 0.0 0.0 3.0
assign (resid    16 and  name HN   )(resid    16 and  name HB1  ) 0.0 0.0 3.0
assign (resid    16 and  name HN   )(resid    16 and  name HB2  ) 0.0 0.0 3.0
! residue  17 LEU
assign (resid    17 and  name HA   )(resid    17 and  name HN  ) 0.0 0.0 3.0
assign (resid    17 and  name HN   )(resid    17 and  name HB1  ) 0.0 0.0 3.0
assign (resid    17 and  name HN   )(resid    17 and  name HB2  ) 0.0 0.0 3.0
assign (resid    17 and  name HN   )(resid    17 and  name HG  ) 0.0 0.0 3.0
assign (resid    17 and  name HN   )(resid    17 and  name HD1#  ) 0.0 0.0 6.5 
assign (resid    17 and  name HN   )(resid    17 and  name HD2#  ) 0.0 0.0 6.5
! residue  18 THR
assign (resid    18 and  name HN   )(resid    18 and  name HA  ) 0.0 0.0 3.0
assign (resid    18 and  name HN   )(resid    18 and  name HG2#  ) 0.0 0.0 4.5 
assign (resid    18 and  name HN   )(resid    18 and  name HB  ) 0.0 0.0 5.0
! residue  19 GLU
assign (resid    19 and  name HN   )(resid    19 and  name HA  ) 0.0 0.0 3.0
assign (resid    19 and  name HN   )(resid    19 and  name HB#  ) 0.0 0.0 3.5
assign (resid    19 and  name HN   )(resid    19 and  name HG#  ) 0.0 0.0 5.0
! residue  20 GLN
assign (resid    20 and  name HA   )(resid    20 and  name HN  ) 0.0 0.0 3.0
assign (resid    20 and  name HN   )(resid    20 and  name HB#  ) 0.0 0.0 4.0
assign (resid    20 and  name HN   )(resid    20 and  name HG#  ) 0.0 0.0 5.0
assign (resid    20 and  name HE#   )(resid    20 and  name HG#  ) 0.0 0.0 7.0
! residue  21 LYS 
assign (resid    21 and  name HA   )(resid    21 and  name HN  ) 0.0 0.0 3.0
! residue  22 THR
assign (resid    22 and  name HN   )(resid    22 and  name HA  ) 0.0 0.0 4.0
assign (resid    22 and  name HN   )(resid    22 and  name HG2#  ) 0.0 0.0 4.5 
! residue  23 LEU
assign (resid    23 and  name HN   )(resid    23 and  name HA  ) 0.0 0.0 3.0
assign (resid    23 and  name HN   )(resid    23 and  name HG  ) 0.0 0.0 3.0
assign (resid    23 and  name HN   )(resid    23 and  name HB1  ) 0.0 0.0 3.0
assign (resid    23 and  name HN   )(resid    23 and  name HB2  ) 0.0 0.0 3.0
assign (resid    23 and  name HN   )(resid    23 and  name HD1#  ) 0.0 0.0 5.0
assign (resid    23 and  name HN   )(resid    23 and  name HD2#  ) 0.0 0.0 5.0
! residue  24 CYS
assign (resid    24 and  name HA   )(resid    24 and  name HN  ) 0.0 0.0 3.0
assign (resid    24 and  name HN   )(resid    24 and  name HB1  ) 0.0 0.0 4.0
assign (resid    24 and  name HN   )(resid    24 and  name HB2  ) 0.0 0.0 4.0
! residue  25 THR
assign (resid    25 and  name HN   )(resid    25 and  name HA  ) 0.0 0.0 4.0
assign (resid    25 and  name HN   )(resid    25 and  name HB  ) 0.0 0.0 4.0
assign (resid    25 and  name HN   )(resid    25 and  name HG2#  ) 0.0 0.0 4.5 
! residue  27 LEU
assign (resid    27 and  name HA   )(resid    27 and  name HN  ) 0.0 0.0 3.0
assign (resid    27 and  name HB1   )(resid    27 and  name HN  ) 0.0 0.0 4.0 
assign (resid    27 and  name HB2   )(resid    27 and  name HN  ) 0.0 0.0 4.0
assign (resid    27 and  name HG   )(resid    27 and  name HN  ) 0.0 0.0 3.0
assign (resid    27 and  name HD1#   )(resid    27 and  name HN  ) 0.0 0.0 5.5
assign (resid    27 and  name HD2#   )(resid    27 and  name HN  ) 0.0 0.0 5.5
! residue  28 THR
assign (resid    28 and  name HA   )(resid    28 and  name HN  ) 0.0 0.0 3.0
assign (resid    28 and  name HB   )(resid    28 and  name HN  ) 0.0 0.0 5.0
assign (resid    28 and  name HG2#   )(resid    28 and  name HN  ) 0.0 0.0 4.5 
! residue  29 VAL
assign (resid    29 and  name HA   )(resid    29 and  name HN  ) 0.0 0.0 4.0
assign (resid    29 and  name HB   )(resid    29 and  name HN  ) 0.0 0.0 5.0
assign (resid    29 and  name HG1#   )(resid    29 and  name HN  ) 0.0 0.0 6.5
assign (resid    29 and  name HG2#   )(resid    29 and  name HN  ) 0.0 0.0 6.5
! residue  30 THR
assign (resid    30 and  name HA   )(resid    30 and  name HN  ) 0.0 0.0 3.0
assign (resid    30 and  name HB   )(resid    30 and  name HN  ) 0.0 0.0 2.5
assign (resid    30 and  name HG2#   )(resid    30 and  name HN  ) 0.0 0.0 5.5
! residue  31 ASP
assign (resid    31 and  name HA   )(resid    31 and  name HN  ) 0.0 0.0 4.0
assign (resid    31 and  name HB1   )(resid    31 and  name HN  ) 0.0 0.0 3.0
assign (resid    31 and  name HB2   )(resid    31 and  name HN  ) 0.0 0.0 3.0
! residue  32 ILE
assign (resid    32 and  name HA   )(resid    32 and  name HN  ) 0.0 0.0 3.0
assign (resid    32 and  name HB   )(resid    32 and  name HN  ) 0.0 0.0 4.0
assign (resid    32 and  name HG11   )(resid    32 and  name HN  ) 0.0 0.0 3.0 
assign (resid    32 and  name HG12   )(resid    32 and  name HN  ) 0.0 0.0 3.0
assign (resid    32 and  name HG2#   )(resid    32 and  name HN  ) 0.0 0.0 4.5
assign (resid    32 and  name HD1#   )(resid    32 and  name HN  ) 0.0 0.0 5.5
! residue  33 PHE
assign (resid    33 and  name HA   )(resid    33 and  name HN  ) 0.0 0.0 3.0
assign (resid    33 and  name HB1   )(resid    33 and  name HN  ) 0.0 0.0 4.0
assign (resid    33 and  name HB2   )(resid    33 and  name HN  ) 0.0 0.0 4.0
assign (resid    33 and  name HD#   )(resid    33 and  name HN  ) 0.0 0.0 5.0
assign (resid    33 and  name HE#   )(resid    33 and  name HN  ) 0.0 0.0 7.0
! residue  34 ALA
assign (resid    34 and  name HA   )(resid    34 and  name HN  ) 0.0 0.0 3.0
assign (resid    34 and  name HB#  )(resid    34 and  name HN  ) 0.0 0.0 4.0
! residue  35 ALA
assign (resid    35 and  name HA   )(resid    35 and  name HN  ) 0.0 0.0 3.0
assign (resid    35 and  name HB#   )(resid    35 and  name HN  ) 0.0 0.0 4.5
! residue  36 SER
assign (resid    36 and  name HA   )(resid    36 and  name HN  ) 0.0 0.0 4.0
assign (resid    36 and  name HB1   )(resid    36 and  name HN  ) 0.0 0.0 4.0
assign (resid    36 and  name HB2   )(resid    36 and  name HN  ) 0.0 0.0 4.0
! residue  37 LYS
assign (resid    37 and  name HA   )(resid    37 and  name HN  ) 0.0 0.0 4.0
assign (resid    37 and  name HB#   )(resid    37 and  name HN  ) 0.0 0.0 4.0
! residue  38 ASN
assign (resid    38 and  name HA   )(resid    38 and  name HN  ) 0.0 0.0 4.0
assign (resid    38 and  name HB1   )(resid    38 and  name HN  ) 0.0 0.0 5.0
assign (resid    38 and  name HB2   )(resid    38 and  name HN  ) 0.0 0.0 5.0
assign (resid    38 and  name HB1   )(resid    38 and  name HD21  ) 0.0 0.0 6.0 
assign (resid    38 and  name HB2   )(resid    38 and  name HD22  ) 0.0 0.0 6.0
assign (resid    38 and  name HN   )(resid    38 and  name HD#  ) 0.0 0.0 7.0
! residue  39 THR
assign (resid    39 and  name HA   )(resid    39 and  name HN  ) 0.0 0.0 3.0
assign (resid    39 and  name HB   )(resid    39 and  name HN  ) 0.0 0.0 4.0
assign (resid    39 and  name HG2#   )(resid    39 and  name HN  ) 0.0 0.0 4.5 
! residue  40 THR
assign (resid    40 and  name HA   )(resid    40 and  name HN  ) 0.0 0.0 4.0
assign (resid    40 and  name HG2#   )(resid    40 and  name HN  ) 0.0 0.0 4.0 
! residue  41 GLU
assign (resid    41 and  name HA   )(resid    41 and  name HN  ) 0.0 0.0 2.5
assign (resid    41 and  name HB#   )(resid    41 and  name HN  ) 0.0 0.0 4.0
! residue  42 LYS
assign (resid    42 and  name HA   )(resid    42 and  name HN  ) 0.0 0.0 3.0
! residue  43 GLU
assign (resid    43 and  name HA   )(resid    43 and  name HN  ) 0.0 0.0 3.0
assign (resid    43 and  name HB#   )(resid    43 and  name HN  ) 0.0 0.0 4.0
assign (resid    43 and  name HG#   )(resid    43 and  name HN  ) 0.0 0.0 3.5
! residue  44 THR
assign (resid    44 and  name HA   )(resid    44 and  name HN  ) 0.0 0.0 3.0
assign (resid    44 and  name HB   )(resid    44 and  name HN  ) 0.0 0.0 2.5
assign (resid    44 and  name HG2#   )(resid    44 and  name HN  ) 0.0 0.0 5.5
assign (resid    44 and  name HA   )(resid    44 and  name HN  ) 0.0 0.0 3.0
! residue  45 PHE
assign (resid    45 and  name HN   )(resid    45 and  name HD#  ) 0.0 0.0 6.0
assign (resid    45 and  name HN   )(resid    45 and  name HA  ) 0.0 0.0 3.0
assign (resid    45 and  name HN   )(resid    45 and  name HB1  ) 0.0 0.0 3.0
assign (resid    45 and  name HN   )(resid    45 and  name HB2  ) 0.0 0.0 3.0
! residue  46 CYS
assign (resid    46 and  name HA   )(resid    46 and  name HN  ) 0.0 0.0 3.0
assign (resid    46 and  name HB1   )(resid    46 and  name HN  ) 0.0 0.0 4.0
assign (resid    46 and  name HB2   )(resid    46 and  name HN  ) 0.0 0.0 4.0
! residue  47 ARG
assign (resid    47 and  name HA   )(resid    47 and  name HN  ) 0.0 0.0 4.0
! residue  48 ALA
assign (resid    48 and  name HA   )(resid    48 and  name HN  ) 0.0 0.0 4.0
assign (resid    48 and  name HB#   )(resid    48 and  name HN  ) 0.0 0.0 4.0
! residue  49 ALA
assign (resid    49 and  name HA   )(resid    49 and  name HN  ) 0.0 0.0 3.0
! residue  50 THR
assign (resid    50 and  name HA   )(resid    50 and  name HN  ) 0.0 0.0 3.0
assign (resid    50 and  name HB   )(resid    50 and  name HN  ) 0.0 0.0 3.0
assign (resid    50 and  name HG2#   )(resid    50 and  name HN  ) 0.0 0.0 5.5
! residue  51 VAL
assign (resid    51 and  name HA   )(resid    51 and  name HN  ) 0.0 0.0 3.0
assign (resid    51 and  name HB   )(resid    51 and  name HN  ) 0.0 0.0 3.0
assign (resid    51 and  name HG1#   )(resid    51 and  name HN  ) 0.0 0.0 4.5
assign (resid    51 and  name HG2#   )(resid    51 and  name HN  ) 0.0 0.0 4.5
! residue  52 LEU
assign (resid    52 and  name HA   )(resid    52 and  name HN  ) 0.0 0.0 3.0
! residue  54 GLN
assign (resid    54 and  name HA   )(resid    54 and  name HN  ) 0.0 0.0 3.0
assign (resid    54 and  name HG#   )(resid    54 and  name HN  ) 0.0 0.0 4.0
assign (resid    54 and  name HB#   )(resid    54 and  name HN  ) 0.0 0.0 4.0
! residue  55 PHE
assign (resid    55 and  name HA   )(resid    55 and  name HN  ) 0.0 0.0 3.0
assign (resid    55 and  name HB1   )(resid    55 and  name HN  ) 0.0 0.0 3.0
assign (resid    55 and  name HB2   )(resid    55 and  name HN  ) 0.0 0.0 3.0
assign (resid    55 and  name HD#   )(resid    55 and  name HN  ) 0.0 0.0 6.0
! residue  56 TYR 
assign (resid    56 and  name HD#   )(resid    56 and  name HN  ) 0.0 0.0 6.0
assign (resid    56 and  name HE#   )(resid    56 and  name HN  ) 0.0 0.0 8.0
assign (resid    56 and  name HA   )(resid    56 and  name HN  ) 0.0 0.0 4.0
assign (resid    56 and  name HB1   )(resid    56 and  name HN  ) 0.0 0.0 4.0
assign (resid    56 and  name HB2   )(resid    56 and  name HN  ) 0.0 0.0 4.0
! residue  57 SER
assign (resid    57 and  name HA   )(resid    57 and  name HN  ) 0.0 0.0 3.0
assign (resid    57 and  name HB1   )(resid    57 and  name HN  ) 0.0 0.0 3.0
assign (resid    57 and  name HB2   )(resid    57 and  name HN  ) 0.0 0.0 3.0
! residue  58 HIS
assign (resid    58 and  name HA   )(resid    58 and  name HN  ) 0.0 0.0 3.0
assign (resid    58 and  name HB1   )(resid    58 and  name HN  ) 0.0 0.0 3.0
assign (resid    58 and  name HB2   )(resid    58 and  name HN  ) 0.0 0.0 3.0
! residue  59 HIS
assign (resid    59 and  name HD2   )(resid    59 and  name HN  ) 0.0 0.0 6.0
assign (resid    59 and  name HA   )(resid    59 and  name HN  ) 0.0 0.0 5.0
assign (resid    59 and  name HB1   )(resid    59 and  name HN  ) 0.0 0.0 5.0
assign (resid    59 and  name HB2   )(resid    59 and  name HN  ) 0.0 0.0 5.0
assign (resid    59 and  name HB1   )(resid    59 and  name HD2  ) 0.0 0.0 3.0
assign (resid    59 and  name HB2   )(resid    59 and  name HD2  ) 0.0 0.0 3.0
! residue  60 GLU
assign (resid    60 and  name HA   )(resid    60 and  name HN  ) 0.0 0.0 3.0
assign (resid    60 and  name HB#   )(resid    60 and  name HN  ) 0.0 0.0 4.0
assign (resid    60 and  name HG#   )(resid    60 and  name HN  ) 0.0 0.0 4.0
! residue  61 LYS
assign (resid    61 and  name HA   )(resid    61 and  name HN  ) 0.0 0.0 5.0
! residue  62 ASP
assign (resid    62 and  name HA   )(resid    62 and  name HN  ) 0.0 0.0 4.0
assign (resid    62 and  name HB1   )(resid    62 and  name HN  ) 0.0 0.0 3.0
assign (resid    62 and  name HB2   )(resid    62 and  name HN  ) 0.0 0.0 3.0
! residue  63 THR
assign (resid    63 and  name HA   )(resid    63 and  name HN  ) 0.0 0.0 4.0
assign (resid    63 and  name HB   )(resid    63 and  name HN  ) 0.0 0.0 4.0
assign (resid    63 and  name HG2#   )(resid    63 and  name HN  ) 0.0 0.0 4.5
! residue  64 ARG
assign (resid    64 and  name HA   )(resid    64 and  name HN  ) 0.0 0.0 3.0
! residue  65 CYS
assign (resid    65 and  name HA   )(resid    65 and  name HN  ) 0.0 0.0 5.0
assign (resid    65 and  name HB1   )(resid    65 and  name HN  ) 0.0 0.0 5.0
assign (resid    65 and  name HB2   )(resid    65 and  name HN  ) 0.0 0.0 5.0
! residue  66 LEU
assign (resid    66 and  name HA   )(resid    66 and  name HN  ) 0.0 0.0 4.0
assign (resid    66 and  name HB1   )(resid    66 and  name HN  ) 0.0 0.0 3.0
assign (resid    66 and  name HB2   )(resid    66 and  name HN  ) 0.0 0.0 3.0
assign (resid    66 and  name HG   )(resid    66 and  name HN  ) 0.0 0.0 3.0
assign (resid    66 and  name HD##   )(resid    66 and  name HN  ) 0.0 0.0 6.9 
! residue  67 GLY
assign (resid    67 and  name HA1   )(resid    67 and  name HN  ) 0.0 0.0 4.0
assign (resid    67 and  name HA2   )(resid    67 and  name HN  ) 0.0 0.0 4.0
!residue  68 ALA
assign (resid    68 and  name HA   )(resid    68 and  name HN  ) 0.0 0.0 4.0
assign (resid    68 and  name HB#   )(resid    68 and  name HN  ) 0.0 0.0 4.5
! residue  69 THR
assign (resid    69 and  name HA   )(resid    69 and  name HN  ) 0.0 0.0 4.0
assign (resid    69 and  name HG2#   )(resid    69 and  name HN  ) 0.0 0.0 5.5
! residue  70 ALA
assign (resid    70 and  name HA   )(resid    70 and  name HN  ) 0.0 0.0 5.0
assign (resid    70 and  name HB#   )(resid    70 and  name HN  ) 0.0 0.0 4.5
! residue  71 GLN
assign (resid    71 and  name HA   )(resid    71 and  name HN  ) 0.0 0.0 3.0
assign (resid    71 and  name HB#   )(resid    71 and  name HN  ) 0.0 0.0 4.0
assign (resid    71 and  name HG#   )(resid    71 and  name HN  ) 0.0 0.0 5.0
assign (resid    71 and  name HE#   )(resid    71 and  name HN  ) 0.0 0.0 6.0
! residue  72 GLN
assign (resid    72 and  name HA   )(resid    72 and  name HN  ) 0.0 0.0 3.0
assign (resid    72 and  name HG1   )(resid    72 and  name HN  ) 0.0 0.0 3.0
assign (resid    72 and  name HG2   )(resid    72 and  name HN  ) 0.0 0.0 3.0
assign (resid    72 and  name HE#   )(resid    72 and  name HN  ) 0.0 0.0 6.0
! residue  73 PHE
assign (resid    73 and  name HA   )(resid    73 and  name HN  ) 0.0 0.0 3.0
assign (resid    73 and  name HB1   )(resid    73 and  name HN  ) 0.0 0.0 3.0
assign (resid    73 and  name HB2   )(resid    73 and  name HN  ) 0.0 0.0 3.0
assign (resid    73 and  name HD#   )(resid    73 and  name HN  ) 0.0 0.0 7.0
! residue  74 HIS
assign (resid    74 and  name HA   )(resid    74 and  name HN  ) 0.0 0.0 3.0
assign (resid    74 and  name HB1   )(resid    74 and  name HN  ) 0.0 0.0 3.0
assign (resid    74 and  name HB2   )(resid    74 and  name HN  ) 0.0 0.0 3.0
! residue  75 ARG
assign (resid    75 and  name HA   )(resid    75 and  name HN  ) 0.0 0.0 3.0
! residue  76 HIS
assign (resid    76 and  name HA   )(resid    76 and  name HN  ) 0.0 0.0 4.0
assign (resid    76 and  name HB1   )(resid    76 and  name HN  ) 0.0 0.0 3.0
assign (resid    76 and  name HB2   )(resid    76 and  name HN  ) 0.0 0.0 3.0
assign (resid    76 and  name HD1   )(resid    76 and  name HN  ) 0.0 0.0 6.0
! residue  77 LYS
assign (resid    77 and  name HA   )(resid    77 and  name HN  ) 0.0 0.0 3.0
! residue  78 GLN
assign (resid    78 and  name HA   )(resid    78 and  name HN  ) 0.0 0.0 3.0
! residue  79 LEU
assign (resid    79 and  name HA   )(resid    79 and  name HN  ) 0.0 0.0 3.0
assign (resid    79 and  name HB1   )(resid    79 and  name HN  ) 0.0 0.0 3.0
assign (resid    79 and  name HB2   )(resid    79 and  name HN  ) 0.0 0.0 3.0
assign (resid    79 and  name HD1#   )(resid    79 and  name HN  ) 0.0 0.0 4.0
assign (resid    79 and  name HD2#   )(resid    79 and  name HN  ) 0.0 0.0 4.0
! residue  80 ILE
assign (resid    80 and  name HA   )(resid    80 and  name HN  ) 0.0 0.0 4.0
assign (resid    80 and  name HB   )(resid    80 and  name HN  ) 0.0 0.0 3.0
assign (resid    80 and  name HG11   )(resid    80 and  name HN  ) 0.0 0.0 3.0 
assign (resid    80 and  name HG12   )(resid    80 and  name HN  ) 0.0 0.0 3.0
assign (resid    80 and  name HG2#  )(resid    80 and  name HN  ) 0.0 0.0 5.5
assign (resid    80 and  name HD1#   )(resid    80 and  name HN  ) 0.0 0.0 5.5
! residue  81 ARG
assign (resid    81 and  name HA   )(resid    81 and  name HN  ) 0.0 0.0 3.0
! residue  82 PHE
assign (resid    82 and  name HA   )(resid    82 and  name HN  ) 0.0 0.0 3.0
assign (resid    82 and  name HE#   )(resid    82 and  name HN  ) 0.0 0.0 8.0
assign (resid    82 and  name HD#   )(resid    82 and  name HN  ) 0.0 0.0 7.0
assign (resid    82 and  name HB1   )(resid    82 and  name HN  ) 0.0 0.0 3.0
assign (resid    82 and  name HB2   )(resid    82 and  name HN  ) 0.0 0.0 3.0
! residue  83 LEU
assign (resid    83 and  name HA   )(resid    83 and  name HN  ) 0.0 0.0 4.0
assign (resid    83 and  name HB#   )(resid    83 and  name HN  ) 0.0 0.0 4.0
assign (resid    83 and  name HG   )(resid    83 and  name HN  ) 0.0 0.0 3.0
assign (resid    83 and  name HD1#   )(resid    83 and  name HN  ) 0.0 0.0 5.5 
assign (resid    83 and  name HD2#   )(resid    83 and  name HN  ) 0.0 0.0 5.5
! residue  84 LYS
assign (resid    84 and  name HA   )(resid    84 and  name HN  ) 0.0 0.0 3.0
! residue  85 ARG
assign (resid    85 and  name HA   )(resid    85 and  name HN  ) 0.0 0.0 3.0
! residue  86 LEU
assign (resid    86 and  name HA   )(resid    86 and  name HN  ) 0.0 0.0 3.0
assign (resid    86 and  name HB#   )(resid    86 and  name HN  ) 0.0 0.0 4.0
assign (resid    86 and  name HG   )(resid    86 and  name HN  ) 0.0 0.0 3.0
assign (resid    86 and  name HD1#  )(resid    86 and  name HN  ) 0.0 0.0 6.5
assign (resid    86 and  name HD2#   )(resid    86 and  name HN  ) 0.0 0.0 6.5
! residue  87 ASP
assign (resid    87 and  name HA   )(resid    87 and  name HN  ) 0.0 0.0 3.0
assign (resid    87 and  name HB1   )(resid    87 and  name HN  ) 0.0 0.0 3.0
assign (resid    87 and  name HB2   )(resid    87 and  name HN  ) 0.0 0.0 3.0
! residue  88 ARG
assign (resid    88 and  name HA   )(resid    88 and  name HN  ) 0.0 0.0 3.0
! residue  89 ASN
assign (resid    89 and  name HA   )(resid    89 and  name HN  ) 0.0 0.0 3.0
assign (resid    89 and  name HD21  )(resid    89 and  name HN  ) 0.0 0.0 5.0
assign (resid    89 and  name HD22   )(resid    89 and  name HN  ) 0.0 0.0 5.0
assign (resid    89 and  name HB1   )(resid    89 and  name HN  ) 0.0 0.0 4.0
assign (resid    89 and  name HB2   )(resid    89 and  name HN  ) 0.0 0.0 4.0
assign (resid    89 and  name HA   )(resid    89 and  name HD#  ) 0.0 0.0 6.0 
assign (resid    89 and  name HB#   )(resid    89 and  name HD#  ) 0.0 0.0 7.0
! residue  90 LEU
assign (resid    90 and  name HA   )(resid    90 and  name HN  ) 0.0 0.0 4.0
! residue  91 TRP
assign (resid    91 and  name HA   )(resid    91 and  name HN  ) 0.0 0.0 5.0 
assign (resid    91 and  name HE3   )(resid    91 and  name HA  ) 0.0 0.0 4.0
assign (resid    91 and  name HE3   )(resid    91 and  name HB1  ) 0.0 0.0 4.0
assign (resid    91 and  name HE3   )(resid    91 and  name HB2  ) 0.0 0.0 4.0
assign (resid    91 and  name HD1   )(resid    91 and  name HA  ) 0.0 0.0 4.0
assign (resid    91 and  name HD1   )(resid    91 and  name HB1  ) 0.0 0.0 4.0
assign (resid    91 and  name HD1   )(resid    91 and  name HB2  ) 0.0 0.0 4.0
assign (resid    91 and  name HE3   )(resid    91 and  name HN  ) 0.0 0.0 6.0
assign (resid    91 and  name HB#   )(resid    91 and  name HN  ) 0.0 0.0 5.0
! residue  92 GLY
assign (resid    92 and  name HA1   )(resid    92 and  name HN  ) 0.0 0.0 4.0
assign (resid    92 and  name HA2   )(resid    92 and  name HN  ) 0.0 0.0 4.0
! residue  93 LEU
assign (resid    93 and  name HA   )(resid    93 and  name HN  ) 0.0 0.0 3.0 
! residue  94 ALA
assign (resid    94 and  name HA   )(resid    94 and  name HN  ) 0.0 0.0 3.0 
assign (resid    94 and  name HB#   )(resid    94 and  name HN  ) 0.0 0.0 4.5
! residue  95 GLY
assign (resid    95 and  name HA1   )(resid    95 and  name HN  ) 0.0 0.0 3.0
assign (resid    95 and  name HA2   )(resid    95 and  name HN  ) 0.0 0.0 3.0
! residue  96 LEU
assign (resid    96 and  name HA   )(resid    96 and  name HN  ) 0.0 0.0 5.0 
assign (resid    96 and  name HB#   )(resid    96 and  name HN  ) 0.0 0.0 4.0
assign (resid    96 and  name HG   )(resid    96 and  name HN  ) 0.0 0.0 4.0
assign (resid    96 and  name HD##   )(resid    96 and  name HN  ) 0.0 0.0 7.9
! residue  97 ASN
assign (resid    97 and  name HA   )(resid    97 and  name HN  ) 0.0 0.0 5.0
assign (resid    97 and  name HB#   )(resid    97 and  name HN  ) 0.0 0.0 5.0
! residue  98 SER
assign (resid    98 and  name HA   )(resid    98 and  name HN  ) 0.0 0.0 4.0
assign (resid    98 and  name HB#   )(resid    98 and  name HN  ) 0.0 0.0 5.0 
! residue  99 CYS
assign (resid    99 and  name HA   )(resid    99 and  name HN  ) 0.0 0.0 5.0
assign (resid    99 and  name HB1   )(resid    99 and  name HN  ) 0.0 0.0 6.0
assign (resid    99 and  name HB2   )(resid    99 and  name HN  ) 0.0 0.0 6.0
! residue  101 VAL
assign (resid    101 and  name HA   )(resid    101 and  name HN  ) 0.0 0.0 3.0
assign (resid    101 and  name HB   )(resid    101 and  name HN  ) 0.0 0.0 4.0
assign (resid    101 and  name HG1#   )(resid    101 and  name HN  ) 0.0 0.0 5.5
assign (resid    101 and  name HG2#   )(resid    101 and  name HN  ) 0.0 0.0 5.5
! residue  102 LYS
assign (resid    102 and  name HA   )(resid    102 and  name HN  ) 0.0 0.0 5.0
assign (resid    102 and  name HB#   )(resid    102 and  name HN  ) 0.0 0.0 6.0
! residue  103 GLU
assign (resid    103 and  name HA   )(resid    103 and  name HN  ) 0.0 0.0 4.0
assign (resid    103 and  name HB#   )(resid    103 and  name HN  ) 0.0 0.0 4.0
assign (resid    103 and  name HG#   )(resid    103 and  name HN  ) 0.0 0.0 6.0
! residue  104 ALA
assign (resid    104 and  name HA   )(resid    104 and  name HN  ) 0.0 0.0 5.0
assign (resid    104 and  name HB#   )(resid    104 and  name HN  ) 0.0 0.0 4.5
! residue  105 ASN
assign (resid    105 and  name HA   )(resid    105 and  name HN  ) 0.0 0.0 2.5
assign (resid    105 and  name HB1   )(resid    105 and  name HN  ) 0.0 0.0 4.0
assign (resid    105 and  name HB2   )(resid    105 and  name HN  ) 0.0 0.0 4.0
assign (resid    105 and  name HB1   )(resid    105 and  name HD#  ) 0.0 0.0 6.0
assign (resid    105 and  name HB2   )(resid    105 and  name HD#  ) 0.0 0.0 6.0
assign (resid    105 and  name HD21   )(resid    105 and  name HN  ) 0.0 0.0 5.0
assign (resid    105 and  name HD22   )(resid    105 and  name HN  ) 0.0 0.0 5.0
! residue  106 GLN
assign (resid    106 and  name HA   )(resid    106 and  name HN  ) 0.0 0.0 6.0 
assign (resid    106 and  name HA   )(resid    106 and  name HE#  ) 0.0 0.0 7.0
assign (resid    106 and  name HB#   )(resid    106 and  name HN  ) 0.0 0.0 6.0
assign (resid    106 and  name HG#   )(resid    106 and  name HN  ) 0.0 0.0 6.0
assign (resid    106 and  name HG#   )(resid    106 and  name HE#  ) 0.0 0.0 6.0
! residue  107 SER
assign (resid    107 and  name HA   )(resid    107 and  name HN  ) 0.0 0.0 4.0
assign (resid    107 and  name HB1   )(resid    107 and  name HN  ) 0.0 0.0 5.0
assign (resid    107 and  name HB2   )(resid    107 and  name HN  ) 0.0 0.0 5.0
! residue  108 THR
assign (resid    108 and  name HA   )(resid    108 and  name HN  ) 0.0 0.0 4.0 
assign (resid    108 and  name HB   )(resid    108 and  name HN  ) 0.0 0.0 6.0
assign (resid    108 and  name HG2#   )(resid    108 and  name HN  ) 0.0 0.0 4.0
! residue  109 LEU
assign (resid    109 and  name HA   )(resid    109 and  name HN  ) 0.0 0.0 4.0 
assign (resid    109 and  name HB1   )(resid    109 and  name HN  ) 0.0 0.0 4.0
assign (resid    109 and  name HB2   )(resid    109 and  name HN  ) 0.0 0.0 4.0
assign (resid    109 and  name HG   )(resid    109 and  name HN  ) 0.0 0.0 6.0
assign (resid    109 and  name HD1#   )(resid    109 and  name HN  ) 0.0 0.0 6.5
assign (resid    109 and  name HD2#   )(resid    109 and  name HN  ) 0.0 0.0 6.5
! residue  110 GLU
assign (resid    110 and  name HA   )(resid    110 and  name HN  ) 0.0 0.0 5.0
assign (resid    110 and  name HB#   )(resid    110 and  name HN  ) 0.0 0.0 5.0
assign (resid    110 and  name HG#   )(resid    110 and  name HN  ) 0.0 0.0 6.0
! residue  111 ASN
assign (resid    111 and  name HA   )(resid    111 and  name HN  ) 0.0 0.0 3.0 
assign (resid    111 and  name HA   )(resid    111 and  name HD#  ) 0.0 0.0 7.0
assign (resid    111 and  name HD21   )(resid    111 and  name HN  ) 0.0 0.0 6.0
assign (resid    111 and  name HD22   )(resid    111 and  name HN  ) 0.0 0.0 6.0
assign (resid    111 and  name HB1   )(resid    111 and  name HN  ) 0.0 0.0 3.0
assign (resid    111 and  name HB2   )(resid    111 and  name HN  ) 0.0 0.0 3.0
! residue  112 PHE
assign (resid    112 and  name HA   )(resid    112 and  name HN  ) 0.0 0.0 3.0
assign (resid    112 and  name HB1   )(resid    112 and  name HN  ) 0.0 0.0 3.0
assign (resid    112 and  name HB2   )(resid    112 and  name HN  ) 0.0 0.0 3.0
assign (resid    112 and  name HD#   )(resid    112 and  name HN  ) 0.0 0.0 7.0
! residue  113 LEU
assign (resid    113 and  name HA   )(resid    113 and  name HN  ) 0.0 0.0 4.0
! residue  114 GLU
assign (resid    114 and  name HA   )(resid    114 and  name HN  ) 0.0 0.0 4.0
assign (resid    114 and  name HG#   )(resid    114 and  name HN  ) 0.0 0.0 4.0
! residue  115 ARG
assign (resid    115 and  name HA   )(resid    115 and  name HN  ) 0.0 0.0 3.0
assign (resid    115 and  name HN   )(resid    115 and  name HE#  ) 0.0 0.0 7.0
! residue  116 LEU
assign (resid    116 and  name HA   )(resid    116 and  name HN  ) 0.0 0.0 4.0 
! residue  117 LYS
assign (resid    117 and  name HA   )(resid    117 and  name HN  ) 0.0 0.0 3.0
! residue  118 THR
assign (resid    118 and  name HA   )(resid    118 and  name HN  ) 0.0 0.0 3.0 
assign (resid    118 and  name HB   )(resid    118 and  name HN  ) 0.0 0.0 2.5
assign (resid    118 and  name HG2#   )(resid    118 and  name HN  ) 0.0 0.0 5.5 
! residue  119 ILE
assign (resid    119 and  name HA   )(resid    119 and  name HN  ) 0.0 0.0 5.0
assign (resid    119 and  name HB   )(resid    119 and  name HN  ) 0.0 0.0 4.0
assign (resid    119 and  name HG11   )(resid    119 and  name HN  ) 0.0 0.0 5.0 
assign (resid    119 and  name HG12   )(resid    119 and  name HN  ) 0.0 0.0 5.0
assign (resid    119 and  name HG2#   )(resid    119 and  name HN  ) 0.0 0.0 6.5
assign (resid    119 and  name HD1#   )(resid    119 and  name HN  ) 0.0 0.0 7.5
! residue  120 MET
assign (resid    120 and  name HA   )(resid    120 and  name HN  ) 0.0 0.0 4.0
assign (resid    120 and  name HB1   )(resid    120 and  name HN  ) 0.0 0.0 4.0
assign (resid    120 and  name HB2   )(resid    120 and  name HN  ) 0.0 0.0 4.0
assign (resid    120 and  name HG1   )(resid    120 and  name HN  ) 0.0 0.0 5.0
assign (resid    120 and  name HG2   )(resid    120 and  name HN  ) 0.0 0.0 5.0
! residue  121 ARG
assign (resid    121 and  name HA   )(resid    121 and  name HN  ) 0.0 0.0 4.0 
! residue  122 GLU
assign (resid    122 and  name HA   )(resid    122 and  name HN  ) 0.0 0.0 3.0
assign (resid    122 and  name HB#   )(resid    122 and  name HN  ) 0.0 0.0 4.0 
assign (resid    122 and  name HG#   )(resid    122 and  name HN  ) 0.0 0.0 6.0
! residue  123 LYS
assign (resid    123 and  name HA   )(resid    123 and  name HN  ) 0.0 0.0 3.0
! residue  124 TYR
assign (resid    124 and  name HA   )(resid    124 and  name HN  ) 0.0 0.0 4.0
assign (resid    124 and  name HD#   )(resid    124 and  name HN  ) 0.0 0.0 7.0
assign (resid    124 and  name HB#   )(resid    124 and  name HN  ) 0.0 0.0 4.0
! residue  125 SER
assign (resid    125 and  name HA   )(resid    125 and  name HN  ) 0.0 0.0 4.0
assign (resid    125 and  name HB#   )(resid    125 and  name HN  ) 0.0 0.0 4.0
! residue  126 LYS
assign (resid    126 and  name HA   )(resid    126 and  name HN  ) 0.0 0.0 4.0
! residue  127 CYS
assign (resid    127 and  name HA   )(resid    127 and  name HN  ) 0.0 0.0 4.0 
assign (resid    127 and  name HB#  )(resid    127 and  name HN  ) 0.0 0.0 5.0
! residue  128 SER
assign (resid    128 and  name HA   )(resid    128 and  name HN  ) 0.0 0.0 5.0
assign (resid    128 and  name HB1   )(resid    128 and  name HN  ) 0.0 0.0 5.0
assign (resid    128 and  name HB2   )(resid    128 and  name HN  ) 0.0 0.0 5.0
! residue  129 SER
assign (resid    129 and  name HA  )(resid    129 and  name HN  ) 0.0 0.0 4.0
assign (resid    129 and  name HB#  )(resid    129 and  name HN  ) 0.0 0.0 6.0
!
! NOE effects between i,i+1
! from 1H-15N spectra
!
! residue  1 HIS
assign (resid    1 and  name HA   )(resid    2 and  name HN  ) 0.0 0.0 2.5
assign (resid    1 and  name HB#   )(resid    2 and  name HN  ) 0.0 0.0 4.0
! residue  2 LYS
assign (resid    2 and  name HA   )(resid    3 and  name HN  ) 0.0 0.0 4.0
assign (resid    2 and  name HN   )(resid    3 and  name HN  ) 0.0 0.0 4.0
! residue  3 CYS
assign (resid    3 and  name HA   )(resid    4 and  name HN  ) 0.0 0.0 3.0
assign (resid    3 and  name HN   )(resid    4 and  name HN  ) 0.0 0.0 4.0
assign (resid    4 and  name HN   )(resid    3 and  name HB1  ) 0.0 0.0 5.0 
assign (resid    4 and  name HN   )(resid    3 and  name HB2 ) 0.0 0.0 5.0
! residue  4 ASP
assign (resid    4 and  name HA   )(resid    5 and  name HN  ) 0.0 0.0 2.5
assign (resid    4 and  name HN   )(resid    5 and  name HN  ) 0.0 0.0 4.0
assign (resid    5 and  name HN   )(resid    4 and  name HB1  ) 0.0 0.0 5.0 
assign (resid    5 and  name HN   )(resid    4 and  name HB2  ) 0.0 0.0 5.0
! residue  5 ILE 
assign (resid    5 and  name HN   )(resid    6 and  name HN  ) 0.0 0.0 3.0
assign (resid    5 and  name HG11   )(resid    6 and  name HN  ) 0.0 0.0 5.0 
assign (resid    5 and  name HG12   )(resid    6 and  name HN  ) 0.0 0.0 5.0 
assign (resid    5 and  name HG2#   )(resid    6 and  name HN  ) 0.0 0.0 4.5
assign (resid    5 and  name HB   )(resid    6 and  name HN  ) 0.0 0.0 4.0
assign (resid    5 and  name HD1#   )(resid    6 and  name HN  ) 0.0 0.0 6.5
! residue  6 THR
assign (resid    6 and  name HN   )(resid    7 and  name HN  ) 0.0 0.0 3.0
assign (resid    7 and  name HN   )(resid    6 and  name HB  ) 0.0 0.0 4.0
assign (resid    6 and  name HN   )(resid    7 and  name HB# ) 0.0 0.0 6.0
assign (resid    6 and  name HN   )(resid    7 and  name HG ) 0.0 0.0 5.0
! residue  7 LEU
assign (resid    7 and  name HA   )(resid    8 and  name HN  ) 0.0 0.0 4.0
assign (resid    7 and  name HN   )(resid    8 and  name HN  ) 0.0 0.0 3.0
assign (resid    7 and  name HB#   )(resid    8 and  name HN  ) 0.0 0.0 4.0
assign (resid    7 and  name HG   )(resid    8 and  name HN  ) 0.0 0.0 3.0
assign (resid    7 and  name HD1#  )(resid    8 and  name HN  ) 0.0 0.0 6.0
assign (resid    7 and  name HD2#   )(resid    8 and  name HN  ) 0.0 0.0 6.0
! residue  8 GLN
assign (resid    8 and  name HN   )(resid    9 and  name HN  ) 0.0 0.0 3.0
assign (resid    8 and  name HA   )(resid    9 and  name HN  ) 0.0 0.0 4.0
! residue  9 GLU
assign (resid    9 and  name HA   )(resid    10 and  name HN  ) 0.0 0.0 4.0
assign (resid    9 and  name HN   )(resid    10 and  name HN  ) 0.0 0.0 3.0
assign (resid    10 and  name HN   )(resid    9 and  name HA  ) 0.0 0.0 4.0
assign (resid    10 and  name HN   )(resid    9 and  name HB#  ) 0.0 0.0 6.0 
assign (resid    10 and  name HN   )(resid    9 and  name HG#  ) 0.0 0.0 6.0
! residue  10 ILE
assign (resid    10 and  name HA   )(resid    11 and  name HN  ) 0.0 0.0 5.0
assign (resid    10 and  name HN   )(resid    11 and  name HN  ) 0.0 0.0 3.0
assign (resid    10 and  name HN   )(resid    11 and  name HD1#  ) 0.0 0.0 7.5
assign (resid    10 and  name HN   )(resid    11 and  name HG1#  ) 0.0 0.0 6.0
assign (resid    10 and  name HN   )(resid    11 and  name HB  ) 0.0 0.0 5.0
assign (resid    11 and  name HN   )(resid    10 and  name HG2#  ) 0.0 0.0 5.5
assign (resid    11 and  name HN   )(resid    10 and  name HG1#  ) 0.0 0.0 6.0
assign (resid    11 and  name HN   )(resid    10 and  name HB  ) 0.0 0.0 3.0
! residue  11 ILE
assign (resid    11 and  name HA   )(resid    12 and  name HN  ) 0.0 0.0 4.0
assign (resid    11 and  name HN   )(resid    12 and  name HN  ) 0.0 0.0 3.0
assign (resid    12 and  name HN   )(resid    11 and  name HD1#  ) 0.0 0.0 6.5
assign (resid    12 and  name HN   )(resid    11 and  name HG2#  ) 0.0 0.0 5.5
assign (resid    12 and  name HN   )(resid    11 and  name HG11  ) 0.0 0.0 6.0
assign (resid    12 and  name HN   )(resid    11 and  name HG12  ) 0.0 0.0 6.0
assign (resid    12 and  name HN   )(resid    11 and  name HB  ) 0.0 0.0 3.0
! residue  12 LYS
assign (resid    12 and  name HA   )(resid    13 and  name HN  ) 0.0 0.0 4.0
assign (resid    12 and  name HN   )(resid    13 and  name HN  ) 0.0 0.0 3.0
! residue  13 THR
assign (resid    13 and  name HA   )(resid    14 and  name HN  ) 0.0 0.0 4.0
assign (resid    13 and  name HN   )(resid    14 and  name HN  ) 0.0 0.0 3.0
assign (resid    14 and  name HN   )(resid    13 and  name HA  ) 0.0 0.0 4.0
assign (resid    14 and  name HN   )(resid    13 and  name HB  ) 0.0 0.0 3.0
assign (resid    14 and  name HN   )(resid    13 and  name HG2#  ) 0.0 0.0 5.5 
! residue  14 LEU
assign (resid    14 and  name HA   )(resid    15 and  name HN  ) 0.0 0.0 4.0
assign (resid    14 and  name HN   )(resid    15 and  name HN  ) 0.0 0.0 3.0
assign (resid    14 and  name HN   )(resid    15 and  name HB1  ) 0.0 0.0 5.0
assign (resid    14 and  name HN   )(resid    15 and  name HB2  ) 0.0 0.0 5.0
assign (resid    15 and  name HN   )(resid    14 and  name HA  ) 0.0 0.0 4.0
assign (resid    15 and  name HD21   )(resid    14 and  name HA  ) 0.0 0.0 6.0
assign (resid    15 and  name HD22   )(resid    14 and  name HA  ) 0.0 0.0 6.0
! residue  15 ASN
assign (resid    15 and  name HA   )(resid    16 and  name HN  ) 0.0 0.0 5.0
assign (resid    15 and  name HN   )(resid    16 and  name HN  ) 0.0 0.0 3.0
assign (resid    16 and  name HN   )(resid    15 and  name HD#  ) 0.0 0.0 7.0
assign (resid    16 and  name HN   )(resid    15 and  name HB1  ) 0.0 0.0 3.0
assign (resid    16 and  name HN   )(resid    15 and  name HB2  ) 0.0 0.0 3.0
! residue  16 SER
assign (resid    16 and  name HA   )(resid    17 and  name HN  ) 0.0 0.0 4.0
assign (resid    16 and  name HN   )(resid    17 and  name HN  ) 0.0 0.0 3.0
assign (resid    17 and  name HN   )(resid    16 and  name HB1  ) 0.0 0.0 3.0
assign (resid    17 and  name HN   )(resid    16 and  name HB2  ) 0.0 0.0 3.0
assign (resid    17 and  name HA   )(resid    16 and  name HN  ) 0.0 0.0 6.0
! residue  17 LEU
assign (resid    17 and  name HA   )(resid    18 and  name HN  ) 0.0 0.0 4.0
assign (resid    17 and  name HN   )(resid    18 and  name HN  ) 0.0 0.0 3.0
assign (resid    18 and  name HN   )(resid    17 and  name HB1  ) 0.0 0.0 5.0
assign (resid    18 and  name HN   )(resid    17 and  name HB2  ) 0.0 0.0 5.0
assign (resid    18 and  name HN   )(resid    17 and  name HG  ) 0.0 0.0 6.0
assign (resid    18 and  name HN   )(resid    17 and  name HD1#  ) 0.0 0.0 6.5
assign (resid    18 and  name HN   )(resid    17 and  name HD2#  ) 0.0 0.0 6.5
! residue  18 THR
assign (resid    18 and  name HA   )(resid    19 and  name HN  ) 0.0 0.0 4.0
assign (resid    18 and  name HN   )(resid    19 and  name HA  ) 0.0 0.0 5.0
assign (resid    18 and  name HN   )(resid    19 and  name HN  ) 0.0 0.0 3.0
assign (resid    18 and  name HN   )(resid    19 and  name HB#  ) 0.0 0.0 6.0
assign (resid    19 and  name HN   )(resid    18 and  name HB  ) 0.0 0.0 5.0
assign (resid    19 and  name HN   )(resid    18 and  name HG2#  ) 0.0 0.0 6.5
! residue  19 GLU
assign (resid    20 and  name HN   )(resid    19 and  name HB#  ) 0.0 0.0 4.0
assign (resid    19 and  name HA   )(resid    20 and  name HN  ) 0.0 0.0 4.0
assign (resid    19 and  name HN   )(resid    20 and  name HN  ) 0.0 0.0 3.0
assign (resid    20 and  name HE#   )(resid    19 and  name HB#  ) 0.0 0.0 8.0
! residue  20 GLN
assign (resid    20 and  name HA   )(resid    21 and  name HN  ) 0.0 0.0 4.0
assign (resid    20 and  name HN   )(resid    21 and  name HN  ) 0.0 0.0 5.0
assign (resid    20 and  name HB#   )(resid    21 and  name HN  ) 0.0 0.0 6.0
assign (resid    20 and  name HG#   )(resid    21 and  name HN  ) 0.0 0.0 7.0
! residue  21 LYS 
assign (resid    21 and  name HA   )(resid    22 and  name HN  ) 0.0 0.0 2.5
assign (resid    21 and  name HN   )(resid    22 and  name HN  ) 0.0 0.0 5.0
! residue  22 THR
assign (resid    22 and  name HA   )(resid    23 and  name HN  ) 0.0 0.0 3.0
assign (resid    22 and  name HN   )(resid    23 and  name HN  ) 0.0 0.0 5.0
assign (resid    23 and  name HN   )(resid    22 and  name HG2#  ) 0.0 0.0 5.5 
assign (resid    23 and  name HN   )(resid    22 and  name HB  ) 0.0 0.0 3.0
! residue  23 LEU
assign (resid    23 and  name HA   )(resid    24 and  name HN  ) 0.0 0.0 4.0
assign (resid    23 and  name HN   )(resid    24 and  name HN  ) 0.0 0.0 6.0
assign (resid    24 and  name HN   )(resid    23 and  name HG  ) 0.0 0.0 5.0
assign (resid    24 and  name HN   )(resid    23 and  name HB1  ) 0.0 0.0 4.0
assign (resid    24 and  name HN   )(resid    23 and  name HB2  ) 0.0 0.0 4.0
assign (resid    24 and  name HN   )(resid    23 and  name HD1#  ) 0.0 0.0 6.5
assign (resid    24 and  name HN   )(resid    23 and  name HD2#  ) 0.0 0.0 6.5
! residue  24 CYS
assign (resid    25 and  name HN   )(resid    24 and  name HB1  ) 0.0 0.0 5.0
assign (resid    25 and  name HN   )(resid    24 and  name HB2  ) 0.0 0.0 5.0
assign (resid    24 and  name HA   )(resid    25 and  name HN  ) 0.0 0.0 4.0
assign (resid    24 and  name HN   )(resid    25 and  name HN  ) 0.0 0.0 3.0
! residue  27 LEU
assign (resid    27 and  name HA   )(resid    28 and  name HN  ) 0.0 0.0 2.5
assign (resid    27 and  name HB1   )(resid    28 and  name HN  ) 0.0 0.0 4.0
assign (resid    27 and  name HB2   )(resid    28 and  name HN  ) 0.0 0.0 4.0
assign (resid    27 and  name HG   )(resid    28 and  name HN  ) 0.0 0.0 6.0
assign (resid    27 and  name HD1#   )(resid    28 and  name HN  ) 0.0 0.0 6.5
assign (resid    27 and  name HD2#   )(resid    28 and  name HN  ) 0.0 0.0 6.5
assign (resid    27 and  name HN   )(resid    28 and  name HN  ) 0.0 0.0 6.0
! residue  28 THR
assign (resid    28 and  name HA   )(resid    29 and  name HN  ) 0.0 0.0 3.0
assign (resid    28 and  name HB   )(resid    29 and  name HN  ) 0.0 0.0 3.0
assign (resid    28 and  name HG2#   )(resid    29 and  name HN  ) 0.0 0.0 6.5
assign (resid    28 and  name HN   )(resid    29 and  name HN  ) 0.0 0.0 5.0
! residue  29 VAL
assign (resid    29 and  name HB   )(resid    30 and  name HN  ) 0.0 0.0 3.0
assign (resid    29 and  name HA   )(resid    30 and  name HN  ) 0.0 0.0 2.5
assign (resid    29 and  name HN   )(resid    30 and  name HN  ) 0.0 0.0 6.0
assign (resid    29 and  name HG1#   )(resid    30 and  name HN  ) 0.0 0.0 5.5
assign (resid    29 and  name HG2#   )(resid    30 and  name HN  ) 0.0 0.0 5.5
! residue  30 THR
assign (resid    30 and  name HA   )(resid    31 and  name HN  ) 0.0 0.0 2.5
assign (resid    30 and  name HB   )(resid    31 and  name HN  ) 0.0 0.0 5.0
assign (resid    30 and  name HG2#   )(resid    31 and  name HN  ) 0.0 0.0 4.5 
assign (resid    30 and  name HA   )(resid    31 and  name HN  ) 0.0 0.0 2.5
assign (resid    30 and  name HN   )(resid    31 and  name HN  ) 0.0 0.0 5.0
! residue  31 ASP
assign (resid    31 and  name HB1   )(resid    32 and  name HN  ) 0.0 0.0 6.0
assign (resid    31 and  name HB2   )(resid    32 and  name HN  ) 0.0 0.0 6.0
assign (resid    31 and  name HA   )(resid    32 and  name HN  ) 0.0 0.0 2.5
assign (resid    31 and  name HN   )(resid    32 and  name HN  ) 0.0 0.0 5.0
assign (resid    32 and  name HG1#   )(resid    31 and  name HN  ) 0.0 0.0 7.5 
assign (resid    32 and  name HD1#   )(resid    31 and  name HN  ) 0.0 0.0 7.5
! residue  32 ILE
assign (resid    32 and  name HA   )(resid    33 and  name HN  ) 0.0 0.0 4.0
assign (resid    32 and  name HN   )(resid    33 and  name HN  ) 0.0 0.0 3.0
assign (resid    32 and  name HN   )(resid    33 and  name HE#  ) 0.0 0.0 7.0
assign (resid    32 and  name HN   )(resid    33 and  name HA  ) 0.0 0.0 6.0
assign (resid    32 and  name HB   )(resid    33 and  name HN  ) 0.0 0.0 5.0
assign (resid    32 and  name HG11   )(resid    33 and  name HN  ) 0.0 0.0 5.0 
assign (resid    32 and  name HG12   )(resid    33 and  name HN  ) 0.0 0.0 5.0
assign (resid    32 and  name HG2#   )(resid    33 and  name HN  ) 0.0 0.0 6.5
assign (resid    32 and  name HD1#   )(resid    33 and  name HN  ) 0.0 0.0 6.5
assign (resid    32 and  name HD#   )(resid    33 and  name HD#) 0.0 0.0 9.5
assign (resid    32 and  name HD#   )(resid    33 and  name HE# ) 0.0 0.0 8.5
assign (resid    32 and  name HD#   )(resid    33 and  name HZ ) 0.0 0.0 7.5
! residue  33 PHE
assign (resid    34 and  name HA   )(resid    33 and  name HN  ) 0.0 0.0 6.0
assign (resid    34 and  name HB#   )(resid    33 and  name HN  ) 0.0 0.0 6.5
assign (resid    33 and  name HB1   )(resid    34 and  name HN  ) 0.0 0.0 4.0
assign (resid    33 and  name HB2   )(resid    34 and  name HN  ) 0.0 0.0 4.0
assign (resid    33 and  name HA   )(resid    34 and  name HN  ) 0.0 0.0 4.0
assign (resid    33 and  name HN   )(resid    34 and  name HN  ) 0.0 0.0 3.0
assign (resid    33 and  name HN   )(resid    34 and  name HA  ) 0.0 0.0 6.0
assign (resid    33 and  name HN   )(resid    34 and  name HB#  ) 0.0 0.0 6.0
assign (resid    33 and  name HD#   )(resid    34 and  name HN  ) 0.0 0.0 7.0
assign (resid    33 and  name HE#   )(resid    34 and  name HN  ) 0.0 0.0 8.0
! residue  34 ALA
assign (resid    34 and  name HA   )(resid    35 and  name HN  ) 0.0 0.0 3.0
assign (resid    34 and  name HB#  )(resid    35 and  name HN  ) 0.0 0.0 4.5
assign (resid    34 and  name HA   )(resid    35 and  name HN  ) 0.0 0.0 3.0
assign (resid    34 and  name HN   )(resid    35 and  name HN  ) 0.0 0.0 3.0
! residue  35 ALA
assign (resid    35 and  name HA   )(resid    36 and  name HN  ) 0.0 0.0 4.0
assign (resid    35 and  name HB#   )(resid    36 and  name HN  ) 0.0 0.0 5.5
assign (resid    35 and  name HN   )(resid    36 and  name HN  ) 0.0 0.0 5.0
assign (resid    35 and  name HN   )(resid    36 and  name HB#  ) 0.0 0.0 7.0
! residue  36 SER
assign (resid    36 and  name HB1   )(resid    37 and  name HN  ) 0.0 0.0 5.0
assign (resid    36 and  name HB2   )(resid    37 and  name HN  ) 0.0 0.0 5.0
assign (resid    36 and  name HA   )(resid    37 and  name HN  ) 0.0 0.0 3.0
assign (resid    36 and  name HN   )(resid    37 and  name HN  ) 0.0 0.0 3.0
! residue  37 LYS
assign (resid    37 and  name HA   )(resid    38 and  name HN  ) 0.0 0.0 3.0
assign (resid    37 and  name HN   )(resid    38 and  name HN  ) 0.0 0.0 3.0
assign (resid    37 and  name HN   )(resid    38 and  name HA  ) 0.0 0.0 6.0
assign (resid    37 and  name HB#   )(resid    38 and  name HN  ) 0.0 0.0 4.0
! residue  38 ASN
assign (resid    39 and  name HA   )(resid    38 and  name HN  ) 0.0 0.0 5.0
assign (resid    38 and  name HB1   )(resid    39 and  name HN  ) 0.0 0.0 5.0
assign (resid    38 and  name HB2   )(resid    39 and  name HN  ) 0.0 0.0 5.0
assign (resid    38 and  name HA   )(resid    39 and  name HN  ) 0.0 0.0 3.0
assign (resid    38 and  name HN   )(resid    39 and  name HN  ) 0.0 0.0 3.0
assign (resid    38 and  name HN   )(resid    39 and  name HA  ) 0.0 0.0 6.0
assign (resid    38 and  name HN   )(resid    39 and  name HB  ) 0.0 0.0 6.0
! residue  39 THR
assign (resid    39 and  name HB   )(resid    40 and  name HN  ) 0.0 0.0 3.0
assign (resid    39 and  name HG2#   )(resid    40 and  name HN  ) 0.0 0.0 4.5
assign (resid    39 and  name HA   )(resid    40 and  name HN  ) 0.0 0.0 2.5
assign (resid    39 and  name HN   )(resid    40 and  name HN  ) 0.0 0.0 4.0
! residue  40 THR
assign (resid    40 and  name HA   )(resid    41 and  name HN  ) 0.0 0.0 3.0
assign (resid    40 and  name HB   )(resid    41 and  name HN  ) 0.0 0.0 2.5
assign (resid    40 and  name HN   )(resid    41 and  name HN  ) 0.0 0.0 5.0
assign (resid    40 and  name HG2#   )(resid    41 and  name HN  ) 0.0 0.0 6.5
! residue  41 GLU
assign (resid    41 and  name HB#   )(resid    42 and  name HN  ) 0.0 0.0 3.5
assign (resid    41 and  name HA   )(resid    42 and  name HN  ) 0.0 0.0 4.0
assign (resid    41 and  name HN   )(resid    42 and  name HA  ) 0.0 0.0 6.0
assign (resid    41 and  name HN   )(resid    42 and  name HN  ) 0.0 0.0 5.0
! residue  42 LYS
assign (resid    42 and  name HN   )(resid    43 and  name HN  ) 0.0 0.0 3.0
assign (resid    43 and  name HG#   )(resid    42 and  name HN  ) 0.0 0.0 7.0
! residue  43 GLU
assign (resid    44 and  name HB   )(resid    43 and  name HN  ) 0.0 0.0 5.0
assign (resid    43 and  name HB#   )(resid    44 and  name HN  ) 0.0 0.0 4.0
assign (resid    43 and  name HG#   )(resid    44 and  name HN  ) 0.0 0.0 4.0
Assign (resid    43 and  name HA   )(resid    44 and  name HN  ) 0.0 0.0 4.0
assign (resid    43 and  name HN   )(resid    44 and  name HN  ) 0.0 0.0 3.0
assign (resid    43 and  name HN   )(resid    44 and  name HA  ) 0.0 0.0 6.0
! residue  44 THR
assign (resid    44 and  name HG2#   )(resid    45 and  name HN  ) 0.0 0.0 5.5
assign (resid    44 and  name HB   )(resid    45 and  name HN  ) 0.0 0.0 3.0
assign (resid    44 and  name HA   )(resid    45 and  name HN  ) 0.0 0.0 4.0
assign (resid    44 and  name HN   )(resid    45 and  name HN  ) 0.0 0.0 3.0
assign (resid    44 and  name HN   )(resid    45 and  name HD#  ) 0.0 0.0 8.0
assign (resid    44 and  name HN   )(resid    45 and  name HE#  ) 0.0 0.0 8.0
assign (resid    44 and  name HN   )(resid    45 and  name HA  ) 0.0 0.0 6.0
assign (resid    44 and  name HN   )(resid    45 and  name HB1  ) 0.0 0.0 5.0
assign (resid    44 and  name HN   )(resid    45 and  name HB2  ) 0.0 0.0 5.0
! residue  45 PHE
assign (resid    45 and  name HN   )(resid    46 and  name HN  ) 0.0 0.0 3.0
assign (resid    45 and  name HA   )(resid    46 and  name HN  ) 0.0 0.0 5.0
assign (resid    46 and  name HN   )(resid    45 and  name HD#  ) 0.0 0.0 8.0
assign (resid    46 and  name HN   )(resid    45 and  name HB1  ) 0.0 0.0 4.0
assign (resid    46 and  name HN   )(resid    45 and  name HB2  ) 0.0 0.0 4.0
assign (resid    45 and  name HN   )(resid    46 and  name HA  ) 0.0 0.0 6.0
! residue  46 CYS
assign (resid    46 and  name HB1   )(resid    47 and  name HN  ) 0.0 0.0 4.0
assign (resid    46 and  name HB2   )(resid    47 and  name HN  ) 0.0 0.0 4.0
assign (resid    46 and  name HA   )(resid    47 and  name HN  ) 0.0 0.0 5.0
assign (resid    46 and  name HN   )(resid    47 and  name HN  ) 0.0 0.0 3.0
! residue  47 ARG
assign (resid    47 and  name HA   )(resid    48 and  name HN  ) 0.0 0.0 4.0
assign (resid    47 and  name HN   )(resid    48 and  name HN  ) 0.0 0.0 3.0
! residue  48 ALA
assign (resid    48 and  name HA   )(resid    49 and  name HN  ) 0.0 0.0 5.0
assign (resid    48 and  name HN   )(resid    49 and  name HN  ) 0.0 0.0 3.0
! residue  49 ALA
assign (resid    49 and  name HA   )(resid    50 and  name HN  ) 0.0 0.0 5.0
assign (resid    49 and  name HN   )(resid    50 and  name HN  ) 0.0 0.0 3.0
! residue  50 THR
assign (resid    50 and  name HB   )(resid    51 and  name HN  ) 0.0 0.0 3.0
assign (resid    50 and  name HN   )(resid    51 and  name HN  ) 0.0 0.0 3.0
assign (resid    50 and  name HG2#   )(resid    51 and  name HN  ) 0.0 0.0 5.5
! residue  51 VAL
assign (resid    51 and  name HA   )(resid    52 and  name HN  ) 0.0 0.0 4.0
assign (resid    51 and  name HB   )(resid    52 and  name HN  ) 0.0 0.0 3.0
assign (resid    51 and  name HG1#   )(resid    52 and  name HN  ) 0.0 0.0 5.5
assign (resid    51 and  name HG2#   )(resid    52 and  name HN  ) 0.0 0.0 5.5
assign (resid    51 and  name HN   )(resid    52 and  name HN  ) 0.0 0.0 3.0
! residue  54 GLN
assign (resid    54 and  name HA   )(resid    55 and  name HN  ) 0.0 0.0 4.0
assign (resid    54 and  name HN   )(resid    55 and  name HN  ) 0.0 0.0 3.0
assign (resid    54 and  name HG#   )(resid    55 and  name HN  ) 0.0 0.0 4.0
assign (resid    54 and  name HB#   )(resid    55 and  name HN  ) 0.0 0.0 4.0
! residue  55 PHE
assign (resid    55 and  name HB1   )(resid    56 and  name HN  ) 0.0 0.0 4.0
assign (resid    55 and  name HB2   )(resid    56 and  name HN  ) 0.0 0.0 4.0
assign (resid    56 and  name HD#   )(resid    55 and  name HN  ) 0.0 0.0 8.0
assign (resid    55 and  name HD#   )(resid    56 and  name HN  ) 0.0 0.0 6.0
assign (resid    55 and  name HA   )(resid    56 and  name HN  ) 0.0 0.0 5.0
assign (resid    55 and  name HN   )(resid    56 and  name HN  ) 0.0 0.0 3.0
! residue  56 TYR 
assign (resid    56 and  name HD#   )(resid    57 and  name HN  ) 0.0 0.0 6.0
assign (resid    56 and  name HE#   )(resid    57 and  name HN  ) 0.0 0.0 7.0
assign (resid    56 and  name HB1   )(resid    57 and  name HN  ) 0.0 0.0 5.0
assign (resid    56 and  name HB2   )(resid    57 and  name HN  ) 0.0 0.0 5.0
assign (resid    56 and  name HA   )(resid    57 and  name HN  ) 0.0 0.0 5.0
assign (resid    56 and  name HN   )(resid    57 and  name HN  ) 0.0 0.0 3.0
! residue  57 SER
assign (resid    57 and  name HB1   )(resid    58 and  name HN  ) 0.0 0.0 4.0
assign (resid    57 and  name HB2   )(resid    58 and  name HN  ) 0.0 0.0 4.0
assign (resid    57 and  name HA   )(resid    58 and  name HN  ) 0.0 0.0 5.0
assign (resid    57 and  name HN   )(resid    58 and  name HN  ) 0.0 0.0 3.0
! residue  58 HIS
assign (resid    58 and  name HB1   )(resid    59 and  name HN  ) 0.0 0.0 5.0
assign (resid    58 and  name HB2   )(resid    59 and  name HN  ) 0.0 0.0 5.0
assign (resid    58 and  name HA   )(resid    59 and  name HN  ) 0.0 0.0 5.0
assign (resid    58 and  name HN   )(resid    59 and  name HN  ) 0.0 0.0 3.0
! residue  59 HIS
assign (resid    59 and  name HB#   )(resid    60 and  name HN  ) 0.0 0.0 6.0
assign (resid    59 and  name HA   )(resid    60 and  name HN  ) 0.0 0.0 5.0
assign (resid    59 and  name HN   )(resid    60 and  name HN  ) 0.0 0.0 3.0
! residue  60 GLU
assign (resid    60 and  name HN   )(resid    61 and  name HN  ) 0.0 0.0 5.0
assign (resid    60 and  name HA   )(resid    61 and  name HN  ) 0.0 0.0 3.0
! residue  61 LYS
assign (resid    61 and  name HA   )(resid    62 and  name HN  ) 0.0 0.0 4.0
assign (resid    61 and  name HN   )(resid    62 and  name HN  ) 0.0 0.0 6.0
! residue  62 ASP
assign (resid    62 and  name HB1   )(resid    63 and  name HN  ) 0.0 0.0 5.0
assign (resid    62 and  name HB2   )(resid    63 and  name HN  ) 0.0 0.0 5.0
assign (resid    62 and  name HA   )(resid    63 and  name HN  ) 0.0 0.0 3.0
assign (resid    62 and  name HN   )(resid    63 and  name HN  ) 0.0 0.0 6.0
! residue  63 THR
assign (resid    63 and  name HB   )(resid    64 and  name HN  ) 0.0 0.0 5.0
assign (resid    63 and  name HG2#   )(resid    64 and  name HN  ) 0.0 0.0 6.5
assign (resid    63 and  name HA   )(resid    64 and  name HN  ) 0.0 0.0 5.0
assign (resid    63 and  name HN   )(resid    64 and  name HN  ) 0.0 0.0 4.0
! residue  64 ARG
assign (resid    64 and  name HA   )(resid    65 and  name HN  ) 0.0 0.0 5.0
assign (resid    64 and  name HN   )(resid    65 and  name HN  ) 0.0 0.0 3.0
! residue  65 CYS
assign (resid    65 and  name HN   )(resid    66 and  name HN  ) 0.0 0.0 3.0
assign (resid    65 and  name HB1   )(resid    66 and  name HN  ) 0.0 0.0 5.0
assign (resid    65 and  name HB2   )(resid    66 and  name HN  ) 0.0 0.0 5.0
assign (resid    65 and  name HA   )(resid    66 and  name HN  ) 0.0 0.0 4.0
! residue  66 LEU
assign (resid    66 and  name HN   )(resid    67 and  name HN  ) 0.0 0.0 3.0 
assign (resid    66 and  name HD##   )(resid    67 and  name HN  ) 0.0 0.0 7.9
assign (resid    66 and  name HB#   )(resid    67 and  name HN  ) 0.0 0.0 7.9
! residue  67 GLY
assign (resid    67 and  name HA1   )(resid    68 and  name HN  ) 0.0 0.0 3.0
assign (resid    67 and  name HA2   )(resid    68 and  name HN  ) 0.0 0.0 3.0
assign (resid    67 and  name HN   )(resid    68 and  name HN  ) 0.0 0.0 3.0
!residue  68 ALA
assign (resid    68 and  name HA   )(resid    69 and  name HN  ) 0.0 0.0 5.0
assign (resid    68 and  name HN   )(resid    69 and  name HN  ) 0.0 0.0 3.0
assign (resid    69 and  name HG2#   )(resid    68 and  name HN  ) 0.0 0.0 6.5
assign (resid    68 and  name HB#   )(resid    69 and  name HN  ) 0.0 0.0 5.5
! residue  69 THR
assign (resid    69 and  name HA   )(resid    70 and  name HN  ) 0.0 0.0 4.0
assign (resid    69 and  name HG2#   )(resid    70 and  name HN  ) 0.0 0.0 6.5
! residue  70 ALA
assign (resid    70 and  name HB#   )(resid    71 and  name HN  ) 0.0 0.0 4.5
assign (resid    70 and  name HA   )(resid    71 and  name HN  ) 0.0 0.0 5.0
assign (resid    70 and  name HN   )(resid    71 and  name HN  ) 0.0 0.0 6.0
! residue  71 GLN
assign (resid    71 and  name HB#   )(resid    72 and  name HN  ) 0.0 0.0 5.0
assign (resid    71 and  name HA   )(resid    72 and  name HN  ) 0.0 0.0 5.0
assign (resid    71 and  name HN   )(resid    72 and  name HN  ) 0.0 0.0 3.0
assign (resid    72 and  name HG#   )(resid    71 and  name HN  ) 0.0 0.0 7.0
! residue  72 GLN
assign (resid    72 and  name HG#   )(resid    73 and  name HN  ) 0.0 0.0 4.0
assign (resid    73 and  name HA   )(resid    72 and  name HN  ) 0.0 0.0 6.0
assign (resid    73 and  name HB#   )(resid    72 and  name HN  ) 0.0 0.0 6.0
assign (resid    72 and  name HN   )(resid    73 and  name HN  ) 0.0 0.0 3.0
! residue  73 PHE
assign (resid    73 and  name HB1   )(resid    74 and  name HN  ) 0.0 0.0 5.0
assign (resid    73 and  name HB2   )(resid    74 and  name HN  ) 0.0 0.0 5.0
assign (resid    73 and  name HD#   )(resid    74 and  name HN  ) 0.0 0.0 7.0
assign (resid    73 and  name HA   )(resid    74 and  name HN  ) 0.0 0.0 4.0
assign (resid    73 and  name HN   )(resid    74 and  name HN  ) 0.0 0.0 4.0
! residue  74 HIS
assign (resid    74 and  name HB1   )(resid    75 and  name HN  ) 0.0 0.0 5.0
assign (resid    74 and  name HB2   )(resid    75 and  name HN  ) 0.0 0.0 5.0
assign (resid    74 and  name HA   )(resid    75 and  name HN  ) 0.0 0.0 4.0
assign (resid    74 and  name HN   )(resid    75 and  name HN  ) 0.0 0.0 4.0
! residue  75 ARG
assign (resid    75 and  name HA   )(resid    76 and  name HN  ) 0.0 0.0 4.0
assign (resid    75 and  name HN   )(resid    76 and  name HN  ) 0.0 0.0 3.0
! residue  76 HIS
assign (resid    76 and  name HB#   )(resid    77 and  name HN  ) 0.0 0.0 4.0
assign (resid    76 and  name HD1   )(resid    77 and  name HN  ) 0.0 0.0 5.0
assign (resid    76 and  name HA   )(resid    77 and  name HN  ) 0.0 0.0 5.0
assign (resid    76 and  name HN   )(resid    77 and  name HN  ) 0.0 0.0 3.0
! residue  77 LYS
assign (resid    77 and  name HA   )(resid    78 and  name HN  ) 0.0 0.0 5.0
assign (resid    77 and  name HN   )(resid    78 and  name HN  ) 0.0 0.0 3.0
! residue  78 GLN
assign (resid    78 and  name HA   )(resid    79 and  name HN  ) 0.0 0.0 4.0
assign (resid    79 and  name HB#   )(resid    78 and  name HN  ) 0.0 0.0 6.0  
assign (resid    78 and  name HN   )(resid    79 and  name HN  ) 0.0 0.0 3.0
! residue  79 LEU
assign (resid    79 and  name HB1   )(resid    80 and  name HN  ) 0.0 0.0 4.0
assign (resid    79 and  name HB2   )(resid    80 and  name HN  ) 0.0 0.0 4.0
assign (resid    79 and  name HD##   )(resid    80 and  name HN  ) 0.0 0.0 7.9
assign (resid    79 and  name HA   )(resid    80 and  name HN  ) 0.0 0.0 5.0
assign (resid    79 and  name HN   )(resid    80 and  name HN  ) 0.0 0.0 3.0
assign (resid    80 and  name HG2#   )(resid    79 and  name HN  ) 0.0 0.0 7.5
assign (resid    80 and  name HD1#   )(resid    79 and  name HN  ) 0.0 0.0 7.5
! residue  80 ILE
assign (resid    80 and  name HB   )(resid    81 and  name HN  ) 0.0 0.0 4.0
assign (resid    80 and  name HG1#   )(resid    81 and  name HN  ) 0.0 0.0 5.0
assign (resid    80 and  name HG2#  )(resid    81 and  name HN  ) 0.0 0.0 5.5
assign (resid    80 and  name HA   )(resid    81 and  name HN  ) 0.0 0.0 5.0
assign (resid    80 and  name HN   )(resid    81 and  name HN  ) 0.0 0.0 3.0
! residue  81 ARG
assign (resid    82 and  name HD#   )(resid    81 and  name HN  ) 0.0 0.0 8.0
assign (resid    82 and  name HB#   )(resid    81 and  name HN  ) 0.0 0.0 6.0
assign (resid    81 and  name HA   )(resid    82 and  name HN  ) 0.0 0.0 4.0
assign (resid    81 and  name HN   )(resid    82 and  name HN  ) 0.0 0.0 3.0
! residue  82 PHE
assign (resid    82 and  name HD#   )(resid    83 and  name HN  ) 0.0 0.0 8.0
assign (resid    82 and  name HB1   )(resid    83 and  name HN  ) 0.0 0.0 4.0
assign (resid    82 and  name HB2   )(resid    83 and  name HN  ) 0.0 0.0 4.0
assign (resid    82 and  name HA   )(resid    83 and  name HN  ) 0.0 0.0 5.0
assign (resid    82 and  name HN   )(resid    83 and  name HN  ) 0.0 0.0 3.0
! residue  83 LEU
assign (resid    83 and  name HB#   )(resid    84 and  name HN  ) 0.0 0.0 5.0
assign (resid    83 and  name HD1#   )(resid    84 and  name HN  ) 0.0 0.0 6.5
assign (resid    83 and  name HD2#   )(resid    84 and  name HN  ) 0.0 0.0 6.5
assign (resid    83 and  name HA   )(resid    84 and  name HN  ) 0.0 0.0 5.0
assign (resid    83 and  name HN   )(resid    84 and  name HN  ) 0.0 0.0 3.0
! residue  84 LYS
assign (resid    85 and  name HA   )(resid    84 and  name HN  ) 0.0 0.0 6.0
assign (resid    84 and  name HA   )(resid    85 and  name HN  ) 0.0 0.0 4.0
assign (resid    84 and  name HN   )(resid    85 and  name HN  ) 0.0 0.0 3.0
! residue  85 ARG
assign (resid    85 and  name HA   )(resid    86 and  name HN  ) 0.0 0.0 5.0
assign (resid    85 and  name HN   )(resid    86 and  name HN  ) 0.0 0.0 3.0
! residue  86 LEU
assign (resid    86 and  name HB#   )(resid    87 and  name HN  ) 0.0 0.0 5.0
assign (resid    86 and  name HG   )(resid    87 and  name HN  ) 0.0 0.0 4.0
assign (resid    86 and  name HD1#  )(resid    87 and  name HN  ) 0.0 0.0 6.5
assign (resid    86 and  name HD2#   )(resid    87 and  name HN  ) 0.0 0.0 6.5
assign (resid    86 and  name HA   )(resid    87 and  name HN  ) 0.0 0.0 4.0
assign (resid    86 and  name HN   )(resid    87 and  name HN  ) 0.0 0.0 4.0
! residue  87 ASP
assign (resid    87 and  name HB1   )(resid    88 and  name HN  ) 0.0 0.0 4.0
assign (resid    87 and  name HB2   )(resid    88 and  name HN  ) 0.0 0.0 4.0
assign (resid    87 and  name HA   )(resid    88 and  name HN  ) 0.0 0.0 5.0
assign (resid    87 and  name HN   )(resid    88 and  name HN  ) 0.0 0.0 4.0
! residue  88 ARG
assign (resid    88 and  name HA   )(resid    89 and  name HN  ) 0.0 0.0 4.0
assign (resid    88 and  name HA   )(resid    89 and  name HD#  ) 0.0 0.0 6.0
assign (resid    88 and  name HN   )(resid    89 and  name HN  ) 0.0 0.0 3.0
! residue  89 ASN
assign (resid    89 and  name HD21  )(resid    90 and  name HN  ) 0.0 0.0 6.0
assign (resid    89 and  name HD22   )(resid    90 and  name HN  ) 0.0 0.0 6.0
assign (resid    89 and  name HB1   )(resid    90 and  name HN  ) 0.0 0.0 5.0
assign (resid    89 and  name HB2   )(resid    90 and  name HN  ) 0.0 0.0 5.0
assign (resid    89 and  name HA   )(resid    90 and  name HN  ) 0.0 0.0 5.0
assign (resid    89 and  name HN   )(resid    90 and  name HN  ) 0.0 0.0 3.0
! residue  90 LEU
assign (resid    90 and  name HA   )(resid    91 and  name HN  ) 0.0 0.0 6.0
assign (resid    90 and  name HN   )(resid    91 and  name HN  ) 0.0 0.0 4.0
assign (resid    91 and  name HE3   )(resid    90 and  name HD##  ) 0.0 0.0 8.9
! residue  91 TRP
assign (resid    91 and  name HE3   )(resid    92 and  name HN  ) 0.0 0.0 6.0
assign (resid    91 and  name HB#   )(resid    92 and  name HN  ) 0.0 0.0 5.0
assign (resid    91 and  name HA   )(resid    92 and  name HN  ) 0.0 0.0 5.0
assign (resid    91 and  name HN   )(resid    92 and  name HN  ) 0.0 0.0 5.0
! residue  92 GLY
assign (resid    92 and  name HA1   )(resid    93 and  name HN  ) 0.0 0.0 4.0
assign (resid    92 and  name HA2   )(resid    93 and  name HN  ) 0.0 0.0 4.0
assign (resid    92 and  name HN   )(resid    93 and  name HN  ) 0.0 0.0 4.0
assign (resid    93 and  name HD##   )(resid    92 and  name HN  ) 0.0 0.0 8.9
! residue  93 LEU
assign (resid    93 and  name HA   )(resid    94 and  name HN  ) 0.0 0.0 4.0
assign (resid    93 and  name HN   )(resid    94 and  name HN  ) 0.0 0.0 4.0
! residue  94 ALA
assign (resid    94 and  name HB#   )(resid    95 and  name HN  ) 0.0 0.0 5.5
assign (resid    94 and  name HA   )(resid    95 and  name HN  ) 0.0 0.0 5.0
assign (resid    94 and  name HN   )(resid    95 and  name HN  ) 0.0 0.0 4.0
! residue  95 GLY
assign (resid    95 and  name HA1   )(resid    96 and  name HN  ) 0.0 0.0 5.0
assign (resid    95 and  name HA2   )(resid    96 and  name HN  ) 0.0 0.0 5.0
assign (resid    95 and  name HN   )(resid    96 and  name HN  ) 0.0 0.0 4.0
assign (resid    96 and  name HB#   )(resid    95 and  name HN  ) 0.0 0.0 7.0 
assign (resid    96 and  name HD##   )(resid    95 and  name HN  ) 0.0 0.0 8.9
! residue  96 LEU
assign (resid    96 and  name HB#   )(resid    97 and  name HN  ) 0.0 0.0 6.0
assign (resid    96 and  name HD##   )(resid    97 and  name HN  ) 0.0 0.0 7.9
assign (resid    96 and  name HA   )(resid    97 and  name HN  ) 0.0 0.0 4.0
assign (resid    96 and  name HN   )(resid    97 and  name HN  ) 0.0 0.0 6.0
! residue  97 ASN
assign (resid    97 and  name HB#   )(resid    98 and  name HN  ) 0.0 0.0 6.0
assign (resid    97 and  name HA   )(resid    98 and  name HN  ) 0.0 0.0 5.0
assign (resid    97 and  name HN   )(resid    98 and  name HN  ) 0.0 0.0 5.0
! residue  98 SER
assign (resid    98 and  name HB#   )(resid    99 and  name HN  ) 0.0 0.0 6.0
assign (resid    98 and  name HA   )(resid    99 and  name HN  ) 0.0 0.0 3.0
assign (resid    98 and  name HN   )(resid    99 and  name HN  ) 0.0 0.0 6.0
! residue  99 CYS
assign (resid    99 and  name HA   )(resid    100 and  name HD#  ) 0.0 0.0 5.0
assign (resid    100 and  name HD1   )(resid    99 and  name HN  ) 0.0 0.0 5.0
assign (resid    100 and  name HD2   )(resid    99 and  name HN  ) 0.0 0.0 5.0
! residue  100 PRO
assign (resid    100 and  name HA   )(resid    101 and  name HN  ) 0.0 0.0 2.5
! residue  101 VAL
assign (resid    101 and  name HB   )(resid    102 and  name HN  ) 0.0 0.0 5.0
assign (resid    101 and  name HG1#   )(resid    102 and  name HN  ) 0.0 0.0 6.5
assign (resid    101 and  name HG2#   )(resid    102 and  name HN  ) 0.0 0.0 6.5
assign (resid    101 and  name HA   )(resid    102 and  name HN  ) 0.0 0.0 3.0
assign (resid    101 and  name HN   )(resid    102 and  name HN  ) 0.0 0.0 5.0
! residue  102 LYS
assign (resid    102 and  name HB#   )(resid    103 and  name HN  ) 0.0 0.0 6.0
assign (resid    103 and  name HG#   )(resid    102 and  name HN  ) 0.0 0.0 7.0
assign (resid    102 and  name HA   )(resid    103 and  name HN  ) 0.0 0.0 2.5
assign (resid    102 and  name HN   )(resid    103 and  name HN  ) 0.0 0.0 5.0
! residue  103 GLU
assign (resid    103 and  name HB#   )(resid    104 and  name HN  ) 0.0 0.0 6.0
assign (resid    103 and  name HG#   )(resid    104 and  name HN  ) 0.0 0.0 7.0
assign (resid    103 and  name HA   )(resid    104 and  name HN  ) 0.0 0.0 2.5
assign (resid    103 and  name HN   )(resid    104 and  name HN  ) 0.0 0.0 6.0
! residue  104 ALA
assign (resid    104 and  name HB#   )(resid    105 and  name HN  ) 0.0 0.0 4.0
assign (resid    104 and  name HB#   )(resid    105 and  name HD21  ) 0.0 0.0 6.5
assign (resid    104 and  name HB#   )(resid    105 and  name HD22  ) 0.0 0.0 6.5
assign (resid    104 and  name HA   )(resid    105 and  name HN  ) 0.0 0.0 4.0
assign (resid    104 and  name HN   )(resid    105 and  name HN  ) 0.0 0.0 4.0
! residue  105 ASN
assign (resid    106 and  name HG#   )(resid    105 and  name HN  ) 0.0 0.0 7.0
assign (resid    106 and  name HE#   )(resid    105 and  name HN  ) 0.0 0.0 7.0
assign (resid    105 and  name HB#   )(resid    106 and  name HN  ) 0.0 0.0 7.0
assign (resid    105 and  name HA   )(resid    106 and  name HN  ) 0.0 0.0 4.0
assign (resid    105 and  name HN   )(resid    106 and  name HN  ) 0.0 0.0 6.0
! residue  106 GLN
assign (resid    106 and  name HB#   )(resid    107 and  name HN  ) 0.0 0.0 6.5
assign (resid    106 and  name HG#   )(resid    107 and  name HN  ) 0.0 0.0 7.0
assign (resid    106 and  name HA   )(resid    107 and  name HN  ) 0.0 0.0 4.0
assign (resid    106 and  name HN   )(resid    107 and  name HN  ) 0.0 0.0 6.0
! residue  107 SER
assign (resid    107 and  name HB1   )(resid    108 and  name HN  ) 0.0 0.0 5.0
assign (resid    107 and  name HB2   )(resid    108 and  name HN  ) 0.0 0.0 5.0
assign (resid    107 and  name HA   )(resid    108 and  name HN  ) 0.0 0.0 2.5
assign (resid    107 and  name HN   )(resid    108 and  name HN  ) 0.0 0.0 6.0
! residue  108 THR
assign (resid    108 and  name HG2#   )(resid    109 and  name HN  ) 0.0 0.0 6.5
assign (resid    108 and  name HA   )(resid    109 and  name HN  ) 0.0 0.0 2.5
assign (resid    108 and  name HB   )(resid    109 and  name HN  ) 0.0 0.0 4.0
! residue  109 LEU
assign (resid    109 and  name HB1   )(resid    110 and  name HN  ) 0.0 0.0 5.0
assign (resid    109 and  name HB2   )(resid    110 and  name HN  ) 0.0 0.0 5.0
assign (resid    109 and  name HG   )(resid    110 and  name HN  ) 0.0 0.0 5.0
assign (resid    109 and  name HD1#   )(resid    110 and  name HN  ) 0.0 0.0 7.5
assign (resid    109 and  name HD2#   )(resid    110 and  name HN  ) 0.0 0.0 7.5
assign (resid    109 and  name HN   )(resid    110 and  name HN  ) 0.0 0.0 4.0
! residue  110 GLU
assign (resid    110 and  name HB1   )(resid    111 and  name HN  ) 0.0 0.0 5.0
assign (resid    110 and  name HB2   )(resid    111 and  name HN  ) 0.0 0.0 5.0
assign (resid    110 and  name HG#   )(resid    111 and  name HN  ) 0.0 0.0 6.0
assign (resid    111 and  name HB1   )(resid    110 and  name HN  ) 0.0 0.0 6.0
assign (resid    111 and  name HB2   )(resid    110 and  name HN  ) 0.0 0.0 6.0
assign (resid    110 and  name HA   )(resid    111 and  name HN  ) 0.0 0.0 5.0
assign (resid    110 and  name HN   )(resid    111 and  name HN  ) 0.0 0.0 4.0
! residue  111 ASN
assign (resid    111 and  name HB1   )(resid    112 and  name HN  ) 0.0 0.0 5.0
assign (resid    111 and  name HB2   )(resid    112 and  name HN  ) 0.0 0.0 5.0
assign (resid    112 and  name HD#   )(resid    111 and  name HN  ) 0.0 0.0 8.0
assign (resid    112 and  name HB1   )(resid    111 and  name HN  ) 0.0 0.0 6.0
assign (resid    112 and  name HB2   )(resid    111 and  name HN  ) 0.0 0.0 6.0
assign (resid    111 and  name HN   )(resid    112 and  name HN  ) 0.0 0.0 3.0
! residue  112 PHE
assign (resid    112 and  name HB1   )(resid    113 and  name HN  ) 0.0 0.0 5.0
assign (resid    112 and  name HB2   )(resid    113 and  name HN  ) 0.0 0.0 5.0
assign (resid    112 and  name HD#   )(resid    113 and  name HN  ) 0.0 0.0 7.0
assign (resid    112 and  name HA   )(resid    113 and  name HN  ) 0.0 0.0 5.0
assign (resid    112 and  name HN   )(resid    113 and  name HN  ) 0.0 0.0 4.0
! residue  113 LEU
assign (resid    113 and  name HA   )(resid    114 and  name HN  ) 0.0 0.0 5.0
assign (resid    113 and  name HN   )(resid    114 and  name HN  ) 0.0 0.0 4.0
assign (resid    114 and  name HG#   )(resid    113 and  name HN  ) 0.0 0.0 7.0
! residue  114 GLU
assign (resid    114 and  name HG#   )(resid    115 and  name HN  ) 0.0 0.0 6.0
assign (resid    114 and  name HA   )(resid    115 and  name HN  ) 0.0 0.0 5.0
assign (resid    114 and  name HN   )(resid    115 and  name HN  ) 0.0 0.0 3.0
assign (resid    114 and  name HN   )(resid    115 and  name HE#  ) 0.0 0.0 7.0
! residue  115 ARG
assign (resid    115 and  name HA   )(resid    116 and  name HN  ) 0.0 0.0 5.0
assign (resid    115 and  name HN   )(resid    116 and  name HN  ) 0.0 0.0 3.0
assign (resid    116 and  name HN   )(resid    115 and  name HE#  ) 0.0 0.0 7.0
! residue  116 LEU
assign (resid    117 and  name HA   )(resid    116 and  name HN  ) 0.0 0.0 6.0
assign (resid    116 and  name HA   )(resid    117 and  name HN  ) 0.0 0.0 5.0
assign (resid    116 and  name HN   )(resid    117 and  name HN  ) 0.0 0.0 3.0
! residue  117 LYS
assign (resid    117 and  name HA   )(resid    118 and  name HN  ) 0.0 0.0 5.0
assign (resid    117 and  name HN   )(resid    118 and  name HN  ) 0.0 0.0 3.0
! residue  118 THR
assign (resid    118 and  name HB   )(resid    119 and  name HN  ) 0.0 0.0 5.0
assign (resid    118 and  name HG2#   )(resid    119 and  name HN  ) 0.0 0.0 7.5
assign (resid    118 and  name HN   )(resid    119 and  name HN  ) 0.0 0.0 3.0
! residue  119 ILE
assign (resid    119 and  name HB   )(resid    120 and  name HN  ) 0.0 0.0 4.0
assign (resid    119 and  name HG11   )(resid    120 and  name HN  ) 0.0 0.0 6.0 
assign (resid    119 and  name HG12   )(resid    120 and  name HN  ) 0.0 0.0 6.0
assign (resid    119 and  name HG2#   )(resid    120 and  name HN  ) 0.0 0.0 5.5
assign (resid    119 and  name HD1#   )(resid    120 and  name HN  ) 0.0 0.0 6.5
assign (resid    120 and  name HA   )(resid    119 and  name HN  ) 0.0 0.0 6.0
assign (resid    120 and  name HG#   )(resid    119 and  name HN  ) 0.0 0.0 7.0
assign (resid    119 and  name HA   )(resid    120 and  name HN  ) 0.0 0.0 5.0
assign (resid    119 and  name HN   )(resid    120 and  name HN  ) 0.0 0.0 4.0
! residue  120 MET
assign (resid    120 and  name HB1   )(resid    121 and  name HN  ) 0.0 0.0 6.0
assign (resid    120 and  name HB2   )(resid    121 and  name HN  ) 0.0 0.0 6.0
assign (resid    120 and  name HG1   )(resid    121 and  name HN  ) 0.0 0.0 6.0
assign (resid    120 and  name HG2   )(resid    121 and  name HN  ) 0.0 0.0 6.0
assign (resid    121 and  name HA   )(resid    120 and  name HN  ) 0.0 0.0 6.0
assign (resid    120 and  name HA   )(resid    121 and  name HN  ) 0.0 0.0 5.0
assign (resid    120 and  name HN   )(resid    121 and  name HN  ) 0.0 0.0 4.0
! residue  121 ARG
assign (resid    121 and  name HA   )(resid    122 and  name HN  ) 0.0 0.0 5.0
assign (resid    121 and  name HN   )(resid    122 and  name HN  ) 0.0 0.0 3.0
! residue  122 GLU
assign (resid    122 and  name HN   )(resid    123 and  name HN  ) 0.0 0.0 3.0
! residue  123 LYS
assign (resid    124 and  name HA   )(resid    123 and  name HN  ) 0.0 0.0 6.0
assign (resid    124 and  name HB1   )(resid    123 and  name HN  ) 0.0 0.0 6.0
assign (resid    124 and  name HB2   )(resid    123 and  name HN  ) 0.0 0.0 6.0
assign (resid    123 and  name HA   )(resid    124 and  name HN  ) 0.0 0.0 5.0
assign (resid    123 and  name HN   )(resid    124 and  name HN  ) 0.0 0.0 4.0
! residue  124 TYR
assign (resid    124 and  name HD#   )(resid    125 and  name HN  ) 0.0 0.0 8.0
assign (resid    124 and  name HB#   )(resid    125 and  name HN  ) 0.0 0.0 6.0
assign (resid    124 and  name HA   )(resid    125 and  name HN  ) 0.0 0.0 5.0
assign (resid    124 and  name HN   )(resid    125 and  name HN  ) 0.0 0.0 4.0
! residue  125 SER
assign (resid    125 and  name HB#   )(resid    126 and  name HN  ) 0.0 0.0 6.0
assign (resid    125 and  name HA   )(resid    126 and  name HN  ) 0.0 0.0 5.0
assign (resid    125 and  name HN   )(resid    126 and  name HN  ) 0.0 0.0 4.0
! residue  126 LYS
assign (resid    126 and  name HA   )(resid    127 and  name HN  ) 0.0 0.0 5.0
assign (resid    126 and  name HN   )(resid    127 and  name HN  ) 0.0 0.0 4.0
! residue  127 CYS
assign (resid    127 and  name HB#  )(resid    128 and  name HN  ) 0.0 0.0 6.0
assign (resid    127 and  name HA   )(resid    128 and  name HN  ) 0.0 0.0 4.0
assign (resid    127 and  name HN   )(resid    128 and  name HN  ) 0.0 0.0 4.0
! residue  128 SER
assign (resid    128 and  name HA   )(resid    129 and  name HN  ) 0.0 0.0 4.0
assign (resid    128 and  name HN   )(resid    129 and  name HN  ) 0.0 0.0 5.0
!
! NOE effects between i,i+1
! from 1H-13C spectra
!
! residue  4 ASP
assign (resid    4 and  name HA   )(resid    5 and  name HG2#  ) 0.0 0.0 6.5
! residue  5 ILE 
assign (resid   5  and  name HG2#   )(resid    6 and  name HA  ) 0.0 0.0 6.5
! residue  10 ILE
assign (resid   10  and  name HG2#   )(resid    11 and  name HA ) 0.0 0.0 4.5
! residue  11 ILE
assign (resid   11  and  name HG2#   )(resid    12 and  name HA  ) 0.0 0.0 4.5
! residue  27 LEU
assign (resid   27  and  name HA   )(resid   28  and  name HG2#  ) 0.0 0.0 6.5
! residue  28 THR
assign (resid   28  and  name HG2#   )(resid   29  and  name HG##  ) 0.0 0.0 9.4
assign (resid   28  and  name HB   )(resid   29  and  name HG##  ) 0.0 0.0 7.9
! residue  32 ILE
assign (resid   32  and  name HD1#   )(resid    33 and  name HA  ) 0.0 0.0 4.5
assign (resid   32  and  name HD1#   )(resid    33 and  name HB#  ) 0.0 0.0 5.5
! residue  34 ALA
assign (resid   34  and  name HB#   )(resid   35  and  name HA  ) 0.0 0.0 6.5
assign (resid   34  and  name HA   )(resid   35  and  name HB#  ) 0.0 0.0 6.5
! residue  39 THR
assign (resid   39  and  name HA   )(resid   40  and  name HG2#  ) 0.0 0.0 4.5
assign (resid   39  and  name HG2#   )(resid   40  and  name HA  ) 0.0 0.0 6.5
! residue  56 TYR
assign (resid  56  and  name HD#   )(resid    57 and  name HA  ) 0.0 0.0 7.0
! residue  44 THR
assign (resid   45  and  name HD#   )(resid    44 and  name HG2#  ) 0.0 0.0 8.5
! residue  62 ASP
assign (resid   62  and  name HA   )(resid    63 and  name HG2#  ) 0.0 0.0 6.5
! residue  67 GLY
assign (resid   67  and  name HA1   )(resid   68  and  name HB#  ) 0.0 0.0 6.5
assign (resid   67  and  name HA2   )(resid   68  and  name HB#  ) 0.0 0.0 6.5
! residue  68 ALA
assign (resid   68  and  name HB#   )(resid   69  and  name HG2#  ) 0.0 0.0 6.0
! residue  93 LEU
assign (resid   94  and  name HB#   )(resid    93 and  name HD##  ) 0.0 0.0 9.4
! residue  99 CYS
assign (resid   99  and  name HA   )(resid   100  and  name HD1  ) 0.0 0.0 5.0
assign (resid   99  and  name HA   )(resid   100  and  name HD2  ) 0.0 0.0 5.0
! residue  100 PRO
assign (resid   100  and  name HA   )(resid   101  and  name HG1#  ) 0.0 0.0 6.5
assign (resid   100  and  name HA   )(resid   101  and  name HG2#  ) 0.0 0.0 6.5
! residue  101 VAL
assign (resid   101  and  name HG##   )(resid    102 and  name HA  ) 0.0 0.0 6.5
! residue  102 LYS
! residue  103 GLU
assign (resid   103  and  name HA   )(resid   104  and  name HB#  ) 0.0 0.0 6.5
! residue  104 ALA
! residue  105 ASN
assign (resid   105  and  name HA   )(resid   106  and  name HG#  ) 0.0 0.0 6.0
! residue  106 GLN
assign (resid   106  and  name HG#   )(resid    107 and  name HA  ) 0.0 0.0 6.0
assign (resid   106  and  name HB#   )(resid    107 and  name HA  ) 0.0 0.0 6.0
! residue  107 SER
assign (resid   107  and  name HA   )(resid    108 and  name HG2#  ) 0.0 0.0 6.5
! residue  119 ILE
assign (resid    119 and  name HG2#   )(resid    120 and  name HA  ) 0.0 0.0 4.5
assign (resid    119 and  name HG2#   )(resid    120 and  name HB#  ) 0.0 0.0 5.5
assign (resid    119 and  name HG2#   )(resid    120 and  name HE#  ) 0.0 0.0 6.0
!
! NOE effects between i and i+2,i+3,i+4
! from 1H-1H and 1H-15N spectra
!
! residue  4 ASP
assign (resid    4 and  name HN   )(resid    6 and  name HN  ) 0.0 0.0 6.0
assign (resid    4 and  name HA   )(resid    7 and  name HN  ) 0.0 0.0 6.0
assign (resid    4 and  name HA   )(resid    8 and  name HN  ) 0.0 0.0 6.0
assign (resid    4 and  name HA   )(resid    6 and  name HN  ) 0.0 0.0 5.0
assign (resid    4 and  name HN   )(resid    7 and  name HD## ) 0.0 0.0 7.9 
assign (resid    6 and  name HN   )(resid    4 and  name HB1  ) 0.0 0.0 5.0
assign (resid    6 and  name HN   )(resid    4 and  name HB2  ) 0.0 0.0 5.0
assign (resid    7 and  name HN   )(resid    4 and  name HB1  ) 0.0 0.0 5.0
assign (resid    7 and  name HN   )(resid    4 and  name HB2  ) 0.0 0.0 5.0
! residue  5 ILE 
assign (resid    5 and  name HA   )(resid    8 and  name HN  ) 0.0 0.0 4.0
assign (resid    5 and  name HN   )(resid    7 and  name HN  ) 0.0 0.0 6.0
assign (resid    5 and  name HN   )(resid    8 and  name HB#  ) 0.0 0.0 6.0
! residue  6 THR
assign (resid    6 and  name HN   )(resid    8 and  name HN  ) 0.0 0.0 5.0
assign (resid    6 and  name HN   )(resid    9 and  name HN  ) 0.0 0.0 6.0
assign (resid    6 and  name HN   )(resid    6 and  name HA  ) 0.0 0.0 3.0
assign (resid    10 and  name HN   )(resid    6 and  name HA  ) 0.0 0.0 5.0
assign (resid    10 and  name HN   )(resid    6 and  name HG2#  ) 0.0 0.0 6.5
! residue  7 LEU
assign (resid    7 and  name HA   )(resid    10 and  name HN  ) 0.0 0.0 4.0
assign (resid    7 and  name HA   )(resid    11 and  name HN  ) 0.0 0.0 5.0
assign (resid    7 and  name HN   )(resid    11 and  name HD1#  ) 0.0 0.0 7.5
assign (resid    7 and  name HN   )(resid    9 and  name HN  ) 0.0 0.0 5.0
! residue  8 GLN
assign (resid    8 and  name HA   )(resid    11 and  name HN  ) 0.0 0.0 4.0
assign (resid    8 and  name HA   )(resid    12 and  name HN  ) 0.0 0.0 5.0
assign (resid    8 and  name HN   )(resid    10 and  name HN  ) 0.0 0.0 5.0
assign (resid    8 and  name HN   )(resid    11 and  name HD#  ) 0.0 0.0 6.5
assign (resid    10 and  name HN   )(resid    8 and  name HA  ) 0.0 0.0 5.0
! residue  9 GLU
assign (resid    9 and  name HA   )(resid    11 and  name HN  ) 0.0 0.0 5.0
assign (resid    9 and  name HA   )(resid    12 and  name HN  ) 0.0 0.0 4.0
assign (resid    11 and  name HN   )(resid    9 and  name HB# ) 0.0 0.0 6.0
! residue  10 ILE
assign (resid    10 and  name HA   )(resid    12 and  name HN  ) 0.0 0.0 5.0
assign (resid    10 and  name HA   )(resid    13 and  name HN  ) 0.0 0.0 4.0
assign (resid    10 and  name HA   )(resid    14 and  name HN  ) 0.0 0.0 5.0
! residue  11 ILE
assign (resid    11 and  name HA   )(resid    13 and  name HN  ) 0.0 0.0 5.0
assign (resid    11 and  name HA   )(resid    14 and  name HN  ) 0.0 0.0 4.0
assign (resid    11 and  name HA   )(resid    15 and  name HN  ) 0.0 0.0 5.0
assign (resid    14 and  name HN   )(resid    11 and  name HD1#  ) 0.0 0.0 7.5
! residue  12 LYS
assign (resid    12 and  name HA   )(resid    15 and  name HN  ) 0.0 0.0 4.0
assign (resid    12 and  name HA   )(resid    16 and  name HN  ) 0.0 0.0 5.0
assign (resid    12 and  name HN   )(resid    14 and  name HN  ) 0.0 0.0 5.0
assign (resid    12 and  name HN   )(resid    15 and  name HB#  ) 0.0 0.0 6.0
! residue  13 THR
assign (resid    13 and  name HA   )(resid    15 and  name HN  ) 0.0 0.0 5.0
assign (resid    13 and  name HN   )(resid    15 and  name HN  ) 0.0 0.0 5.0
assign (resid    13 and  name HN   )(resid    15 and  name HB#  ) 0.0 0.0 6.0
assign (resid    15 and  name HN   )(resid    13 and  name HA  ) 0.0 0.0 5.0
assign (resid    15 and  name HN   )(resid    13 and  name HB  ) 0.0 0.0 6.0
! residue  14 LEU
assign (resid    14 and  name HA   )(resid    16 and  name HN  ) 0.0 0.0 5.0
assign (resid    14 and  name HA   )(resid    17 and  name HN  ) 0.0 0.0 4.0
assign (resid    14 and  name HN   )(resid    16 and  name HN  ) 0.0 0.0 5.0
! residue  15 ASN
assign (resid    15 and  name HA   )(resid    18 and  name HN  ) 0.0 0.0 6.0
assign (resid    15 and  name HA   )(resid    17 and  name HN  ) 0.0 0.0 6.0
assign (resid    15 and  name HN   )(resid    17 and  name HN  ) 0.0 0.0 5.0
! residue  16 SER
assign (resid    16 and  name HA   )(resid    18 and  name HN  ) 0.0 0.0 5.0
assign (resid    16 and  name HN   )(resid    18 and  name HN  ) 0.0 0.0 6.0
assign (resid    16 and  name HN   )(resid    19 and  name HN  ) 0.0 0.0 6.0
! residue  17 LEU
assign (resid    17 and  name HA   )(resid    19 and  name HN  ) 0.0 0.0 5.0
assign (resid    17 and  name HN   )(resid    19 and  name HN  ) 0.0 0.0 5.0
assign (resid    20 and  name HN   )(resid    17 and  name HA  ) 0.0 0.0 6.0
! residue  18 THR
assign (resid    18 and  name HA   )(resid    20 and  name HN  ) 0.0 0.0 5.0
assign (resid    18 and  name HN   )(resid    20 and  name HN  ) 0.0 0.0 6.0
assign (resid    20 and  name HN   )(resid    18 and  name HG2#  ) 0.0 0.0 7.5 
! residue  19 GLU
assign (resid    21 and  name HN   )(resid    19 and  name HB#  ) 0.0 0.0 6.0
! residue  24 CYS
assign (resid    24 and  name HN   )(resid    27 and  name HD1#  ) 0.0 0.0 6.5 
assign (resid    24 and  name HN   )(resid    27 and  name HD2#  ) 0.0 0.0 6.5
assign (resid    27 and  name HD1#   )(resid    24 and  name HA ) 0.0 0.0 7.5
assign (resid    27 and  name HD2#   )(resid    24 and  name HA ) 0.0 0.0 7.5
assign (resid    27 and  name HD1#   )(resid    24 and  name HB1 ) 0.0 0.0 7.5
assign (resid    27 and  name HD2#   )(resid    24 and  name HB1 ) 0.0 0.0 7.5
assign (resid    27 and  name HD1#   )(resid    24 and  name HB2 ) 0.0 0.0 7.5
assign (resid    27 and  name HD2#   )(resid    24 and  name HB2 ) 0.0 0.0 7.5
! residue  25 THR
assign (resid    25 and  name HA   )(resid    27 and  name HN  ) 0.0 0.0 5.0
assign (resid    25 and  name HB   )(resid    27 and  name HN  ) 0.0 0.0 5.0
assign (resid    27 and  name HN   )(resid    25 and  name HG2#  ) 0.0 0.0 7.5 
! residue  27 LEU
assign (resid    27 and  name HA   )(resid    29 and  name HN  ) 0.0 0.0 5.0
assign (resid    27 and  name HB#   )(resid    29 and  name HN  ) 0.0 0.0 6.0
! residue  30 THR
assign (resid    30 and  name HG2#   )(resid    32 and  name HN  ) 0.0 0.0 5.5
assign (resid    30 and  name HG2#   )(resid    33 and  name HN  ) 0.0 0.0 6.5
! residue  31 ASP
assign (resid    31 and  name HA   )(resid    34 and  name HN  ) 0.0 0.0 5.0
assign (resid    31 and  name HB1   )(resid    34 and  name HN  ) 0.0 0.0 5.0
assign (resid    31 and  name HB2   )(resid    34 and  name HN  ) 0.0 0.0 5.0
assign (resid    31 and  name HA   )(resid    33 and  name HN  ) 0.0 0.0 4.0
! residue  32 ILE
assign (resid    32 and  name HB   )(resid    34 and  name HN  ) 0.0 0.0 6.0
assign (resid    32 and  name HD1#   )(resid    34 and  name HN  ) 0.0 0.0 7.5
assign (resid    32 and  name HG1#   )(resid    34 and  name HN  ) 0.0 0.0 7.0
assign (resid    32 and  name HA   )(resid    34 and  name HN  ) 0.0 0.0 5.0
assign (resid    32 and  name HA   )(resid    35 and  name HN  ) 0.0 0.0 5.0
assign (resid    32 and  name HA   )(resid    36 and  name HN  ) 0.0 0.0 6.0
assign (resid    32 and  name HA   )(resid    37 and  name HN  ) 0.0 0.0 6.0
assign (resid    32 and  name HN   )(resid    34 and  name HN  ) 0.0 0.0 5.0
assign (resid    32 and  name HG2#   )(resid    34 and  name HN  ) 0.0 0.0 7.5
! residue  33 PHE
assign (resid    33 and  name HN   )(resid    35 and  name HN  ) 0.0 0.0 5.0
assign (resid    33 and  name HD#   )(resid    35 and  name HN  ) 0.0 0.0 8.0
assign (resid    33 and  name HD#   )(resid    36 and  name HN  ) 0.0 0.0 8.0
assign (resid    33 and  name HB#   )(resid    35 and  name HN  ) 0.0 0.0 7.0
! residue  34 ALA
assign (resid    34 and  name HB#  )(resid    37 and  name HN  ) 0.0 0.0 6.5
assign (resid    34 and  name HN   )(resid    36 and  name HN  ) 0.0 0.0 6.0
assign (resid    34 and  name HA   )(resid    36 and  name HN  ) 0.0 0.0 6.0
! residue  35 ALA
assign (resid    35 and  name HA   )(resid    37 and  name HN  ) 0.0 0.0 5.0
assign (resid    35 and  name HA   )(resid    38 and  name HN  ) 0.0 0.0 5.0
assign (resid    35 and  name HN   )(resid    37 and  name HN  ) 0.0 0.0 6.0
! residue  36 SER
assign (resid    36 and  name HA   )(resid    38 and  name HN  ) 0.0 0.0 5.0
assign (resid    36 and  name HA   )(resid    39 and  name HN  ) 0.0 0.0 6.0
assign (resid    36 and  name HB#   )(resid    38 and  name HN  ) 0.0 0.0 7.0
assign (resid    36 and  name HN   )(resid    38 and  name HN  ) 0.0 0.0 6.0
! residue  37 LYS
assign (resid    37 and  name HA   )(resid    39 and  name HN  ) 0.0 0.0 6.0
assign (resid    37 and  name HN   )(resid    39 and  name HN  ) 0.0 0.0 6.0
assign (resid    37 and  name HB#   )(resid    39 and  name HN  ) 0.0 0.0 6.0
! residue  39 THR
assign (resid    39 and  name HG2#   )(resid    44 and  name HN  ) 0.0 0.0 6.5
! residue  40 THR
assign (resid    40 and  name HB   )(resid    42 and  name HN  ) 0.0 0.0 4.0
assign (resid    40 and  name HB   )(resid    43 and  name HN  ) 0.0 0.0 4.0
assign (resid    40 and  name HN   )(resid    43 and  name HN  ) 0.0 0.0 5.0
assign (resid    40 and  name HN   )(resid    42 and  name HN  ) 0.0 0.0 6.0
assign (resid    40 and  name HA   )(resid    42 and  name HN  ) 0.0 0.0 5.0
assign (resid    40 and  name HA   )(resid    43 and  name HN  ) 0.0 0.0 5.0
assign (resid    40 and  name HG2#   )(resid    42 and  name HN  ) 0.0 0.0 6.5
assign (resid    40 and  name HG2#   )(resid    43 and  name HN  ) 0.0 0.0 6.5
assign (resid    40 and  name HG2#   )(resid    44 and  name HN  ) 0.0 0.0 7.5
assign (resid    43 and  name HB#   )(resid    40 and  name HN  ) 0.0 0.0 5.0
assign (resid    43 and  name HG#   )(resid    40 and  name HN  ) 0.0 0.0 4.0
! residue  41 GLU
assign (resid    41 and  name HB#   )(resid    42 and  name HN  ) 0.0 0.0 3.5
assign (resid    41 and  name HA   )(resid    42 and  name HN  ) 0.0 0.0 4.0
assign (resid    41 and  name HN   )(resid    42 and  name HA  ) 0.0 0.0 6.0
assign (resid    41 and  name HN   )(resid    42 and  name HN  ) 0.0 0.0 5.0
! residue  42 LYS
assign (resid    42 and  name HA   )(resid    46 and  name HN  ) 0.0 0.0 5.0
assign (resid    42 and  name HA   )(resid    44 and  name HN  ) 0.0 0.0 6.0
assign (resid    42 and  name HA   )(resid    45 and  name HN  ) 0.0 0.0 4.0
assign (resid    42 and  name HN   )(resid    44 and  name HN  ) 0.0 0.0 5.0
assign (resid    42 and  name HN   )(resid    45 and  name HN  ) 0.0 0.0 5.0
assign (resid    42 and  name HN   )(resid    45 and  name HD#  ) 0.0 0.0 8.0
assign (resid    42 and  name HN   )(resid    45 and  name HE#  ) 0.0 0.0 8.0
! residue  43 GLU
assign (resid    43 and  name HA   )(resid    45 and  name HN  ) 0.0 0.0 5.0
assign (resid    43 and  name HB#   )(resid    45 and  name HN  ) 0.0 0.0 6.0
assign (resid    43 and  name HG#   )(resid    45 and  name HN  ) 0.0 0.0 6.0
assign (resid    43 and  name HA   )(resid    46 and  name HN  ) 0.0 0.0 4.0
assign (resid    43 and  name HN   )(resid    44 and  name HN  ) 0.0 0.0 3.0
assign (resid    43 and  name HN   )(resid    45 and  name HN  ) 0.0 0.0 5.0
assign (resid    43 and  name HN   )(resid    44 and  name HA  ) 0.0 0.0 6.0
! residue  44 THR
assign (resid    44 and  name HA   )(resid    46 and  name HN  ) 0.0 0.0 6.0
assign (resid    44 and  name HB   )(resid    46 and  name HN  ) 0.0 0.0 6.0
assign (resid    44 and  name HA   )(resid    47 and  name HN  ) 0.0 0.0 5.0
assign (resid    44 and  name HN   )(resid    47 and  name HN  ) 0.0 0.0 6.0
! residue  45 PHE
assign (resid    45 and  name HN   )(resid    47 and  name HN  ) 0.0 0.0 6.0
assign (resid    45 and  name HN   )(resid    48 and  name HN  ) 0.0 0.0 5.0
assign (resid    45 and  name HA   )(resid    48 and  name HN  ) 0.0 0.0 5.0
assign (resid    49 and  name HN   )(resid    45 and  name HE#  ) 0.0 0.0 7.0
! residue  46 CYS
assign (resid    46 and  name HB1   )(resid    48 and  name HN  ) 0.0 0.0 6.0
assign (resid    46 and  name HB2   )(resid    48 and  name HN  ) 0.0 0.0 6.0
assign (resid    46 and  name HN   )(resid    48 and  name HN  ) 0.0 0.0 5.0
! residue  47 ARG
assign (resid    47 and  name HN   )(resid    49 and  name HN  ) 0.0 0.0 6.0
! residue  48 ALA
assign (resid    48 and  name HN   )(resid    50 and  name HN  ) 0.0 0.0 5.0
assign (resid    48 and  name HA   )(resid    51 and  name HN  ) 0.0 0.0 5.0
assign (resid    48 and  name HA   )(resid    52 and  name HN  ) 0.0 0.0 5.0
! residue  49 ALA
assign (resid    49 and  name HA   )(resid    51 and  name HN  ) 0.0 0.0 5.0
! residue  50 THR
assign (resid    50 and  name HG2#   )(resid    52 and  name HN  ) 0.0 0.0 7.5
! residue  52 LEU
assign (resid    52 and  name HA   )(resid    55 and  name HN  ) 0.0 0.0 4.0
assign (resid    52 and  name HA   )(resid    56 and  name HN  ) 0.0 0.0 5.0
! residue  54 GLN
assign (resid    54 and  name HA   )(resid    56 and  name HN  ) 0.0 0.0 5.0
! residue  55 PHE
assign (resid    55 and  name HD#   )(resid    59 and  name HD2  ) 0.0 0.0 6.0
assign (resid    55 and  name HE#   )(resid    59 and  name HD2  ) 0.0 0.0 7.0
assign (resid    55 and  name HZ   )(resid    59 and  name HD2  ) 0.0 0.0 6.0
assign (resid    55 and  name HA   )(resid    59 and  name HD2  ) 0.0 0.0 4.0
assign (resid    55 and  name HB1   )(resid    59 and  name HD2  ) 0.0 0.0 5.0
assign (resid    55 and  name HB2   )(resid    59 and  name HD2  ) 0.0 0.0 5.0
! residue  56 TYR 
assign (resid    56 and  name HA   )(resid    58 and  name HN  ) 0.0 0.0 6.0
assign (resid    56 and  name HA   )(resid    59 and  name HN  ) 0.0 0.0 5.0
assign (resid    56 and  name HA   )(resid    60 and  name HN  ) 0.0 0.0 5.0
assign (resid    56 and  name HN   )(resid    58 and  name HN  ) 0.0 0.0 6.0
! residue  57 SER
assign (resid    57 and  name HA   )(resid    60 and  name HN  ) 0.0 0.0 5.0
! residue  58 HIS
assign (resid    58 and  name HN   )(resid    60 and  name HN  ) 0.0 0.0 5.0
! residue  59 HIS
assign (resid    59 and  name HA   )(resid    63 and  name HN  ) 0.0 0.0 6.0
assign (resid    59 and  name HA   )(resid    62 and  name HN  ) 0.0 0.0 5.0
! residue  60 GLU
assign (resid    60 and  name HN   )(resid    62 and  name HN  ) 0.0 0.0 6.0
! residue  62 ASP
assign (resid    62 and  name HA   )(resid    64 and  name HN  ) 0.0 0.0 5.0
assign (resid    66 and  name HD##   )(resid    62 and  name HN  ) 0.0 0.0 7.9
! residue  63 THR
assign (resid    63 and  name HA   )(resid    66 and  name HN  ) 0.0 0.0 4.0
assign (resid    66 and  name HD##   )(resid    63 and  name HN  ) 0.0 0.0 8.9
! residue  64 ARG
assign (resid    64 and  name HN   )(resid    66 and  name HN  ) 0.0 0.0 5.0
assign (resid    64 and  name HN   )(resid    66 and  name HD##  ) 0.0 0.0 8.9
! residue  67 GLY
assign (resid    67 and  name HA1   )(resid    69 and  name HN  ) 0.0 0.0 5.0
assign (resid    67 and  name HA2   )(resid    69 and  name HN  ) 0.0 0.0 5.0
assign (resid    67 and  name HA1   )(resid    69 and  name HN  ) 0.0 0.0 5.0
assign (resid    67 and  name HA2   )(resid    69 and  name HN  ) 0.0 0.0 5.0
!residue  68 ALA
assign (resid    72 and  name HG1   )(resid    68 and  name HN  ) 0.0 0.0 5.0
assign (resid    72 and  name HG2   )(resid    68 and  name HN  ) 0.0 0.0 5.0
assign (resid    68 and  name HB#   )(resid    75 and  name HN  ) 0.0 0.0 7.5
! residue  69 THR
assign (resid    69 and  name HN   )(resid    72 and  name HN  ) 0.0 0.0 5.0
assign (resid    69 and  name HN   )(resid    73 and  name HN  ) 0.0 0.0 6.0
assign (resid    72 and  name HG1   )(resid    69 and  name HN  ) 0.0 0.0 5.0
assign (resid    72 and  name HG2   )(resid    69 and  name HN  ) 0.0 0.0 5.0
assign (resid    69 and  name HG2#   )(resid    71 and  name HN  ) 0.0 0.0 6.5
assign (resid    69 and  name HG2#   )(resid    72 and  name HN  ) 0.0 0.0 6.5
assign (resid    69 and  name HG2#   )(resid    72 and  name HE21  ) 0.0 0.0 7.5
assign (resid    69 and  name HG2#   )(resid    72 and  name HE22  ) 0.0 0.0 7.5
! residue  70 ALA
assign (resid    70 and  name HB#   )(resid    72 and  name HN  ) 0.0 0.0 6.5
assign (resid    70 and  name HB#   )(resid    73 and  name HN  ) 0.0 0.0 6.5
assign (resid    70 and  name HB#   )(resid    74 and  name HN  ) 0.0 0.0 7.5
! residue  71 GLN
assign (resid    71 and  name HA   )(resid    75 and  name HN  ) 0.0 0.0 6.0
assign (resid    71 and  name HG#   )(resid    75 and  name HN  ) 0.0 0.0 7.0
! residue  72 GLN
assign (resid    72 and  name HA   )(resid    74 and  name HN  ) 0.0 0.0 5.0
assign (resid    72 and  name HA   )(resid    75 and  name HN  ) 0.0 0.0 4.0
assign (resid    72 and  name HA   )(resid    76 and  name HN  ) 0.0 0.0 5.0
assign (resid    72 and  name HN   )(resid    74 and  name HN  ) 0.0 0.0 6.0
assign (resid    72 and  name HN   )(resid    75 and  name HN  ) 0.0 0.0 6.0
! residue  73 PHE
assign (resid    73 and  name HB#   )(resid    75 and  name HN  ) 0.0 0.0 7.0
assign (resid    73 and  name HA   )(resid    75 and  name HN  ) 0.0 0.0 6.0
assign (resid    73 and  name HN   )(resid    75 and  name HN  ) 0.0 0.0 5.0
! residue  74 HIS
assign (resid    74 and  name HB#   )(resid    78 and  name HN  ) 0.0 0.0 7.0
assign (resid    74 and  name HA   )(resid    76 and  name HN  ) 0.0 0.0 6.0
assign (resid    74 and  name HA   )(resid    77 and  name HN  ) 0.0 0.0 4.0
assign (resid    74 and  name HA   )(resid    78 and  name HN  ) 0.0 0.0 5.0
! residue  75 ARG
assign (resid    75 and  name HA   )(resid    77 and  name HN  ) 0.0 0.0 5.0
assign (resid    75 and  name HA   )(resid    78 and  name HN  ) 0.0 0.0 4.0
assign (resid    75 and  name HN   )(resid    77 and  name HN  ) 0.0 0.0 6.0
assign (resid    75 and  name HN   )(resid    78 and  name HN  ) 0.0 0.0 6.0
! residue  76 HIS
assign (resid    76 and  name HB#   )(resid    78 and  name HN  ) 0.0 0.0 7.0
assign (resid    76 and  name HN   )(resid    78 and  name HN  ) 0.0 0.0 5.0
! residue  77 LYS
assign (resid    77 and  name HA   )(resid    80 and  name HN  ) 0.0 0.0 4.0
assign (resid    77 and  name HA   )(resid    79 and  name HN  ) 0.0 0.0 6.0
assign (resid    77 and  name HA   )(resid    81 and  name HN  ) 0.0 0.0 5.0
assign (resid    77 and  name HN   )(resid    79 and  name HN  ) 0.0 0.0 6.0
! residue  78 GLN
assign (resid    78 and  name HA   )(resid    80 and  name HN  ) 0.0 0.0 6.0
assign (resid    78 and  name HN   )(resid    80 and  name HN  ) 0.0 0.0 5.0
! residue  79 LEU
assign (resid    79 and  name HA   )(resid    82 and  name HN  ) 0.0 0.0 4.0
assign (resid    79 and  name HA   )(resid    83 and  name HN  ) 0.0 0.0 5.0
assign (resid    82 and  name HD#   )(resid    79 and  name HN  ) 0.0 0.0 8.0
assign (resid    82 and  name HB#   )(resid    79 and  name HN  ) 0.0 0.0 6.0
! residue  80 ILE
assign (resid    80 and  name HA   )(resid    82 and  name HN  ) 0.0 0.0 5.0
assign (resid    80 and  name HA   )(resid    83 and  name HN  ) 0.0 0.0 4.0
assign (resid    80 and  name HA   )(resid    84 and  name HN  ) 0.0 0.0 6.0
assign (resid    80 and  name HN   )(resid    82 and  name HN  ) 0.0 0.0 5.0
! residue  81 ARG
assign (resid    81 and  name HA   )(resid    83 and  name HN  ) 0.0 0.0 5.0
assign (resid    81 and  name HA   )(resid    84 and  name HN  ) 0.0 0.0 4.0
assign (resid    81 and  name HN   )(resid    83 and  name HN  ) 0.0 0.0 5.0
! residue  82 PHE
assign (resid    82 and  name HD#   )(resid    85 and  name HN  ) 0.0 0.0 7.0
assign (resid    82 and  name HA   )(resid    84 and  name HN  ) 0.0 0.0 6.0
assign (resid    82 and  name HA   )(resid    85 and  name HN  ) 0.0 0.0 5.0
assign (resid    82 and  name HA   )(resid    86 and  name HN  ) 0.0 0.0 5.0
assign (resid    82 and  name HN   )(resid    84 and  name HN  ) 0.0 0.0 5.0
! residue  83 LEU
assign (resid    83 and  name HN   )(resid    85 and  name HN  ) 0.0 0.0 5.0
assign (resid    83 and  name HA   )(resid    85 and  name HN  ) 0.0 0.0 5.0
! residue  84 LYS
assign (resid    84 and  name HA   )(resid    86 and  name HN  ) 0.0 0.0 6.0
assign (resid    84 and  name HA   )(resid    87 and  name HN  ) 0.0 0.0 4.0
assign (resid    84 and  name HA   )(resid    88 and  name HN  ) 0.0 0.0 5.0
assign (resid    84 and  name HN   )(resid    86 and  name HN  ) 0.0 0.0 5.0
! residue  85 ARG
assign (resid    85 and  name HA   )(resid    87 and  name HN  ) 0.0 0.0 5.0
assign (resid    85 and  name HN   )(resid    87 and  name HN  ) 0.0 0.0 5.0
! residue  86 LEU
assign (resid    86 and  name HN   )(resid    88 and  name HN  ) 0.0 0.0 6.0
! residue  87 ASP
assign (resid    87 and  name HA   )(resid    90 and  name HN  ) 0.0 0.0 6.0
assign (resid    87 and  name HN   )(resid    89 and  name HN  ) 0.0 0.0 6.0
! residue  88 ARG
assign (resid    88 and  name HN   )(resid    90 and  name HN  ) 0.0 0.0 6.0
! residue  89 ASN
assign (resid    89 and  name HA   )(resid    92 and  name HN  ) 0.0 0.0 5.0
! residue  91 TRP
assign (resid    91 and  name HE3   )(resid    93 and  name HN  ) 0.0 0.0 6.0
! residue  92 GLY
assign (resid    92 and  name HA#   )(resid    95 and  name HN  ) 0.0 0.0 7.0
assign (resid    92 and  name HA#   )(resid    94 and  name HN  ) 0.0 0.0 6.0
assign (resid    92 and  name HN   )(resid    94 and  name HN  ) 0.0 0.0 6.0
! residue  94 ALA
assign (resid    94 and  name HA   )(resid    96 and  name HN  ) 0.0 0.0 6.0 
assign (resid    94 and  name HN   )(resid    96 and  name HN  ) 0.0 0.0 6.0
! residue  96 LEU
assign (resid    96 and  name HB#   )(resid    98 and  name HN  ) 0.0 0.0 5.0
assign (resid    96 and  name HD##   )(resid    98 and  name HN  ) 0.0 0.0 7.9
assign (resid    96 and  name HD##   )(resid    99 and  name HN  ) 0.0 0.0 8.9
assign (resid    96 and  name HA   )(resid    98 and  name HN  ) 0.0 0.0 6.0
! residue  101 VAL
assign (resid    101 and  name HG##   )(resid    103 and  name HN  ) 0.0 0.0 7.9
assign (resid    101 and  name HA   )(resid    103 and  name HN  ) 0.0 0.0 6.0
! residue  103 GLU
assign (resid    103 and  name HB#   )(resid    105 and  name HN  ) 0.0 0.0 6.0
assign (resid    103 and  name HG#   )(resid    105 and  name HN  ) 0.0 0.0 5.0
assign (resid    103 and  name HA   )(resid    105 and  name HN  ) 0.0 0.0 5.0
! residue  104 ALA
assign (resid    104 and  name HB#   )(resid    106 and  name HE#  ) 0.0 0.0 7.5
! residue  106 GLN
assign (resid    106 and  name HB#   )(resid    108 and  name HN  ) 0.0 0.0 7.0
assign (resid    106 and  name HG#   )(resid    108 and  name HN  ) 0.0 0.0 7.0
! residue  107 SER
assign (resid    107 and  name HA   )(resid    109 and  name HN  ) 0.0 0.0 5.0
! residue  108 THR
assign (resid    108 and  name HG2#   )(resid    111 and  name HN  ) 0.0 0.0 7.5
assign (resid    108 and  name HG2#   )(resid    111 and  name HD#  ) 0.0 0.0 8.5
assign (resid    111 and  name HB1   )(resid    108 and  name HN  ) 0.0 0.0 5.0
assign (resid    111 and  name HB2   )(resid    108 and  name HN  ) 0.0 0.0 5.0
assign (resid    108 and  name HB   )(resid    111 and  name HN  ) 0.0 0.0 6.0
assign (resid    108 and  name HA   )(resid    110 and  name HN  ) 0.0 0.0 6.0
assign (resid    108 and  name HN   )(resid    111 and  name HN  ) 0.0 0.0 6.0
assign (resid    108 and  name HN   )(resid    111 and  name HD#  ) 0.0 0.0 7.0 
! residue  109 LEU
assign (resid    109 and  name HD1#   )(resid    113 and  name HN  ) 0.0 0.0 6.5
assign (resid    109 and  name HD2#   )(resid    113 and  name HN  ) 0.0 0.0 6.5
assign (resid    109 and  name HA   )(resid    112 and  name HN  ) 0.0 0.0 5.0
! residue  110 GLU
assign (resid    112 and  name HB#   )(resid    110 and  name HN  ) 0.0 0.0 7.0
assign (resid    110 and  name HA   )(resid    112 and  name HN  ) 0.0 0.0 6.0
assign (resid    110 and  name HA   )(resid    113 and  name HN  ) 0.0 0.0 4.0
assign (resid    110 and  name HN   )(resid    112 and  name HN  ) 0.0 0.0 6.0
! residue  111 ASN
assign (resid    111 and  name HB1   )(resid    114 and  name HN  ) 0.0 0.0 6.0
assign (resid    111 and  name HB2   )(resid    114 and  name HN  ) 0.0 0.0 6.0
assign (resid    111 and  name HA   )(resid    114 and  name HN  ) 0.0 0.0 5.0
assign (resid    111 and  name HN   )(resid    113 and  name HN  ) 0.0 0.0 5.0
! residue  112 PHE
assign (resid    112 and  name HB#   )(resid    115 and  name HN  ) 0.0 0.0 7.0
assign (resid    112 and  name HD#   )(resid    114 and  name HN  ) 0.0 0.0 8.0
assign (resid    112 and  name HD#   )(resid    116 and  name HN  ) 0.0 0.0 8.0
assign (resid    112 and  name HA   )(resid    115 and  name HN  ) 0.0 0.0 5.0
assign (resid    112 and  name HN   )(resid    114 and  name HN  ) 0.0 0.0 6.0
! residue  113 LEU
assign (resid    113 and  name HA   )(resid    116 and  name HN  ) 0.0 0.0 5.0
assign (resid    113 and  name HA   )(resid    117 and  name HN  ) 0.0 0.0 5.0
assign (resid    113 and  name HN   )(resid    115 and  name HN  ) 0.0 0.0 6.0
! residue  114 GLU
assign (resid    114 and  name HA   )(resid    117 and  name HN  ) 0.0 0.0 4.0
assign (resid    114 and  name HN   )(resid    117 and  name HN  ) 0.0 0.0 6.0
assign (resid    114 and  name HA   )(resid    118 and  name HN  ) 0.0 0.0 5.0
! residue  115 ARG
assign (resid    115 and  name HA   )(resid    117 and  name HN  ) 0.0 0.0 5.0
assign (resid    115 and  name HN   )(resid    117 and  name HN  ) 0.0 0.0 6.0
! residue  116 LEU
assign (resid    116 and  name HN   )(resid    118 and  name HN  ) 0.0 0.0 6.0
! residue  117 LYS
assign (resid    117 and  name HA   )(resid    120 and  name HN  ) 0.0 0.0 5.0
assign (resid    117 and  name HA   )(resid    121 and  name HN  ) 0.0 0.0 6.0
assign (resid    117 and  name HN   )(resid    119 and  name HN  ) 0.0 0.0 6.0
! residue  118 THR
assign (resid    118 and  name HA   )(resid    121 and  name HN  ) 0.0 0.0 5.0
assign (resid    118 and  name HN   )(resid    120 and  name HN  ) 0.0 0.0 5.0
! residue  119 ILE
assign (resid    119 and  name HD1#   )(resid    121 and  name HN  ) 0.0 0.0 7.5
assign (resid    119 and  name HA   )(resid    122 and  name HN  ) 0.0 0.0 5.0
assign (resid    119 and  name HA   )(resid    123 and  name HN  ) 0.0 0.0 5.0
assign (resid    119 and  name HN   )(resid    121 and  name HN  ) 0.0 0.0 6.0
! residue  120 MET
assign (resid    120 and  name HA   )(resid    123 and  name HN  ) 0.0 0.0 5.0
assign (resid    120 and  name HA   )(resid    122 and  name HN  ) 0.0 0.0 6.0
assign (resid    120 and  name HN   )(resid    122 and  name HN  ) 0.0 0.0 5.0
! residue  121 ARG
assign (resid    121 and  name HA   )(resid    123 and  name HN  ) 0.0 0.0 6.0
assign (resid    121 and  name HA   )(resid    124 and  name HN  ) 0.0 0.0 5.0
assign (resid    121 and  name HN   )(resid    123 and  name HN  ) 0.0 0.0 6.0
! residue  122 GLU
assign (resid    122 and  name HN   )(resid    124 and  name HN  ) 0.0 0.0 6.0
! residue  123 LYS
assign (resid    123 and  name HN   )(resid    125 and  name HN  ) 0.0 0.0 5.0
assign (resid    123 and  name HN   )(resid    126 and  name HN  ) 0.0 0.0 6.0
! residue  124 TYR
assign (resid    124 and  name HA   )(resid    127 and  name HN  ) 0.0 0.0 6.0
! residue  125 SER
assign (resid    125 and  name HB#   )(resid    127 and  name HN  ) 0.0 0.0 7.0
assign (resid    125 and  name HA   )(resid    127 and  name HN  ) 0.0 0.0 6.0
assign (resid    125 and  name HA   )(resid    128 and  name HN  ) 0.0 0.0 6.0
assign (resid    125 and  name HN   )(resid    127 and  name HN  ) 0.0 0.0 5.0
! residue  126 LYS
assign (resid    126 and  name HA   )(resid    128 and  name HN  ) 0.0 0.0 6.0
!
! NOE effects between i and i+2,i+3,i+4
! from 1H-13C spectra
!
! residue  5 ILE 
assign (resid   5  and  name HD1#   )(resid    8 and  name HB#  ) 0.0 0.0 5.5 
assign (resid   5  and  name HG2#   )(resid    8 and  name HB#  ) 0.0 0.0 7.5
assign (resid   5  and  name HA   )(resid    8 and  name HB#  ) 0.0 0.0 4.0
assign (resid   5  and  name HA   )(resid    8 and  name HG#  ) 0.0 0.0 6.0
! residue  6 THR
assign (resid   6  and  name HB   )(resid    10 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   6  and  name HG2#   )(resid    10 and  name HD1#  ) 0.0 0.0 6.0
assign (resid   6  and  name HA   )(resid   9  and  name HB#  ) 0.0 0.0 4.0
assign (resid   6  and  name HA   )(resid   9  and  name HG#  ) 0.0 0.0 6.0
! residue  7 LEU
assign (resid   7  and  name HA   )(resid   10  and  name HD1#  ) 0.0 0.0 4.5
assign (resid   7  and  name HA   )(resid   10  and  name HG2#  ) 0.0 0.0 6.5
assign (resid   7  and  name HD1#   )(resid   10  and  name HG2#  ) 0.0 0.0 6.0
assign (resid   7  and  name HD1#   )(resid   10  and  name HD1#  ) 0.0 0.0 6.0
assign (resid   7  and  name HD2#   )(resid   10  and  name HG2#  ) 0.0 0.0 6.0
assign (resid   7  and  name HD2#   )(resid   10  and  name HD1#  ) 0.0 0.0 6.0
assign (resid   7  and  name HA   )(resid   10  and  name HB  ) 0.0 0.0 3.0
! residue  8 GLN
assign (resid   8  and  name HA   )(resid   11  and  name HD1#  ) 0.0 0.0 4.5
assign (resid   8  and  name HA   )(resid   11  and  name HG2#  ) 0.0 0.0 4.5
assign (resid   8  and  name HA   )(resid   11  and  name HB  ) 0.0 0.0 3.0
assign (resid   8  and  name HA   )(resid   11  and  name HG11  ) 0.0 0.0 5.0
assign (resid   8  and  name HA   )(resid   11  and  name HG12  ) 0.0 0.0 5.0
! residue  9 GLU
assign (resid   9  and  name HA   )(resid   12  and  name HB#  ) 0.0 0.0 4.0
! residue  10 ILE
assign (resid   10  and  name HA   )(resid    13 and  name HB  ) 0.0 0.0 3.0
! residue  11 ILE
assign (resid   11  and  name HA   )(resid    14 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   11  and  name HA   )(resid    14 and  name HD2#  ) 0.0 0.0 4.5
assign (resid   11  and  name HA   )(resid    14 and  name HB#  ) 0.0 0.0 4.0
! residue  12 LYS
assign (resid   12  and  name HA   )(resid    15 and  name HB1  ) 0.0 0.0 3.0
assign (resid   12  and  name HA   )(resid    15 and  name HB2  ) 0.0 0.0 3.0
! residue  13 THR
assign (resid   13  and  name HG2#   )(resid    17 and  name HD1# ) 0.0 0.0 6.0
assign (resid   13  and  name HG2#   )(resid    17 and  name HD2# ) 0.0 0.0 6.0
! residue  14 LEU
assign (resid   14  and  name HA   )(resid   17  and  name HB#  ) 0.0 0.0 6.0
! residue  15 ASN
! residue  16 SER
assign (resid   16  and  name HA   )(resid   19  and  name HB#  ) 0.0 0.0 6.0
assign (resid   16  and  name HA   )(resid   19  and  name HG#  ) 0.0 0.0 6.0
! residue  21 LYS 
assign (resid   21  and  name HA   )(resid   25  and  name HG2#  ) 0.0 0.0 4.5
! residue  30 THR
assign (resid    30 and  name HG2#   )(resid    32 and  name HG2#  ) 0.0 0.0 6.0
assign (resid    30 and  name HB   )(resid    32 and  name HG2#  ) 0.0 0.0 4.5
assign (resid    30 and  name HG2#   )(resid    32 and  name HA  ) 0.0 0.0 4.5
! residue  31 ASP
assign (resid   31  and  name HB#   )(resid   34  and  name HB#  ) 0.0 0.0 5.5
! residue  32 ILE
assign (resid   32  and  name HA   )(resid    35 and  name HB# ) 0.0 0.0 6.5
! residue  36 SER
assign (resid   36  and  name HA   )(resid   39  and  name HG2#  ) 0.0 0.0 4.5
assign (resid   36  and  name HB#   )(resid   39  and  name HG2#  ) 0.0 0.0 7.5
! residue  39 THR
assign (resid   39  and  name HG2#   )(resid   43  and  name HG#  ) 0.0 0.0 5.5
! residue  41 GLU
assign (resid   41  and  name HA   )(resid    44 and  name HB  ) 0.0 0.0 3.0
assign (resid   41  and  name HA   )(resid    44 and  name HG2#  ) 0.0 0.0 4.5
! residue  42 LYS
assign (resid   42  and  name HA   )(resid    45 and  name HB#  ) 0.0 0.0 6.0
assign (resid   42  and  name HG#   )(resid    45 and  name HB#  ) 0.0 0.0 7.0
! residue  43 GLU
assign (resid   43  and  name HA   )(resid    46 and  name HB1  ) 0.0 0.0 5.0
assign (resid   43  and  name HA   )(resid    46 and  name HB2  ) 0.0 0.0 5.0
! residue  44 THR
assign (resid   44  and  name HG2#   )(resid    48 and  name HB#  ) 0.0 0.0 6.0
assign (resid   44  and  name HA   )(resid    47 and  name HD#  ) 0.0 0.0 6.0
assign (resid   44  and  name HA   )(resid    47 and  name HB#  ) 0.0 0.0 6.0
! residue  45 PHE
assign (resid   45  and  name HA   )(resid   48  and  name HB#  ) 0.0 0.0 4.5
assign (resid   45  and  name HB#   )(resid  48   and  name HB#  ) 0.0 0.0 7.5
assign (resid   45  and  name HD#   )(resid    48 and  name HB#  ) 0.0 0.0 8.5
! residue  47 ARG
assign (resid   47  and  name HA   )(resid    50 and  name HG2#  ) 0.0 0.0 4.5
assign (resid   47  and  name HA   )(resid    50 and  name HB  ) 0.0 0.0 3.0
! residue  48 ALA
assign (resid  48   and  name HB#   )(resid   51  and  name HB  ) 0.0 0.0 4.5
assign (resid  48   and  name HB#   )(resid   51  and  name HG##  ) 0.0 0.0 9.4
assign (resid  48   and  name HA   )(resid   51  and  name HG##  ) 0.0 0.0 5.9
assign (resid  48   and  name HA   )(resid   51  and  name HB  ) 0.0 0.0 3.0
! residue  50 THR
assign (resid   50  and  name HG2#   )(resid    54 and  name HG#  ) 0.0 0.0 5.5
assign (resid   50  and  name HG2#   )(resid    54 and  name HB#  ) 0.0 0.0 7.5
! residue  51 VAL
assign (resid   51  and  name HA   )(resid    54 and  name HB#  ) 0.0 0.0 6.0
assign (resid   51  and  name HA   )(resid    54 and  name HG#  ) 0.0 0.0 6.0
! residue  52 LEU
assign (resid   52  and  name HD##   )(resid    56 and  name HA  ) 0.0 0.0 5.9
assign (resid   52  and  name HA   )(resid    55 and  name HB1  ) 0.0 0.0 5.0
assign (resid   52  and  name HA   )(resid    55 and  name HB2  ) 0.0 0.0 5.0
! residue  54 GLN
assign (resid   54  and  name HA   )(resid    57 and  name HB#  ) 0.0 0.0 4.0
! residue  55 PHE
assign (resid   55  and  name HA   )(resid    58 and  name HB#  ) 0.0 0.0 6.0
! residue  56 TYR
assign (resid  56  and  name HD#   )(resid    60 and  name HG#  ) 0.0 0.0 8.0
! residue  57 SER
assign (resid   57  and  name HA   )(resid    60 and  name HG#  ) 0.0 0.0 6.0
! residue  59 HIS
assign (resid   59  and  name HA   )(resid    62 and  name HB#  ) 0.0 0.0 4.0
! residue  60 GLU
assign (resid   60  and  name HA   )(resid    63 and  name HG2#  ) 0.0 0.0 6.5
! residue  63 THR
assign (resid   63  and  name HG2#   )(resid    66 and  name HD1#  ) 0.0 0.0 8.0
assign (resid   63  and  name HG2#   )(resid    66 and  name HD2#  ) 0.0 0.0 8.0
assign (resid   63  and  name HA   )(resid    66 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   63  and  name HA   )(resid    66 and  name HD2#  ) 0.0 0.0 4.5
assign (resid   63  and  name HB   )(resid    66 and  name HD##  ) 0.0 0.0 5.9
assign (resid   63  and  name HA   )(resid    66 and  name HB#  ) 0.0 0.0 4.0
assign (resid   63  and  name HB   )(resid    66 and  name HB#  ) 0.0 0.0 6.0
assign (resid   63  and  name HA   )(resid    66 and  name HG  ) 0.0 0.0 3.0
! residue  70 ALA
assign (resid   70  and  name HB#   )(resid    73 and  name HB1  ) 0.0 0.0 6.5
assign (resid   70  and  name HB#   )(resid    73 and  name HB2  ) 0.0 0.0 6.5
assign (resid   70  and  name HA   )(resid    73 and  name HB1  ) 0.0 0.0 5.0
assign (resid   70  and  name HA   )(resid    73 and  name HB2  ) 0.0 0.0 5.0
! residue  71 GLN
assign (resid   71  and  name HA   )(resid    74 and  name HB#  ) 0.0 0.0 4.0
! residue  74 HIS
assign (resid   74  and  name HA   )(resid    77 and  name HB#  ) 0.0 0.0 6.0
! residue  79 LEU
assign (resid   79  and  name HD##   )(resid   82  and  name HB1  ) 0.0 0.0 7.9
assign (resid   79  and  name HD##   )(resid   82  and  name HB2  ) 0.0 0.0 7.9
! residue  80 ILE
assign (resid   80  and  name HD1#   )(resid   83  and  name HD##  ) 0.0 0.0 7.4
assign (resid   80  and  name HA   )(resid   83  and  name HD##  ) 0.0 0.0 5.9
assign (resid   80  and  name HA   )(resid   83  and  name HG  ) 0.0 0.0 5.0
! residue  82 PHE
assign (resid   82  and  name HA   )(resid   85  and  name HD#  ) 0.0 0.0 6.0
assign (resid   82  and  name HA   )(resid   85  and  name HB#  ) 0.0 0.0 4.0
assign (resid   82  and  name HA   )(resid   85  and  name HA  ) 0.0 0.0 5.0
! residue  83 LEU
assign (resid   83  and  name HA   )(resid    86 and  name HB#  ) 0.0 0.0 4.0
assign (resid   83  and  name HA   )(resid    86 and  name HD##  ) 0.0 0.0 5.9
! residue  84 LYS
assign (resid   84  and  name HA   )(resid    87 and  name HB#  ) 0.0 0.0 4.0
! residue  85 ARG
assign (resid   85  and  name HA   )(resid    88 and  name HD#  ) 0.0 0.0 6.0
! residue  86 LEU
assign (resid   86  and  name HD##   )(resid    89 and  name HB#  ) 0.0 0.0 8.9
assign (resid   86  and  name HD##   )(resid    90 and  name HD##  ) 0.0 0.0 8.9
assign (resid   86  and  name HA   )(resid    89 and  name HB#  ) 0.0 0.0 6.0
! residue  87 ASP
assign (resid   87  and  name HA   )(resid    90 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   87  and  name HA   )(resid    90 and  name HD2#  ) 0.0 0.0 4.5
assign (resid   87  and  name HA   )(resid    90 and  name HB#  ) 0.0 0.0 6.0
! residue  90 LEU
assign (resid   90  and  name HD##   )(resid    93 and  name HD1#  ) 0.0 0.0 7.4
assign (resid   90  and  name HD##   )(resid    93 and  name HD2#  ) 0.0 0.0 7.4
assign (resid   90  and  name HD##   )(resid    94 and  name HB#  ) 0.0 0.0 9.4
assign (resid   90  and  name HA   )(resid    93 and  name HD1#  ) 0.0 0.0 6.5
assign (resid   90  and  name HA   )(resid    93 and  name HD2#  ) 0.0 0.0 6.5
! residue  91 TRP
assign (resid   91  and  name HA   )(resid    94 and  name HB#  ) 0.0 0.0 4.5
assign (resid   91  and  name HB#   )(resid    94 and  name HB#  ) 0.0 0.0 5.5
! residue  94 ALA
assign (resid   94  and  name HB#   )(resid    96 and  name HD##  ) 0.0 0.0 7.4
! residue  109 LEU
assign (resid    109 and  name HD1#   )(resid    113 and  name HG  ) 0.0 0.0 6.5
assign (resid    109 and  name HD1#   )(resid    113 and  name HD1#  ) 0.0 0.0 8.0
assign (resid    109 and  name HD1#   )(resid    113 and  name HD2#  ) 0.0 0.0 8.0
assign (resid    109 and  name HD2#   )(resid    113 and  name HG  ) 0.0 0.0 6.5
assign (resid    109 and  name HD2#   )(resid    113 and  name HD1#  ) 0.0 0.0 8.0
assign (resid    109 and  name HD2#   )(resid    113 and  name HD2#  ) 0.0 0.0 8.0
assign (resid    109 and  name HD##   )(resid    112 and  name HB1  ) 0.0 0.0 7.9
assign (resid    109 and  name HD##   )(resid    112 and  name HB2  ) 0.0 0.0 7.9
assign (resid    109 and  name HA   )(resid    112 and  name HB1  ) 0.0 0.0 5.0
assign (resid    109 and  name HA   )(resid    112 and  name HB2  ) 0.0 0.0 5.0
! residue  110 GLU
assign (resid    110 and  name HA   )(resid    113 and  name HD##  ) 0.0 0.0 5.9
! residue  111 ASN
assign (resid    111 and  name HA   )(resid    114 and  name HB#  ) 0.0 0.0 4.0
assign (resid    111 and  name HA   )(resid    114 and  name HG#  ) 0.0 0.0 4.0
! residue  112 PHE
assign (resid    112 and  name HA   )(resid    115 and  name HB#  ) 0.0 0.0 6.0
assign (resid    112 and  name HA   )(resid    115 and  name HG#  ) 0.0 0.0 6.0
! residue  113 LEU
assign (resid    113 and  name HA   )(resid    116 and  name HB#  ) 0.0 0.0 6.0
assign (resid    113 and  name HA   )(resid    116 and  name HD##  ) 0.0 0.0 5.9
! residue  114 GLU
assign (resid    114 and  name HA   )(resid    117 and  name HB#  ) 0.0 0.0 4.0
! residue  115 ARG
assign (resid    115 and  name HA   )(resid    118 and  name HB  ) 0.0 0.0 3.0
! residue  116 LEU
assign (resid   116  and  name HD##   )(resid    119 and  name HD1#  ) 0.0 0.0 7.4
assign (resid   116  and  name HA   )(resid    119 and  name HD1#  ) 0.0 0.0 6.5
assign (resid   116  and  name HD##   )(resid    119 and  name HG2#  ) 0.0 0.0 7.4
assign (resid   116  and  name HA   )(resid    119 and  name HG2#  ) 0.0 0.0 6.5
assign (resid   116  and  name HD##   )(resid    120 and  name HG1  ) 0.0 0.0 7.9
assign (resid   116  and  name HD##   )(resid    120 and  name HG2  ) 0.0 0.0 7.9
assign (resid   116  and  name HA   )(resid    119 and  name HB  ) 0.0 0.0 3.0
assign (resid   116  and  name HD##   )(resid    119 and  name HB  ) 0.0 0.0 7.9
assign (resid    116 and  name HD##   )(resid    120 and  name HE#  ) 0.0 0.0 7.4
! residue  118 THR
assign (resid   118  and  name HA   )(resid    121 and  name HB#  ) 0.0 0.0 4.0
assign (resid   118  and  name HA   )(resid    121 and  name HG#  ) 0.0 0.0 6.0
assign (resid   118  and  name HA   )(resid    121 and  name HD#  ) 0.0 0.0 6.0
! residue  119 ILE
assign (resid   119  and  name HA   )(resid    122 and  name HB#  ) 0.0 0.0 4.0
assign (resid   119  and  name HA   )(resid    122 and  name HG#  ) 0.0 0.0 6.0
! residue  121 ARG
assign (resid   121  and  name HA   )(resid    124 and  name HB1  ) 0.0 0.0 3.0
assign (resid   121  and  name HA   )(resid    124 and  name HB2  ) 0.0 0.0 3.0
! residue  123 LYS
assign (resid   123  and  name HA   )(resid    126 and  name HB#  ) 0.0 0.0 4.0
!
! Long range NOE effects, i-j > 4
! from 1H-1H and 1H-15H spectra
!
assign (resid    29 and  name HN   )(resid    107 and  name HN  ) 0.0 0.0 5.0
assign (resid    31 and  name HN   )(resid    107 and  name HN  ) 0.0 0.0 5.0
assign (resid    31 and  name HN   )(resid    106 and  name HA  ) 0.0 0.0 3.0
assign (resid    31 and  name HN   )(resid    106 and  name HB#  ) 0.0 0.0 6.0
assign (resid    31 and  name HN   )(resid    106 and  name HE#  ) 0.0 0.0 7.0
assign (resid    31 and  name HN   )(resid    105 and  name HB#  ) 0.0 0.0 7.0
assign (resid    31 and  name HN   )(resid    104 and  name HB#  ) 0.0 0.0 6.5
assign (resid    29 and  name HG##   )(resid    107 and  name HN  ) 0.0 0.0 8.9
assign (resid    28 and  name HG2#   )(resid    107 and  name HN  ) 0.0 0.0 7.5
assign (resid    29 and  name HN   )(resid    108 and  name HA  ) 0.0 0.0 5.0
assign (resid    28 and  name HG2#  )(resid    108 and  name HN  ) 0.0 0.0 7.5
assign (resid    29 and  name HN   )(resid    109 and  name HN  ) 0.0 0.0 5.0
assign (resid    28 and  name HA   )(resid    109 and  name HN  ) 0.0 0.0 5.0
assign (resid    28 and  name HB   )(resid    109 and  name HN  ) 0.0 0.0 5.0
assign (resid    28 and  name HG2#   )(resid    109 and  name HN  ) 0.0 0.0 6.5
assign (resid    30 and  name HG2#   )(resid    104 and  name HN  ) 0.0 0.0 6.5
assign (resid    30 and  name HG2#   )(resid    103 and  name HN  ) 0.0 0.0 7.5
assign (resid    30 and  name HG2#   )(resid    105 and  name HN  ) 0.0 0.0 6.5
assign (resid    109 and  name HN   )(resid    29 and  name HG## ) 0.0 0.0 7.9
assign (resid    120 and  name HN   )(resid    11 and  name HD# ) 0.0 0.0 7.5
assign (resid    120 and  name HN   )(resid    11 and  name HG1# ) 0.0 0.0 7.0
assign (resid    120 and  name HN   )(resid    10 and  name HG2# ) 0.0 0.0 7.5
assign (resid    121 and  name HN   )(resid    11 and  name HD# ) 0.0 0.0 7.5
assign (resid    124 and  name HN   )(resid    11 and  name HD# ) 0.0 0.0 7.5
assign (resid    109 and  name HD1#  )(resid    55 and  name HD# ) 0.0 0.0 9.5
assign (resid    109 and  name HD1#  )(resid    55 and  name HE# ) 0.0 0.0 9.5
assign (resid    109 and  name HD2#  )(resid    55 and  name HD# ) 0.0 0.0 9.5
assign (resid    109 and  name HD2#  )(resid    55 and  name HE# ) 0.0 0.0 9.5
assign (resid    109 and  name HD1#   )(resid   55 and  name HZ ) 0.0 0.0 7.5
assign (resid    109 and  name HD2#   )(resid   55 and  name HZ ) 0.0 0.0 7.5
assign (resid    109 and  name HD##   )(resid   56 and  name HE# ) 0.0 0.0 10.9
assign (resid    109 and  name HD##  )(resid    112 and  name HD# ) 0.0 0.0 10.9
assign (resid    93 and  name HD1#   )(resid    45 and  name HD# ) 0.0 0.0 9.5
assign (resid    93 and  name HD2#   )(resid    45 and  name HD# ) 0.0 0.0 9.5
assign (resid    93 and  name HD1#   )(resid    45 and  name HE# ) 0.0 0.0 9.5
assign (resid    93 and  name HD2#   )(resid    45 and  name HE# ) 0.0 0.0 9.5
assign (resid    11 and  name HD#   )(resid    124 and  name HD#) 0.0 0.0 8.5
assign (resid    11 and  name HD#   )(resid    124 and  name HE# ) 0.0 0.0 9.5
assign (resid    27 and  name HD1#   )(resid    55 and  name HE# ) 0.0 0.0 8.5
assign (resid    27 and  name HD2#   )(resid    55 and  name HE# ) 0.0 0.0 8.5
assign (resid    27 and  name HD1#   )(resid    55 and  name HZ ) 0.0 0.0 6.5
assign (resid    27 and  name HD2#   )(resid    55 and  name HZ ) 0.0 0.0 6.5
assign (resid    119 and  name HD#   )(resid    33 and  name HD# ) 0.0 0.0 8.5
assign (resid    119 and  name HD#   )(resid    33 and  name HE# ) 0.0 0.0 8.5
assign (resid    119 and  name HD#   )(resid    33 and  name HZ ) 0.0 0.0 7.5
assign (resid    29 and  name HG1#   )(resid    107 and  name HA ) 0.0 0.0 7.5
assign (resid    29 and  name HG2#   )(resid    107 and  name HA ) 0.0 0.0 7.5
assign (resid    8 and  name HN   )(resid    124 and  name HE# ) 0.0 0.0 8.0
assign (resid    8 and  name HN   )(resid    124 and  name HD# ) 0.0 0.0 8.0
assign (resid    109 and  name HD##   )(resid    27 and  name HN  ) 0.0 0.0 8.9
assign (resid    109 and  name HB#   )(resid    27 and  name HN  ) 0.0 0.0 6.0
assign (resid    107 and  name HB#   )(resid    29 and  name HN  ) 0.0 0.0 7.0
assign (resid    112 and  name HD#   )(resid    32 and  name HN  ) 0.0 0.0 6.0
assign (resid    105 and  name HB#   )(resid    34 and  name HN  ) 0.0 0.0 7.0
assign (resid    96 and  name HD##   )(resid    42 and  name HN  ) 0.0 0.0 8.9
assign (resid    94 and  name HA   )(resid    42 and  name HN  ) 0.0 0.0 6.0
assign (resid    96 and  name HD##   )(resid    43 and  name HN  ) 0.0 0.0 7.9
assign (resid    96 and  name HD##   )(resid    44 and  name HN  ) 0.0 0.0 8.9
assign (resid    94 and  name HA   )(resid    45 and  name HN  ) 0.0 0.0 5.0
assign (resid    96 and  name HD##   )(resid    45 and  name HN  ) 0.0 0.0 8.9
assign (resid    94 and  name HA   )(resid    46 and  name HN  ) 0.0 0.0 6.0
assign (resid    96 and  name HD##   )(resid    46 and  name HN  ) 0.0 0.0 7.9
assign (resid    96 and  name HB#   )(resid    46 and  name HN  ) 0.0 0.0 7.0
assign (resid    29 and  name HG1#   )(resid    55 and  name HN  ) 0.0 0.0 7.5
assign (resid    29 and  name HG2#   )(resid    55 and  name HN  ) 0.0 0.0 7.5
assign (resid    29 and  name HG##   )(resid    56 and  name HN  ) 0.0 0.0 7.9
assign (resid    109 and  name HD1#   )(resid    59 and  name HD2  ) 0.0 0.0 7.5
assign (resid    109 and  name HD2#   )(resid    59 and  name HD2  ) 0.0 0.0 7.5
assign (resid    27 and  name HD1#   )(resid    59 and  name HD2  ) 0.0 0.0 6.5
assign (resid    27 and  name HD2#   )(resid    59 and  name HD2  ) 0.0 0.0 6.5
assign (resid    23 and  name HD##   )(resid    67 and  name HN  ) 0.0 0.0 7.9
assign (resid    23 and  name HD##   )(resid    68 and  name HN  ) 0.0 0.0 7.9
assign (resid    23 and  name HD##   )(resid    72 and  name HE21  ) 0.0 0.0 7.9
assign (resid    23 and  name HD##   )(resid    72 and  name HE22  ) 0.0 0.0 7.9
assign (resid    69 and  name HG2#   )(resid    75 and  name HN  ) 0.0 0.0 7.5
assign (resid    56 and  name HD#   )(resid    83 and  name HN  ) 0.0 0.0 8.0
assign (resid    56 and  name HD#   )(resid    84 and  name HN  ) 0.0 0.0 7.0
assign (resid    56 and  name HE#   )(resid    84 and  name HN  ) 0.0 0.0 8.0
assign (resid    56 and  name HE#   )(resid    87 and  name HN  ) 0.0 0.0 7.0
assign (resid    56 and  name HB#   )(resid    87 and  name HN  ) 0.0 0.0 7.0
assign (resid    56 and  name HE#   )(resid    88 and  name HN  ) 0.0 0.0 8.0
assign (resid    45 and  name HD#   )(resid    94 and  name HN  ) 0.0 0.0 8.0
assign (resid    30 and  name HA   )(resid    105 and  name HN  ) 0.0 0.0 6.0
assign (resid    30 and  name HA   )(resid    106 and  name HE#  ) 0.0 0.0 6.0
assign (resid    30 and  name HG2#   )(resid    106 and  name HE#  ) 0.0 0.0 7.5
assign (resid    30 and  name HA   )(resid    107 and  name HN  ) 0.0 0.0 6.0
assign (resid    28 and  name HB   )(resid    107 and  name HN  ) 0.0 0.0 6.0
assign (resid    29 and  name HG##   )(resid    108 and  name HN  ) 0.0 0.0 8.9
assign (resid    33 and  name HD#   )(resid    115 and  name HN  ) 0.0 0.0 8.0
assign (resid    33 and  name HE#   )(resid    115 and  name HN  ) 0.0 0.0 8.0
assign (resid    33 and  name HE#   )(resid    116 and  name HN  ) 0.0 0.0 7.0
assign (resid    33 and  name HZ   )(resid    116 and  name HN  ) 0.0 0.0 6.0
assign (resid    33 and  name HZ   )(resid    117 and  name HN  ) 0.0 0.0 6.0
assign (resid    11 and  name HD1#   )(resid    125 and  name HN  ) 0.0 0.0 7.5
assign (resid    10 and  name HD1#   )(resid    89 and  name HN  ) 0.0 0.0 7.5
assign (resid    93 and  name HD##   )(resid    6 and  name HN  ) 0.0 0.0 8.9
assign (resid    91 and  name HZ2   )(resid    97 and  name HA  ) 0.0 0.0 4.0
assign (resid    91 and  name HH2   )(resid    97 and  name HA  ) 0.0 0.0 6.0
assign (resid    91 and  name HZ2   )(resid    97 and  name HB#  ) 0.0 0.0 6.0
assign (resid    3 and  name HN   )(resid    128 and  name HN  ) 0.0 0.0 6.0
assign (resid    32 and  name HN   )(resid    112 and  name HD#  ) 0.0 0.0 6.0
assign (resid    32 and  name HN   )(resid    103 and  name HA  ) 0.0 0.0 6.0
assign (resid    22 and  name HG2#   )(resid    75 and  name HN  ) 0.0 0.0 7.5
!
! Long range NOE effects, i-j > 4
! from 1H-13C spectra
!
! residue  6 THR
assign (resid   6  and  name HG2#   )(resid    89 and  name HB#  ) 0.0 0.0 5.5
assign (resid   6  and  name HG2#   )(resid    93 and  name HD1#  ) 0.0 0.0 8.0
assign (resid   6  and  name HG2#   )(resid    93 and  name HD2#  ) 0.0 0.0 8.0
assign (resid   6  and  name HB   )(resid    93 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   6  and  name HB   )(resid    93 and  name HD2#  ) 0.0 0.0 4.5
assign (resid   6  and  name HG2#   )(resid   93  and  name HA  ) 0.0 0.0 6.5
assign (resid   6  and  name HG2#   )(resid    89 and  name HA  ) 0.0 0.0 4.5
! residue  7 LEU
assign (resid   7  and  name HD1#   )(resid   124  and  name HA  ) 0.0 0.0 6.5
assign (resid   7  and  name HD1#   )(resid    93 and  name HD1#  ) 0.0 0.0 8.0
assign (resid   7  and  name HD1#   )(resid    93 and  name HD2#  ) 0.0 0.0 8.0
assign (resid   7  and  name HD2#   )(resid   124  and  name HA  ) 0.0 0.0 6.5
assign (resid   7  and  name HD2#   )(resid    93 and  name HD1#  ) 0.0 0.0 8.0
assign (resid   7  and  name HD2#   )(resid    93 and  name HD2#  ) 0.0 0.0 8.0
assign (resid   7  and  name HA   )(resid    93 and  name HD1#  ) 0.0 0.0 6.5
assign (resid   7  and  name HA   )(resid    93 and  name HD2#  ) 0.0 0.0 6.5
! residue  10 ILE
assign (resid   10  and  name HD1#   )(resid   89  and  name HA  ) 0.0 0.0 6.5
assign (resid   10  and  name HD1#   )(resid   89  and  name HB#  ) 0.0 0.0 5.5
assign (resid   10  and  name HD1#   )(resid    93 and  name HD##  ) 0.0 0.0 7.4
assign (resid   10  and  name HD1#   )(resid    86 and  name HD##  ) 0.0 0.0 9.4
assign (resid   10  and  name HA   )(resid    86 and  name HD##  ) 0.0 0.0 7.9
assign (resid   10  and  name HG2#   )(resid    93 and  name HD##  ) 0.0 0.0 7.4
assign (resid   10  and  name HD1#   )(resid    120 and  name HE#  ) 0.0 0.0 8.0
assign (resid   10  and  name HG2#   )(resid    120 and  name HE#  ) 0.0 0.0 6.0
! residue  11 ILE
assign (resid   11  and  name HD1#   )(resid    124 and  name HA  ) 0.0 0.0 4.5
assign (resid   11  and  name HD1#   )(resid    124 and  name HB1  ) 0.0 0.0 6.5
assign (resid   11  and  name HD1#   )(resid    124 and  name HB2  ) 0.0 0.0 6.5
assign (resid   11  and  name HD1#   )(resid    121 and  name HA  ) 0.0 0.0 4.5
assign (resid   11  and  name HD1#   )(resid    121 and  name HD#  ) 0.0 0.0 6.5
! residue  13 THR
assign (resid   13  and  name HG2#   )(resid    82 and  name HA  ) 0.0 0.0 4.5
assign (resid   13  and  name HG2#   )(resid   82  and  name HB1  ) 0.0 0.0 4.5
assign (resid   13  and  name HG2#   )(resid    82 and  name HB2  ) 0.0 0.0 4.5
assign (resid   13  and  name HG2#   )(resid    85 and  name HD#  ) 0.0 0.0 5.5
assign (resid   13  and  name HG2#   )(resid    85 and  name HA ) 0.0 0.0 4.5
assign (resid   13  and  name HG2#   )(resid    86 and  name HD1# ) 0.0 0.0 6.0
assign (resid   13  and  name HG2#   )(resid    86 and  name HD2# ) 0.0 0.0 6.0
assign (resid   13  and  name HB   )(resid    86 and  name HD1# ) 0.0 0.0 6.5
assign (resid   13  and  name HB   )(resid    86 and  name HD2# ) 0.0 0.0 6.5
assign (resid   13  and  name HA   )(resid    86 and  name HD## ) 0.0 0.0 7.9
assign (resid   13  and  name HG2#   )(resid    86 and  name HA ) 0.0 0.0 6.5
! residue  14 LEU
assign (resid   14  and  name HD1#   )(resid    117 and  name HA  ) 0.0 0.0 4.5
assign (resid   14  and  name HD##   )(resid    120 and  name HG1  ) 0.0 0.0 5.9
assign (resid   14  and  name HD##   )(resid    120 and  name HG2  ) 0.0 0.0 5.9
assign (resid   14  and  name HD##   )(resid    116 and  name HD##  ) 0.0 0.0 8.8
assign (resid   14  and  name HD1#   )(resid    86 and  name HD## ) 0.0 0.0 7.4
assign (resid   14  and  name HD##   )(resid   93  and  name HD1#  ) 0.0 0.0 7.4
assign (resid   14  and  name HD##   )(resid    93 and  name HD2#  ) 0.0 0.0 7.4
assign (resid   14  and  name HD2#   )(resid    117 and  name HA  ) 0.0 0.0 4.5
assign (resid   14  and  name HD2#   )(resid   86  and  name HD##  ) 0.0 0.0 7.4
assign (resid   14  and  name HG   )(resid   86  and  name HD##  ) 0.0 0.0 7.9
assign (resid   14  and  name HD1#   )(resid   113  and  name HD##  ) 0.0 0.0 7.4
assign (resid   14  and  name HD2#   )(resid   113  and  name HD##  ) 0.0 0.0 7.4
! residue  17 LEU
assign (resid    17 and  name HD1#   )(resid   82  and  name HA  ) 0.0 0.0 4.5
assign (resid    17 and  name HD1#   )(resid   82  and  name HB#  ) 0.0 0.0 5.5
assign (resid    17 and  name HD2#   )(resid   82  and  name HA  ) 0.0 0.0 4.5
assign (resid    17 and  name HD2#   )(resid   82  and  name HB#  ) 0.0 0.0 5.5
! residue  18 THR
assign (resid    18 and  name HG2#   )(resid    110 and  name HA  ) 0.0 0.0 4.5
assign (resid    18 and  name HG2#   )(resid   113  and  name HD1#  ) 0.0 0.0 6.0
assign (resid    18 and  name HG2#   )(resid    113 and  name HD2#  ) 0.0 0.0 6.0
assign (resid    18 and  name HG2#   )(resid    113 and  name HG  ) 0.0 0.0 4.5
assign (resid    18 and  name HB    )(resid    110 and  name HA  ) 0.0 0.0 5.0
assign (resid    18 and  name HG2#   )(resid    114 and  name HA  ) 0.0 0.0 4.5
assign (resid    18 and  name HG2#   )(resid    114 and  name HG#  ) 0.0 0.0 5.5
! residue  22 THR
assign (resid   22  and  name HG2#   )(resid    79 and  name HD1#  ) 0.0 0.0 6.0
assign (resid   22  and  name HG2#   )(resid    79 and  name HD2#  ) 0.0 0.0 6.0
assign (resid   22  and  name HG2#   )(resid   75  and  name HD#  ) 0.0 0.0 5.5
! residue  25 THR
assign (resid   25  and  name HG2#   )(resid   109  and  name HD1#  ) 0.0 0.0 6.0
assign (resid   25  and  name HG2#   )(resid    109 and  name HD2#  ) 0.0 0.0 6.0
assign (resid   25  and  name HA   )(resid   109  and  name HD1#  ) 0.0 0.0 6.5
assign (resid   25  and  name HA   )(resid    109 and  name HD2#  ) 0.0 0.0 6.5
assign (resid   25  and  name HB   )(resid    109 and  name HD##  ) 0.0 0.0 7.9
assign (resid   25  and  name HG2#   )(resid   79  and  name HD1#  ) 0.0 0.0 6.0
assign (resid   25  and  name HG2#   )(resid   79  and  name HD2#  ) 0.0 0.0 6.0
assign (resid   25  and  name HG2#   )(resid   113  and  name HD1#  ) 0.0 0.0 6.0
assign (resid   25  and  name HG2#   )(resid   113  and  name HD2#  ) 0.0 0.0 6.0
assign (resid   25  and  name HG2#   )(resid   109  and  name HA  ) 0.0 0.0 4.5
assign (resid   25  and  name HG2#   )(resid    109 and  name HB#  ) 0.0 0.0 5.5
assign (resid   25  and  name HA   )(resid   109  and  name HA  ) 0.0 0.0 5.0
assign (resid   25  and  name HA   )(resid   109  and  name HB1  ) 0.0 0.0 3.0
assign (resid   25  and  name HA   )(resid   109  and  name HB2  ) 0.0 0.0 3.0
assign (resid   25  and  name HB   )(resid   109  and  name HA  ) 0.0 0.0 5.0
assign (resid   25  and  name HB   )(resid   109  and  name HB#  ) 0.0 0.0 6.0
assign (resid   25  and  name HB   )(resid   110  and  name HB#  ) 0.0 0.0 6.0
assign (resid   25  and  name HB   )(resid   110  and  name HG#  ) 0.0 0.0 6.0
! residue  26 GLU
assign (resid   26  and  name HA   )(resid    108 and  name HG2#  ) 0.0 0.0 4.5
assign (resid   26  and  name HB#   )(resid    108 and  name HG2#  ) 0.0 0.0 5.5
assign (resid   26  and  name HG#   )(resid    108 and  name HG2#  ) 0.0 0.0 5.5
assign (resid   26  and  name HA   )(resid    108 and  name HA  ) 0.0 0.0 3.0
! residue  28 THR
assign (resid   28  and  name HG2#   )(resid   107  and  name HA  ) 0.0 0.0 6.5
assign (resid   28  and  name HG2#   )(resid   108  and  name HB  ) 0.0 0.0 6.5
assign (resid   28  and  name HG2#   )(resid   108  and  name HA  ) 0.0 0.0 4.5
assign (resid   28  and  name HG2#   )(resid   106  and  name HG#  ) 0.0 0.0 5.5
assign (resid   28  and  name HG2#   )(resid   106  and  name HB#  ) 0.0 0.0 5.5
assign (resid   28  and  name HG2#   )(resid   108  and  name HG2#  ) 0.0 0.0 6.0
assign (resid   28  and  name HA   )(resid   108  and  name HG2#  ) 0.0 0.0 4.5
assign (resid   28  and  name HB   )(resid   108  and  name HG2#  ) 0.0 0.0 4.5
assign (resid   28  and  name HA   )(resid   108  and  name HB ) 0.0 0.0 5.0
assign (resid   28  and  name HA   )(resid   108  and  name HA ) 0.0 0.0 3.0
assign (resid   28  and  name HB   )(resid   106  and  name HB# ) 0.0 0.0 4.0
assign (resid   28  and  name HB   )(resid   106  and  name HG# ) 0.0 0.0 6.0
assign (resid   28  and  name HB   )(resid   108  and  name HA ) 0.0 0.0 5.0
! residue  29 VAL
assign (resid   29  and  name HG##   )(resid    112 and  name HA  ) 0.0 0.0 7.9
assign (resid   29  and  name HG##   )(resid    112 and  name HB1  ) 0.0 0.0 5.9
assign (resid   29  and  name HG##   )(resid    112 and  name HB2  ) 0.0 0.0 5.9
assign (resid   29  and  name HG##   )(resid    107 and  name HB1  ) 0.0 0.0 7.9
assign (resid   29  and  name HG##   )(resid    107 and  name HB2  ) 0.0 0.0 7.9
assign (resid   29  and  name HG##   )(resid    51 and  name HB  ) 0.0 0.0 7.9
assign (resid   29  and  name HG##   )(resid    51 and  name HG1#  ) 0.0 0.0 9.4
assign (resid   29  and  name HG##   )(resid    51 and  name HG2#  ) 0.0 0.0 9.4
assign (resid   29  and  name HG##   )(resid    52 and  name HD##  ) 0.0 0.0 10.8
assign (resid   29  and  name HG##   )(resid    109 and  name HD##  ) 0.0 0.0 8.8
assign (resid   29  and  name HA   )(resid    51 and  name HG##  ) 0.0 0.0 7.9
assign (resid   29  and  name HB   )(resid    51 and  name HG##  ) 0.0 0.0 7.9
! residue  30 THR
assign (resid    30 and  name HG2#   )(resid    106 and  name HA  ) 0.0 0.0 6.5
assign (resid    30 and  name HG2#   )(resid    104 and  name HA  ) 0.0 0.0 6.5
assign (resid    30 and  name HG2#   )(resid    104 and  name HB#  ) 0.0 0.0 6.0
assign (resid    30 and  name HG2#   )(resid    103 and  name HA  ) 0.0 0.0 4.5
assign (resid    30 and  name HG2#   )(resid    103 and  name HB#  ) 0.0 0.0 5.5
assign (resid    30 and  name HG2#   )(resid    101 and  name HG##  ) 0.0 0.0 9.4
assign (resid    30 and  name HB   )(resid    101 and  name HG##  ) 0.0 0.0 5.9
assign (resid    30 and  name HA   )(resid    106 and  name HA  ) 0.0 0.0 3.0
assign (resid    30 and  name HA   )(resid    106 and  name HB#  ) 0.0 0.0 6.0
assign (resid    30 and  name HA   )(resid    106 and  name HG#  ) 0.0 0.0 4.0
! residue  31 ASP
assign (resid   31  and  name HB#   )(resid   107  and  name HA ) 0.0 0.0 4.0
assign (resid   31  and  name HB#   )(resid   107  and  name HB1 ) 0.0 0.0 6.0
assign (resid   31  and  name HB#   )(resid   107  and  name HB2 ) 0.0 0.0 6.0
! residue  32 ILE
assign (resid   32  and  name HD1#   )(resid    48 and  name HA  ) 0.0 0.0 4.5
assign (resid   32  and  name HD1#   )(resid    48 and  name HB#  ) 0.0 0.0 6.0
assign (resid   32  and  name HD1#   )(resid    44 and  name HA  ) 0.0 0.0 4.5
assign (resid   32  and  name HD1#   )(resid    44 and  name HG2#  ) 0.0 0.0 6.0
assign (resid   32  and  name HG1#   )(resid    44 and  name HG2#  ) 0.0 0.0 5.5
assign (resid   32  and  name HD1#   )(resid    51 and  name HG##  ) 0.0 0.0 9.4
assign (resid   32  and  name HG11  )(resid    51 and  name HG##  ) 0.0 0.0 7.9
assign (resid   32  and  name HG12  )(resid    51 and  name HG##  ) 0.0 0.0 7.9
assign (resid   32  and  name HG2#   )(resid    51 and  name HB  ) 0.0 0.0 4.5
assign (resid   32  and  name HG2#   )(resid    48 and  name HA ) 0.0 0.0 4.5
assign (resid   32  and  name HG2#   )(resid    104 and  name HB# ) 0.0 0.0 8.0
assign (resid   32  and  name HD1#   )(resid    104 and  name HB# ) 0.0 0.0 8.0
assign (resid   32  and  name HG1#   )(resid    48 and  name HA ) 0.0 0.0 6.0
! residue  33 PHE
assign (resid   33  and  name HA   )(resid    44 and  name HG2#  ) 0.0 0.0 6.5
assign (resid   33  and  name HB#   )(resid    44 and  name HG2#  ) 0.0 0.0 7.5
! residue  34 ALA
assign (resid   34  and  name HB#   )(resid   105  and  name HB#  ) 0.0 0.0 5.5
! residue  42 LYS
assign (resid   42  and  name HA   )(resid    94 and  name HB#  ) 0.0 0.0 4.5
assign (resid   42  and  name HB1#  )(resid    94 and  name HB#  ) 0.0 0.0 5.5
assign (resid   42  and  name HA   )(resid    94 and  name HA  ) 0.0 0.0 3.0
assign (resid   42  and  name HB#   )(resid    94 and  name HA  ) 0.0 0.0 4.0
! residue  43 GLU
assign (resid   43  and  name HA   )(resid   96  and  name HD1#  ) 0.0 0.0 4.5
assign (resid   43  and  name HA   )(resid   96  and  name HD2#  ) 0.0 0.0 4.5
assign (resid   43  and  name HG#   )(resid   96  and  name HD1#  ) 0.0 0.0 5.5
assign (resid   43  and  name HG#   )(resid   96  and  name HD2#  ) 0.0 0.0 5.5
! residue  45 PHE
assign (resid   45  and  name HA   )(resid   90  and  name HD##  ) 0.0 0.0 5.9
assign (resid   45  and  name HB#   )(resid  90   and  name HD##  ) 0.0 0.0 6.9
assign (resid   45  and  name HB1   )(resid    94 and  name HB#  ) 0.0 0.0 6.5
assign (resid   45  and  name HB2   )(resid    94 and  name HB#  ) 0.0 0.0 6.5
assign (resid   45  and  name HB#   )(resid    94 and  name HA  ) 0.0 0.0 6.0
! residue  46 CYS
assign (resid   46  and  name HB1   )(resid   96  and  name HD1#  ) 0.0 0.0 4.5
assign (resid   46  and  name HB2   )(resid   96  and  name HD1#  ) 0.0 0.0 4.5
assign (resid   46  and  name HB1   )(resid   96  and  name HD2#  ) 0.0 0.0 4.5
assign (resid   46  and  name HB2   )(resid   96  and  name HD2#  ) 0.0 0.0 4.5
! residue  47 ARG
assign (resid   47 and  name HA   )(resid    101 and  name HG##  ) 0.0 0.0 7.9
! residue  48 ALA
assign (resid  48   and  name HB#   )(resid   90  and  name HD1#  ) 0.0 0.0 6.0
assign (resid  48   and  name HB#   )(resid   90  and  name HD2#  ) 0.0 0.0 6.0
assign (resid  48   and  name HB#   )(resid   96  and  name HD##  ) 0.0 0.0 7.4
! residue  50 THR
assign (resid   50  and  name HG2#   )(resid   101  and  name HA  ) 0.0 0.0 6.5
assign (resid   50  and  name HG2#   )(resid    101 and  name HB  ) 0.0 0.0 4.5
assign (resid   50  and  name HG2#   )(resid    101 and  name HG1#  ) 0.0 0.0 7.0
assign (resid   50  and  name HG2#   )(resid    101 and  name HG2#  ) 0.0 0.0 7.0
assign (resid   50  and  name HB   )(resid    101 and  name HG1#  ) 0.0 0.0 6.5
assign (resid   50  and  name HB   )(resid    101 and  name HG2#  ) 0.0 0.0 6.5
assign (resid   50  and  name HG2#   )(resid    100 and  name HA  ) 0.0 0.0 4.5
! residue  52 LEU
assign (resid   52  and  name HD##   )(resid    83 and  name HD1#  ) 0.0 0.0 7.4
assign (resid   52  and  name HD##   )(resid    83 and  name HD2#  ) 0.0 0.0 7.4
assign (resid   52  and  name HD##   )(resid    109 and  name HD##  ) 0.0 0.0 8.8
! residue  56 TYR 
assign (resid   56  and  name HA   )(resid    80 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   56  and  name HB1   )(resid    80 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   56  and  name HB2   )(resid    80 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   56  and  name HA   )(resid    80 and  name HG2#  ) 0.0 0.0 4.5
assign (resid   56  and  name HB1   )(resid    80 and  name HG2#  ) 0.0 0.0 4.5
assign (resid   56  and  name HB2   )(resid    80 and  name HG2#  ) 0.0 0.0 4.5
assign (resid   56  and  name HA   )(resid    83 and  name HD##  ) 0.0 0.0 5.9
assign (resid   56  and  name HB1   )(resid    83 and  name HD##  ) 0.0 0.0 5.9
assign (resid   56  and  name HB2   )(resid    83 and  name HD##  ) 0.0 0.0 5.9
assign (resid   56  and  name HA   )(resid    83 and  name HG  ) 0.0 0.0 5.0
assign (resid   56  and  name HA   )(resid    80 and  name HG1#  ) 0.0 0.0 6.0
assign (resid   56  and  name HB#   )(resid    80 and  name HG1#  ) 0.0 0.0 7.0
! residue  60 GLU
assign (resid   60  and  name HA   )(resid    80 and  name HD1#  ) 0.0 0.0 4.5
assign (resid   60  and  name HG#   )(resid    80 and  name HD1#  ) 0.0 0.0 5.5
assign (resid   60  and  name HA   )(resid    80 and  name HG2#  ) 0.0 0.0 4.5
assign (resid   60  and  name HG#   )(resid    80 and  name HG2#  ) 0.0 0.0 5.5
assign (resid   60  and  name HA   )(resid    80 and  name HG1#  ) 0.0 0.0 6.0
! residue  66 LEU
assign (resid   66  and  name HD##   )(resid    73 and  name HA  ) 0.0 0.0 5.9
assign (resid   66  and  name HD##   )(resid    73 and  name HB1  ) 0.0 0.0 7.9
assign (resid   66  and  name HD##   )(resid    73 and  name HB2  ) 0.0 0.0 7.9
! residue  83 LEU
assign (resid   83  and  name HD1#   )(resid   109  and  name HD1#  ) 0.0 0.0 6.0
assign (resid   83  and  name HD1#   )(resid    109 and  name HD2#  ) 0.0 0.0 6.0
assign (resid   83  and  name HD2#   )(resid   109  and  name HD1#  ) 0.0 0.0 6.0
assign (resid   83  and  name HD2#   )(resid    109 and  name HD2#  ) 0.0 0.0 6.0
assign (resid   83  and  name HG   )(resid    109 and  name HD##  ) 0.0 0.0 7.9
! residue  86 LEU
assign (resid   86  and  name HD##   )(resid    117 and  name HA ) 0.0 0.0 7.9
! residue  90 LEU
assign (resid   90  and  name HD##   )(resid    120 and  name HE#  ) 0.0 0.0 8.0
! residue  93 LEU
assign (resid   93  and  name HD1#   )(resid    120 and  name HE#  ) 0.0 0.0 6.0
assign (resid   93  and  name HD2#   )(resid    120 and  name HE#  ) 0.0 0.0 6.0
!
! Long range NOE's involving aromatics
!
assign (resid   45  and  name HD#   )(resid    94 and  name HB#  ) 0.0 0.0 8.5
assign (resid   45  and  name HD#   )(resid    90 and  name HD##  ) 0.0 0.0 9.9
assign (resid  124  and  name HD#   )(resid    7 and  name HD1#  ) 0.0 0.0 8.5
assign (resid  124  and  name HD#   )(resid    7 and  name HD2#  ) 0.0 0.0 8.5
assign (resid  56  and  name HD#   )(resid    80 and  name HG2#  ) 0.0 0.0 8.5
assign (resid  56  and  name HD#   )(resid    80 and  name HG1#  ) 0.0 0.0 8.0
assign (resid  33  and  name HD#   )(resid    44 and  name HG2#  ) 0.0 0.0 8.5
assign (resid  33  and  name HE#   )(resid    44 and  name HG2#  ) 0.0 0.0 8.5
assign (resid  82  and  name HD#   )(resid    13 and  name HG2#  ) 0.0 0.0 8.5
assign (resid  82  and  name HE#   )(resid    13 and  name HG2#  ) 0.0 0.0 8.5
assign (resid  33  and  name HD#   )(resid    116 and  name HD##  ) 0.0 0.0 9.9
assign (resid  33  and  name HE#   )(resid    116 and  name HD##  ) 0.0 0.0 9.9
assign (resid  73  and  name HD#   )(resid    66 and  name HD##  ) 0.0 0.0 9.9
assign (resid  73  and  name HE#   )(resid    66 and  name HD##  ) 0.0 0.0 9.9
!
!* H-bonds in helix A.
!
assign (resid  10    and name HN   ) (resid   6    and name O    )  1.8 0.0 0.2
assign (resid  10    and name N    ) (resid   6    and name O    )  2.8 0.1 0.2
assign (resid  11    and name HN   ) (resid   7    and name O    )  1.8 0.0 0.2
assign (resid  11    and name N    ) (resid   7    and name O    )  2.8 0.1 0.2
assign (resid  13    and name HN   ) (resid   9    and name O    )  1.8 0.0 0.2
assign (resid  13    and name N    ) (resid   9    and name O    )  2.8 0.1 0.2
assign (resid  14    and name HN   ) (resid  10    and name O    )  1.8 0.0 0.2
assign (resid  14    and name N    ) (resid  10    and name O    )  2.8 0.1 0.2
assign (resid  15    and name HN   ) (resid  11    and name O    )  1.8 0.0 0.2
assign (resid  15    and name N    ) (resid  11    and name O    )  2.8 0.1 0.2
!
!* H-bonds in helix B.
!
assign (resid  45    and name HN   ) (resid  41    and name O    )  1.8 0.0 0.2
assign (resid  45    and name N    ) (resid  41    and name O    )  2.8 0.1 0.2
assign (resid  46    and name HN   ) (resid  42    and name O    )  1.8 0.0 0.2
assign (resid  46    and name N    ) (resid  42    and name O    )  2.8 0.1 0.2
assign (resid  47    and name HN   ) (resid  43    and name O    )  1.8 0.0 0.2
assign (resid  47    and name N    ) (resid  43    and name O    )  2.8 0.1 0.2
assign (resid  48    and name HN   ) (resid  44    and name O    )  1.8 0.0 0.2
assign (resid  48    and name N    ) (resid  44    and name O    )  2.8 0.1 0.2
assign (resid  49    and name HN   ) (resid  45    and name O    )  1.8 0.0 0.2
assign (resid  49    and name N    ) (resid  45    and name O    )  2.8 0.1 0.2
assign (resid  51    and name HN   ) (resid  47    and name O    )  1.8 0.0 0.2
assign (resid  51    and name N    ) (resid  47    and name O    )  2.8 0.1 0.2
assign (resid  52    and name HN   ) (resid  48    and name O    )  1.8 0.0 0.2
assign (resid  52    and name N    ) (resid  48    and name O    )  2.8 0.1 0.2
assign (resid  55    and name HN   ) (resid  51    and name O    )  1.8 0.0 0.2
assign (resid  55    and name N    ) (resid  51    and name O    )  2.8 0.1 0.2
assign (resid  56    and name HN   ) (resid  52    and name O    )  1.8 0.0 0.2
assign (resid  56    and name N    ) (resid  52    and name O    )  2.8 0.1 0.2
assign (resid  57    and name HN   ) (resid  53    and name O    )  1.8 0.0 0.2
assign (resid  57    and name N    ) (resid  53    and name O    )  2.8 0.1 0.2
!
!* H-bonds in helix C.
!
assign (resid  83    and name HN   ) (resid  79    and name O    )  1.8 0.0 0.2
assign (resid  83    and name N    ) (resid  79    and name O    )  2.8 0.1 0.2
assign (resid  84    and name HN   ) (resid  80    and name O    )  1.8 0.0 0.2
assign (resid  84    and name N    ) (resid  80    and name O    )  2.8 0.1 0.2
assign (resid  85    and name HN   ) (resid  81    and name O    )  1.8 0.0 0.2
assign (resid  85    and name N    ) (resid  81    and name O    )  2.8 0.1 0.2
assign (resid  86    and name HN   ) (resid  82    and name O    )  1.8 0.0 0.2
assign (resid  86    and name N    ) (resid  82    and name O    )  2.8 0.1 0.2
!
!* H-bonds in helix D.
!
assign (resid 114    and name HN   ) (resid 110    and name O    )  1.8 0.0 0.2
assign (resid 114    and name N    ) (resid 110    and name O    )  2.8 0.1 0.2
assign (resid 115    and name HN   ) (resid 111    and name O    )  1.8 0.0 0.2
assign (resid 115    and name N    ) (resid 111    and name O    )  2.8 0.1 0.2
assign (resid 116    and name HN   ) (resid 112    and name O    )  1.8 0.0 0.2
assign (resid 116    and name N    ) (resid 112    and name O    )  2.8 0.1 0.2
assign (resid 117    and name HN   ) (resid 113    and name O    )  1.8 0.0 0.2
assign (resid 117    and name N    ) (resid 113    and name O    )  2.8 0.1 0.2
assign (resid 118    and name HN   ) (resid 114    and name O    )  1.8 0.0 0.2
assign (resid 118    and name N    ) (resid 114    and name O    )  2.8 0.1 0.2
assign (resid 119    and name HN   ) (resid 115    and name O    )  1.8 0.0 0.2
assign (resid 119    and name N    ) (resid 115    and name O    )  2.8 0.1 0.2
assign (resid 120    and name HN   ) (resid 116    and name O    )  1.8 0.0 0.2
assign (resid 120    and name N    ) (resid 116    and name O    )  2.8 0.1 0.2
assign (resid 121    and name HN   ) (resid 117    and name O    )  1.8 0.0 0.2
assign (resid 121    and name N    ) (resid 117    and name O    )  2.8 0.1 0.2
!
! phi angle restraints
! helical residues
! Helix A
 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  -60.0   30.0  2
 assign (resid  15 and name c )   (resid   16 and name n ) 
        (resid  16 and name ca)   (resid   16 and name c )  1  -60.0   30.0  2
 assign (resid  16 and name c )   (resid   17 and name n ) 
        (resid  17 and name ca)   (resid   17 and name c )  1  -60.0   30.0  2
! Helix B 
 assign (resid   40 and name c )   (resid   41 and name n ) 
        (resid   41 and name ca)   (resid   41 and name c )  1  -60.0   30.0  2
 assign (resid   41 and name c )   (resid   42 and name n ) 
        (resid   42 and name ca)   (resid   42 and name c )  1  -60.0   30.0  2
 assign (resid   42 and name c )   (resid   43 and name n ) 
        (resid   43 and name ca)   (resid   43 and name c )  1  -60.0   30.0  2
 assign (resid   43 and name c )   (resid   44 and name n ) 
        (resid   44 and name ca)   (resid   44 and name c )  1  -60.0   30.0  2
 assign (resid   44 and name c )   (resid   45 and name n ) 
        (resid   45 and name ca)   (resid   45 and name c )  1  -60.0   30.0  2
 assign (resid   45 and name c )   (resid   46 and name n ) 
        (resid   46 and name ca)   (resid   46 and name c )  1  -60.0   30.0  2
 assign (resid   46 and name c )   (resid   47 and name n ) 
        (resid   47 and name ca)   (resid   47 and name c )  1  -60.0   30.0  2
 assign (resid   47 and name c )   (resid   48 and name n ) 
        (resid   48 and name ca)   (resid   48 and name c )  1  -60.0   30.0  2
 assign (resid   48 and name c )   (resid   49 and name n ) 
        (resid   49 and name ca)   (resid   49 and name c )  1  -60.0   30.0  2
 assign (resid   49 and name c )   (resid   50 and name n ) 
        (resid   50 and name ca)   (resid   50 and name c )  1  -60.0   30.0  2
 assign (resid   50 and name c )   (resid   51 and name n ) 
        (resid   51 and name ca)   (resid   51 and name c )  1  -60.0   30.0  2
 assign (resid   51 and name c )   (resid   52 and name n ) 
        (resid   52 and name ca)   (resid   52 and name c )  1  -60.0   30.0  2
 assign (resid   53 and name c )   (resid   54 and name n ) 
        (resid   54 and name ca)   (resid   54 and name c )  1  -60.0   30.0  2
 assign (resid   54 and name c )   (resid   55 and name n ) 
        (resid   55 and name ca)   (resid   55 and name c )  1  -60.0   30.0  2
 assign (resid   55 and name c )   (resid   56 and name n ) 
        (resid   56 and name ca)   (resid   56 and name c )  1  -60.0   30.0  2
 assign (resid   56 and name c )   (resid   57 and name n ) 
        (resid   57 and name ca)   (resid   57 and name c )  1  -60.0   30.0  2
! Helix C 
 assign (resid   71 and name c )   (resid   72 and name n ) 
        (resid   72 and name ca)   (resid   72 and name c )  1  -60.0   30.0  2
 assign (resid   72 and name c )   (resid   73 and name n ) 
        (resid   73 and name ca)   (resid   73 and name c )  1  -60.0   30.0  2
 assign (resid   73 and name c )   (resid   74 and name n ) 
        (resid   74 and name ca)   (resid   74 and name c )  1  -60.0   30.0  2
 assign (resid   74 and name c )   (resid   75 and name n ) 
        (resid   75 and name ca)   (resid   75 and name c )  1  -60.0   30.0  2
 assign (resid   75 and name c )   (resid   76 and name n ) 
        (resid   76 and name ca)   (resid   76 and name c )  1  -60.0   30.0  2
 assign (resid   76 and name c )   (resid   77 and name n ) 
        (resid   77 and name ca)   (resid   77 and name c )  1  -60.0   30.0  2
 assign (resid   77 and name c )   (resid   78 and name n ) 
        (resid   78 and name ca)   (resid   78 and name c )  1  -60.0   30.0  2
 assign (resid   78 and name c )   (resid   79 and name n ) 
        (resid   79 and name ca)   (resid   79 and name c )  1  -60.0   30.0  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   81 and name c )   (resid   82 and name n ) 
        (resid   82 and name ca)   (resid   82 and name c )  1  -60.0   30.0  2
 assign (resid   82 and name c )   (resid   83 and name n ) 
        (resid   83 and name ca)   (resid   83 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  -60.0   30.0  2
 assign (resid   84 and name c )   (resid   85 and name n ) 
        (resid   85 and name ca)   (resid   85 and name c )  1  -60.0   30.0  2
 assign (resid   85 and name c )   (resid   86 and name n ) 
        (resid   86 and name ca)   (resid   86 and name c )  1  -60.0   30.0  2
 assign (resid   86 and name c )   (resid   87 and name n ) 
        (resid   87 and name ca)   (resid   87 and name c )  1  -60.0   30.0  2
 assign (resid   87 and name c )   (resid   88 and name n ) 
        (resid   88 and name ca)   (resid   88 and name c )  1  -60.0   30.0  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
! Helix D
 assign (resid 109 and name c )   (resid   110 and name n ) 
        (resid 110 and name ca)   (resid   110 and name c )  1  -60.0   30.0  2
 assign (resid 110 and name c )   (resid   111 and name n ) 
        (resid 111 and name ca)   (resid   111 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 112 and name c )   (resid   113 and name n ) 
        (resid 113 and name ca)   (resid   113 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  -60.0   30.0  2
 assign (resid 114 and name c )   (resid   115 and name n ) 
        (resid 115 and name ca)   (resid   115 and name c )  1  -60.0   30.0  2
 assign (resid 115 and name c )   (resid   116 and name n ) 
        (resid 116 and name ca)   (resid   116 and name c )  1  -60.0   30.0  2
 assign (resid 116 and name c )   (resid   117 and name n ) 
        (resid 117 and name ca)   (resid   117 and name c )  1  -60.0   30.0  2
 assign (resid 117 and name c )   (resid   118 and name n ) 
        (resid 118 and name ca)   (resid   118 and name c )  1  -60.0   30.0  2
 assign (resid 118 and name c )   (resid   119 and name n ) 
        (resid 119 and name ca)   (resid   119 and name c )  1  -60.0   30.0  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 122 and name c )   (resid   123 and name n ) 
        (resid 123 and name ca)   (resid   123 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  -60.0   30.0  2
 assign (resid 124 and name c )   (resid   125 and name n ) 
        (resid 125 and name ca)   (resid   125 and name c )  1  -60.0   30.0  2
! Extended chain/ B sheet like       
 assign (resid   19 and name c )   (resid   20 and name n ) 
        (resid   20 and name ca)   (resid   20 and name c )  1 -120.0   40.0  2
 assign (resid   21 and name c )   (resid   22 and name n ) 
        (resid   22 and name ca)   (resid   22 and name c )  1 -120.0   40.0  2
 assign (resid   28 and name c )   (resid   29 and name n ) 
        (resid   29 and name ca)   (resid   29 and name c )  1 -120.0   40.0  2
 assign (resid   58 and name c )   (resid   59 and name n ) 
        (resid   59 and name ca)   (resid   59 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   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   95 and name c )   (resid   96 and name n ) 
        (resid   96 and name ca)   (resid   96 and name c )  1 -120.0   40.0  2
 assign (resid 101 and name c )   (resid   102 and name n ) 
        (resid 102 and name ca)   (resid   102 and name c )  1 -120.0   40.0  2
! Values < 7 but not helix.
 assign (resid   3 and name c )   (resid   4 and name n ) 
        (resid   4 and name ca)   (resid   4 and name c )  1  60.0   150.0  2
 assign (resid    2 and name c )   (resid   3 and name n ) 
        (resid    3 and name ca)   (resid   3 and name c )  1 60.0   150.0  2
 assign (resid   18 and name c )   (resid   19 and name n ) 
        (resid   19 and name ca)   (resid   19 and name c )  1 60.0   150.0  2
 assign (resid   20 and name c )   (resid   21 and name n ) 
        (resid   21 and name ca)   (resid   21 and name c )  1 60.0   150.0  2
 assign (resid   24 and name c )   (resid   25 and name n ) 
        (resid   25 and name ca)   (resid   25 and name c )  1 60.0   150.0  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   150.0  2
 assign (resid   27 and name c )   (resid   28 and name n ) 
        (resid   28 and name ca)   (resid   28 and name c )  1 60.0   150.0  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   150.0  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   150.0  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   150.0  2
 assign (resid   33 and name c )   (resid   34 and name n ) 
        (resid   34 and name ca)   (resid   34 and name c )  1 60.0   150.0  2
 assign (resid   34 and name c )   (resid   35 and name n ) 
        (resid   35 and name ca)   (resid   35 and name c )  1 60.0   150.0  2 
 assign (resid   35 and name c )   (resid   36 and name n ) 
        (resid   36 and name ca)   (resid   36 and name c )  1 60.0   150.0  2
 assign (resid   36 and name c )   (resid   37 and name n ) 
        (resid   37 and name ca)   (resid   37 and name c )  1 60.0   150.0  2
 assign (resid   59 and name c )   (resid   60 and name n ) 
        (resid   60 and name ca)   (resid   60 and name c )  1 60.0   150.0  2
 assign (resid   61 and name c )   (resid   62 and name n ) 
        (resid   62 and name ca)   (resid   62 and name c )  1 60.0   150.0  2
 assign (resid   62 and name c )   (resid   63 and name n ) 
        (resid   63 and name ca)   (resid   63 and name c )  1 60.0   150.0  2
 assign (resid   65 and name c )   (resid   66 and name n ) 
        (resid   66 and name ca)   (resid   66 and name c )  1 60.0   150.0  2
 assign (resid   69 and name c )   (resid   70 and name n ) 
        (resid   70 and name ca)   (resid   70 and name c )  1 60.0   150.0  2
 assign (resid   70 and name c )   (resid   71 and name n ) 
        (resid   71 and name ca)   (resid   71 and name c )  1 60.0   150.0  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   150.0  2
 assign (resid   96 and name c )   (resid   97 and name n ) 
        (resid   97 and name ca)   (resid   97 and name c )  1 60.0   150.0  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   150.0  2
 assign (resid   98 and name c )   (resid   99 and name n ) 
        (resid   99 and name ca)   (resid   99 and name c )  1 60.0   150.0  2
 assign (resid  102 and name c )   (resid  103 and name n ) 
        (resid  103 and name ca)   (resid  103 and name c )  1 60.0   150.0  2
 assign (resid  104 and name c )   (resid  105 and name n ) 
        (resid  105 and name ca)   (resid  105 and name c )  1 60.0   150.0  2
 assign (resid  107 and name c )   (resid  108 and name n ) 
        (resid  108 and name ca)   (resid  108 and name c )  1 60.0   150.0  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  150.0  2


------- End of Forwarded Message

  Entry H atom name         Orig H atom name
 Raw file had *** H/Q atoms
    1   1H    MET   0           HT2      MET   0  12.894 -14.198   9.969
    2   2H    MET   0           HT3      MET   0  14.184 -14.356  11.047
    3   3H    MET   0           HT1      MET   0  12.590 -14.458  11.618
    4    HA   MET   0           HA       MET   0  12.567 -12.312  12.008
    5   1HB   MET   0           HB1      MET   0  15.326 -12.491  10.748
    6   2HB   MET   0           HB2      MET   0  14.721 -10.971  11.383
    7   1HG   MET   0           HG1      MET   0  14.373 -12.006  13.579
    8   2HG   MET   0           HG2      MET   0  14.864 -13.558  12.960
    9   1HE   MET   0           HE1      MET   0  15.894 -13.125  15.506
   10   2HE   MET   0           HE3      MET   0  16.647 -14.362  14.474
   11   3HE   MET   0           HE2      MET   0  17.641 -13.244  15.399
   12    H    HIS   1           HN       HIS   1  14.289 -12.195   8.861
   13    HA   HIS   1           HA       HIS   1  11.929 -11.412   7.471
   14   1HB   HIS   1           HB1      HIS   1  13.139  -9.322   9.031
   15   2HB   HIS   1           HB2      HIS   1  13.721  -9.011   7.419
   16    HD1  HIS   1           HD1      HIS   1  10.291 -10.340   7.575
   17    HD2  HIS   1           HD2      HIS   1  12.090  -6.673   7.474
   18    HE1  HIS   1           HE1      HIS   1   8.523  -8.708   7.045
   19    H    LYS   2           HN       LYS   2  14.567 -12.837   7.315
   20    HA   LYS   2           HA       LYS   2  14.697 -12.745   4.412
   21   1HB   LYS   2           HB1      LYS   2  15.876 -10.569   5.112
   22   2HB   LYS   2           HB2      LYS   2  17.113 -11.561   5.835
   23   1HG   LYS   2           HG1      LYS   2  17.722 -12.488   3.619
   24   2HG   LYS   2           HG2      LYS   2  16.364 -11.675   2.889
   25   1HD   LYS   2           HD1      LYS   2  17.365  -9.483   3.700
   26   2HD   LYS   2           HD2      LYS   2  18.753 -10.380   4.271
   27   1HE   LYS   2           HE1      LYS   2  19.288 -11.096   1.938
   28   2HE   LYS   2           HE2      LYS   2  17.848 -10.320   1.365
   29   1HZ   LYS   2           HZ2      LYS   2  19.237  -8.427   2.833
   30   2HZ   LYS   2           HZ3      LYS   2  20.357  -9.188   1.803
   31   3HZ   LYS   2           HZ1      LYS   2  18.956  -8.473   1.163
   32    H    CYS   3           HN       CYS   3  14.459 -15.058   5.849
   33    HA   CYS   3           HA       CYS   3  16.477 -16.624   6.727
   34   1HB   CYS   3           HB2      CYS   3  14.353 -17.248   4.680
   35   2HB   CYS   3           HB1      CYS   3  15.420 -18.503   5.259
   36    H    ASP   4           HN       ASP   4  15.998 -17.312   3.433
   37    HA   ASP   4           HA       ASP   4  18.916 -17.426   2.949
   38   1HB   ASP   4           HB2      ASP   4  17.275 -19.345   2.357
   39   2HB   ASP   4           HB1      ASP   4  16.754 -18.365   1.012
   40    H    ILE   5           HN       ILE   5  19.662 -15.531   2.502
   41    HA   ILE   5           HA       ILE   5  18.823 -13.177   1.610
   42    HB   ILE   5           HB       ILE   5  21.286 -14.695   0.689
   43   1HG1  ILE   5          HG12      ILE   5  21.178 -14.536   3.097
   44   2HG1  ILE   5          HG11      ILE   5  22.506 -13.586   2.486
   45   1HG2  ILE   5          HG22      ILE   5  20.881 -11.675   0.490
   46   2HG2  ILE   5          HG21      ILE   5  22.390 -12.523   0.200
   47   3HG2  ILE   5          HG23      ILE   5  21.020 -12.803  -0.846
   48   1HD1  ILE   5          HD12      ILE   5  21.126 -11.519   2.774
   49   2HD1  ILE   5          HD11      ILE   5  19.810 -12.512   3.394
   50   3HD1  ILE   5          HD13      ILE   5  21.307 -12.394   4.283
   51    H    THR   6           HN       THR   6  19.464 -15.807  -0.597
   52    HA   THR   6           HA       THR   6  19.197 -14.643  -3.111
   53    HB   THR   6           HB       THR   6  17.986 -17.379  -2.383
   54    HG1  THR   6           HG1      THR   6  19.931 -17.479  -1.627
   55   1HG2  THR   6          HG22      THR   6  17.837 -16.549  -4.827
   56   2HG2  THR   6          HG21      THR   6  19.581 -16.407  -4.820
   57   3HG2  THR   6          HG23      THR   6  18.832 -17.978  -4.619
   58    H    LEU   7           HN       LEU   7  16.700 -15.851  -1.069
   59    HA   LEU   7           HA       LEU   7  14.368 -15.521  -2.529
   60   1HB   LEU   7           HB2      LEU   7  14.788 -14.902   0.397
   61   2HB   LEU   7           HB1      LEU   7  13.232 -15.059  -0.358
   62    HG   LEU   7           HG       LEU   7  14.600 -16.886   0.907
   63   1HD1  LEU   7          HD13      LEU   7  12.104 -17.017   0.231
   64   2HD1  LEU   7          HD12      LEU   7  12.579 -17.343  -1.427
   65   3HD1  LEU   7          HD11      LEU   7  12.839 -18.555  -0.189
   66   1HD2  LEU   7          HD21      LEU   7  15.115 -17.581  -2.026
   67   2HD2  LEU   7          HD23      LEU   7  16.307 -17.465  -0.763
   68   3HD2  LEU   7          HD22      LEU   7  15.158 -18.777  -0.750
   69    H    GLN   8           HN       GLN   8  15.395 -13.293  -0.090
   70    HA   GLN   8           HA       GLN   8  13.720 -11.142  -0.602
   71   1HB   GLN   8           HB2      GLN   8  15.858 -11.213   1.002
   72   2HB   GLN   8           HB1      GLN   8  16.682 -10.428  -0.342
   73   1HG   GLN   8           HG2      GLN   8  14.422  -8.932  -0.401
   74   2HG   GLN   8           HG1      GLN   8  14.296  -9.524   1.232
   75   1HE2  GLN   8          HE22      GLN   8  16.429  -6.279   0.517
   76   2HE2  GLN   8          HE21      GLN   8  15.274  -6.944  -0.526
   77    H    GLU   9           HN       GLU   9  16.762 -11.579  -2.333
   78    HA   GLU   9           HA       GLU   9  16.465  -9.401  -4.138
   79   1HB   GLU   9           HB2      GLU   9  18.622 -10.486  -3.695
   80   2HB   GLU   9           HB1      GLU   9  18.028 -12.030  -4.256
   81   1HG   GLU   9           HG2      GLU   9  19.380 -11.108  -5.985
   82   2HG   GLU   9           HG1      GLU   9  17.708 -11.089  -6.519
   83    H    ILE  10           HN       ILE  10  15.881 -12.839  -4.598
   84    HA   ILE  10           HA       ILE  10  14.873 -12.961  -7.147
   85    HB   ILE  10           HB       ILE  10  14.547 -14.468  -4.577
   86   1HG1  ILE  10          HG12      ILE  10  15.326 -15.185  -7.403
   87   2HG1  ILE  10          HG11      ILE  10  16.425 -14.743  -6.109
   88   1HG2  ILE  10          HG21      ILE  10  12.182 -14.574  -5.371
   89   2HG2  ILE  10          HG23      ILE  10  12.744 -15.296  -6.874
   90   3HG2  ILE  10          HG22      ILE  10  12.989 -16.112  -5.344
   91   1HD1  ILE  10          HD12      ILE  10  15.571 -16.721  -4.823
   92   2HD1  ILE  10          HD11      ILE  10  14.578 -17.162  -6.209
   93   3HD1  ILE  10          HD13      ILE  10  16.325 -17.158  -6.366
   94    H    ILE  11           HN       ILE  11  12.926 -12.638  -4.259
   95    HA   ILE  11           HA       ILE  11  10.416 -12.246  -5.170
   96    HB   ILE  11           HB       ILE  11  12.022 -10.960  -2.925
   97   1HG1  ILE  11          HG12      ILE  11  10.048 -13.258  -3.132
   98   2HG1  ILE  11          HG11      ILE  11  11.763 -13.457  -3.063
   99   1HG2  ILE  11          HG22      ILE  11  10.020  -9.503  -3.306
  100   2HG2  ILE  11          HG21      ILE  11   8.989 -10.923  -3.122
  101   3HG2  ILE  11          HG23      ILE  11   9.975 -10.350  -1.777
  102   1HD1  ILE  11          HD13      ILE  11  11.821 -12.444  -0.831
  103   2HD1  ILE  11          HD12      ILE  11  10.058 -12.299  -0.857
  104   3HD1  ILE  11          HD11      ILE  11  10.810 -13.888  -0.906
  105    H    LYS  12           HN       LYS  12  12.518  -9.469  -4.533
  106    HA   LYS  12           HA       LYS  12  11.006  -7.516  -5.903
  107   1HB   LYS  12           HB2      LYS  12  14.061  -7.778  -5.618
  108   2HB   LYS  12           HB1      LYS  12  13.270  -6.303  -6.160
  109   1HG   LYS  12           HG2      LYS  12  12.064  -6.124  -4.034
  110   2HG   LYS  12           HG1      LYS  12  12.593  -7.708  -3.522
  111   1HD   LYS  12           HD2      LYS  12  14.076  -6.399  -2.319
  112   2HD   LYS  12           HD1      LYS  12  15.028  -6.644  -3.761
  113   1HE   LYS  12           HE2      LYS  12  13.313  -4.178  -3.221
  114   2HE   LYS  12           HE1      LYS  12  15.046  -4.268  -2.988
  115   1HZ   LYS  12           HZ2      LYS  12  14.491  -5.131  -5.582
  116   2HZ   LYS  12           HZ3      LYS  12  13.654  -3.671  -5.316
  117   3HZ   LYS  12           HZ1      LYS  12  15.333  -3.747  -5.074
  118    H    THR  13           HN       THR  13  13.576  -9.545  -7.312
  119    HA   THR  13           HA       THR  13  13.441  -8.550  -9.948
  120    HB   THR  13           HB       THR  13  14.116 -11.458  -9.095
  121    HG1  THR  13           HG1      THR  13  15.331 -10.030  -7.993
  122   1HG2  THR  13          HG23      THR  13  14.031 -11.060 -11.714
  123   2HG2  THR  13          HG22      THR  13  15.220  -9.804 -11.479
  124   3HG2  THR  13          HG21      THR  13  15.617 -11.458 -11.113
  125    H    LEU  14           HN       LEU  14  11.608 -11.300  -8.589
  126    HA   LEU  14           HA       LEU  14  10.127 -12.007 -10.924
  127   1HB   LEU  14           HB2      LEU  14   9.658 -12.520  -7.966
  128   2HB   LEU  14           HB1      LEU  14   8.479 -13.027  -9.156
  129    HG   LEU  14           HG       LEU  14  10.274 -14.413 -10.309
  130   1HD1  LEU  14          HD13      LEU  14  12.279 -13.163  -9.442
  131   2HD1  LEU  14          HD12      LEU  14  11.837 -13.738  -7.833
  132   3HD1  LEU  14          HD11      LEU  14  12.345 -14.882  -9.061
  133   1HD2  LEU  14          HD22      LEU  14   9.944 -15.041  -7.345
  134   2HD2  LEU  14          HD21      LEU  14   8.841 -15.543  -8.619
  135   3HD2  LEU  14          HD23      LEU  14  10.462 -16.182  -8.561
  136    H    ASN  15           HN       ASN  15   9.300 -10.167  -8.131
  137    HA   ASN  15           HA       ASN  15   6.784  -9.402  -8.357
  138   1HB   ASN  15           HB2      ASN  15   9.382  -8.185  -7.484
  139   2HB   ASN  15           HB1      ASN  15   8.039  -7.210  -7.252
  140   1HD2  ASN  15          HD22      ASN  15   7.552 -10.827  -5.422
  141   2HD2  ASN  15          HD21      ASN  15   7.633 -10.671  -7.097
  142    H    SER  16           HN       SER  16   9.436  -7.634  -9.831
  143    HA   SER  16           HA       SER  16   7.959  -5.722 -11.239
  144   1HB   SER  16           HB2      SER  16  10.509  -5.931 -10.885
  145   2HB   SER  16           HB1      SER  16  10.528  -6.887 -12.351
  146    HG   SER  16           HG       SER  16  10.257  -4.258 -12.132
  147    H    LEU  17           HN       LEU  17   9.482  -8.483 -12.825
  148    HA   LEU  17           HA       LEU  17   8.584  -8.348 -15.369
  149   1HB   LEU  17           HB2      LEU  17   8.542 -10.926 -13.770
  150   2HB   LEU  17           HB1      LEU  17   8.693 -10.707 -15.494
  151    HG   LEU  17           HG       LEU  17  10.840  -9.185 -14.358
  152   1HD1  LEU  17          HD13      LEU  17  10.369 -10.722 -12.418
  153   2HD1  LEU  17          HD12      LEU  17  10.749 -12.091 -13.429
  154   3HD1  LEU  17          HD11      LEU  17  12.000 -10.929 -13.038
  155   1HD2  LEU  17          HD23      LEU  17  10.829 -11.905 -15.746
  156   2HD2  LEU  17          HD22      LEU  17  10.919 -10.369 -16.602
  157   3HD2  LEU  17          HD21      LEU  17  12.237 -10.913 -15.579
  158    H    THR  18           HN       THR  18   6.683  -9.702 -12.735
  159    HA   THR  18           HA       THR  18   4.392 -10.310 -14.443
  160    HB   THR  18           HB       THR  18   3.269 -10.776 -12.129
  161    HG1  THR  18           HG1      THR  18   5.928 -10.309 -11.250
  162   1HG2  THR  18          HG21      THR  18   4.564 -12.524 -13.400
  163   2HG2  THR  18          HG23      THR  18   6.031 -12.017 -12.570
  164   3HG2  THR  18          HG22      THR  18   4.706 -12.741 -11.660
  165    H    GLU  19           HN       GLU  19   5.014  -7.958 -11.848
  166    HA   GLU  19           HA       GLU  19   2.809  -6.480 -11.632
  167   1HB   GLU  19           HB2      GLU  19   5.483  -6.000 -11.050
  168   2HB   GLU  19           HB1      GLU  19   5.175  -4.744 -12.215
  169   1HG   GLU  19           HG2      GLU  19   4.701  -3.854  -9.991
  170   2HG   GLU  19           HG1      GLU  19   3.184  -3.996 -10.864
  171    H    GLN  20           HN       GLN  20   5.156  -5.942 -14.112
  172    HA   GLN  20           HA       GLN  20   3.144  -4.594 -15.882
  173   1HB   GLN  20           HB2      GLN  20   6.176  -4.248 -15.872
  174   2HB   GLN  20           HB1      GLN  20   5.042  -3.398 -16.910
  175   1HG   GLN  20           HG2      GLN  20   3.943  -2.552 -14.695
  176   2HG   GLN  20           HG1      GLN  20   5.401  -3.131 -13.898
  177   1HE2  GLN  20          HE22      GLN  20   7.302  -0.347 -14.901
  178   2HE2  GLN  20          HE21      GLN  20   7.188  -1.726 -13.921
  179    H    LYS  21           HN       LYS  21   2.416  -6.376 -16.910
  180    HA   LYS  21           HA       LYS  21   4.287  -8.274 -18.199
  181   1HB   LYS  21           HB2      LYS  21   2.222  -9.406 -18.975
  182   2HB   LYS  21           HB1      LYS  21   2.253  -9.245 -17.231
  183   1HG   LYS  21           HG2      LYS  21   0.759  -7.265 -17.338
  184   2HG   LYS  21           HG1      LYS  21   0.760  -7.300 -19.085
  185   1HD   LYS  21           HD2      LYS  21  -0.260  -9.615 -17.424
  186   2HD   LYS  21           HD1      LYS  21  -1.281  -8.269 -17.855
  187   1HE   LYS  21           HE2      LYS  21  -1.666 -10.007 -19.501
  188   2HE   LYS  21           HE1      LYS  21  -0.774  -8.736 -20.318
  189   1HZ   LYS  21           HZ3      LYS  21   1.002 -10.603 -19.156
  190   2HZ   LYS  21           HZ1      LYS  21  -0.128 -11.401 -20.121
  191   3HZ   LYS  21           HZ2      LYS  21   0.818 -10.156 -20.788
  192    H    THR  22           HN       THR  22   3.980  -8.795 -20.500
  193    HA   THR  22           HA       THR  22   3.170  -6.466 -22.189
  194    HB   THR  22           HB       THR  22   5.287  -6.714 -23.520
  195    HG1  THR  22           HG1      THR  22   5.338  -9.047 -21.945
  196   1HG2  THR  22          HG23      THR  22   5.501  -5.452 -21.285
  197   2HG2  THR  22          HG22      THR  22   6.044  -6.955 -20.564
  198   3HG2  THR  22          HG21      THR  22   6.988  -6.205 -21.841
  199    H    LEU  23           HN       LEU  23   4.085  -7.743 -24.583
  200    HA   LEU  23           HA       LEU  23   1.969  -9.727 -24.967
  201   1HB   LEU  23           HB2      LEU  23   3.713  -8.517 -27.116
  202   2HB   LEU  23           HB1      LEU  23   2.114  -9.169 -27.143
  203    HG   LEU  23           HG       LEU  23   1.635  -7.051 -25.488
  204   1HD1  LEU  23          HD13      LEU  23   4.020  -6.265 -25.616
  205   2HD1  LEU  23          HD12      LEU  23   3.867  -6.139 -27.357
  206   3HD1  LEU  23          HD11      LEU  23   2.933  -5.083 -26.317
  207   1HD2  LEU  23          HD22      LEU  23   1.713  -6.856 -28.523
  208   2HD2  LEU  23          HD21      LEU  23   0.374  -7.488 -27.569
  209   3HD2  LEU  23          HD23      LEU  23   0.817  -5.792 -27.446
  210    H    CYS  24           HN       CYS  24   5.078  -9.604 -24.088
  211    HA   CYS  24           HA       CYS  24   6.098 -11.869 -25.680
  212   1HB   CYS  24           HB2      CYS  24   7.592 -10.226 -23.633
  213   2HB   CYS  24           HB1      CYS  24   8.236 -11.170 -24.954
  214    H    THR  25           HN       THR  25   4.993 -10.999 -22.456
  215    HA   THR  25           HA       THR  25   6.095 -13.417 -21.244
  216    HB   THR  25           HB       THR  25   3.809 -12.619 -19.685
  217    HG1  THR  25           HG1      THR  25   3.592 -10.618 -20.287
  218   1HG2  THR  25          HG22      THR  25   6.701 -11.797 -19.194
  219   2HG2  THR  25          HG21      THR  25   5.392 -11.718 -18.030
  220   3HG2  THR  25          HG23      THR  25   5.918 -13.258 -18.616
  221    H    GLU  26           HN       GLU  26   4.052 -13.246 -23.660
  222    HA   GLU  26           HA       GLU  26   2.151 -15.352 -22.732
  223   1HB   GLU  26           HB2      GLU  26   1.924 -13.098 -24.758
  224   2HB   GLU  26           HB1      GLU  26   0.985 -14.547 -25.013
  225   1HG   GLU  26           HG2      GLU  26  -0.480 -13.129 -23.887
  226   2HG   GLU  26           HG1      GLU  26   0.060 -14.243 -22.651
  227    H    LEU  27           HN       LEU  27   5.009 -15.324 -23.858
  228    HA   LEU  27           HA       LEU  27   4.682 -17.062 -26.261
  229   1HB   LEU  27           HB2      LEU  27   7.183 -16.162 -24.779
  230   2HB   LEU  27           HB1      LEU  27   7.171 -16.958 -26.335
  231    HG   LEU  27           HG       LEU  27   6.063 -14.143 -25.787
  232   1HD1  LEU  27          HD11      LEU  27   8.569 -14.273 -25.667
  233   2HD1  LEU  27          HD13      LEU  27   8.605 -15.039 -27.250
  234   3HD1  LEU  27          HD12      LEU  27   8.047 -13.381 -27.092
  235   1HD2  LEU  27          HD21      LEU  27   4.894 -15.232 -27.645
  236   2HD2  LEU  27          HD23      LEU  27   5.899 -13.894 -28.176
  237   3HD2  LEU  27          HD22      LEU  27   6.443 -15.548 -28.433
  238    H    THR  28           HN       THR  28   3.483 -18.145 -24.850
  239    HA   THR  28           HA       THR  28   3.766 -19.691 -22.793
  240    HB   THR  28           HB       THR  28   2.511 -21.408 -23.699
  241    HG1  THR  28           HG1      THR  28   2.581 -20.747 -26.361
  242   1HG2  THR  28          HG21      THR  28   1.354 -19.241 -23.733
  243   2HG2  THR  28          HG23      THR  28   1.855 -18.950 -25.391
  244   3HG2  THR  28          HG22      THR  28   0.763 -20.275 -25.019
  245    H    VAL  29           HN       VAL  29   5.063 -20.692 -21.922
  246    HA   VAL  29           HA       VAL  29   7.137 -22.482 -23.163
  247    HB   VAL  29           HB       VAL  29   8.588 -21.991 -21.263
  248   1HG1  VAL  29          HG13      VAL  29   8.480 -20.352 -23.132
  249   2HG1  VAL  29          HG12      VAL  29   7.241 -19.465 -22.230
  250   3HG1  VAL  29          HG11      VAL  29   8.846 -19.677 -21.552
  251   1HG2  VAL  29          HG21      VAL  29   6.809 -21.825 -19.464
  252   2HG2  VAL  29          HG23      VAL  29   7.889 -20.443 -19.450
  253   3HG2  VAL  29          HG22      VAL  29   6.292 -20.291 -20.157
  254    H    THR  30           HN       THR  30   8.004 -24.046 -21.309
  255    HA   THR  30           HA       THR  30   5.786 -25.846 -20.842
  256    HB   THR  30           HB       THR  30   8.745 -25.928 -20.067
  257    HG1  THR  30           HG1      THR  30   7.186 -26.421 -22.192
  258   1HG2  THR  30          HG23      THR  30   6.616 -28.134 -19.784
  259   2HG2  THR  30          HG22      THR  30   8.349 -28.349 -19.549
  260   3HG2  THR  30          HG21      THR  30   7.412 -27.366 -18.437
  261    H    ASP  31           HN       ASP  31   4.577 -26.116 -19.189
  262    HA   ASP  31           HA       ASP  31   4.841 -24.471 -16.768
  263   1HB   ASP  31           HB2      ASP  31   2.718 -24.590 -18.140
  264   2HB   ASP  31           HB1      ASP  31   2.518 -26.272 -17.764
  265    H    ILE  32           HN       ILE  32   6.823 -26.017 -16.494
  266    HA   ILE  32           HA       ILE  32   6.828 -28.699 -15.776
  267    HB   ILE  32           HB       ILE  32   8.693 -28.051 -14.229
  268   1HG1  ILE  32          HG12      ILE  32   9.202 -25.402 -14.519
  269   2HG1  ILE  32          HG11      ILE  32   7.469 -25.311 -14.633
  270   1HG2  ILE  32          HG23      ILE  32   8.673 -26.625 -16.915
  271   2HG2  ILE  32          HG22      ILE  32  10.102 -26.978 -15.971
  272   3HG2  ILE  32          HG21      ILE  32   9.143 -28.294 -16.632
  273   1HD1  ILE  32          HD11      ILE  32   8.976 -26.594 -12.369
  274   2HD1  ILE  32          HD13      ILE  32   8.199 -25.012 -12.331
  275   3HD1  ILE  32          HD12      ILE  32   7.234 -26.465 -12.453
  276    H    PHE  33           HN       PHE  33   5.303 -26.220 -13.897
  277    HA   PHE  33           HA       PHE  33   5.199 -27.474 -11.382
  278   1HB   PHE  33           HB2      PHE  33   3.016 -25.819 -12.731
  279   2HB   PHE  33           HB1      PHE  33   3.078 -26.182 -11.017
  280    HD1  PHE  33           HD1      PHE  33   5.626 -25.705 -10.010
  281    HD2  PHE  33           HD2      PHE  33   3.782 -23.679 -13.274
  282    HE1  PHE  33           HE1      PHE  33   7.099 -23.784  -9.650
  283    HE2  PHE  33           HE2      PHE  33   5.255 -21.747 -12.896
  284    HZ   PHE  33           HZ       PHE  33   6.917 -21.800 -11.088
  285    H    ALA  34           HN       ALA  34   3.359 -28.155 -14.293
  286    HA   ALA  34           HA       ALA  34   1.651 -30.101 -12.911
  287   1HB   ALA  34           HB2      ALA  34   1.787 -29.246 -15.807
  288   2HB   ALA  34           HB1      ALA  34   0.568 -30.316 -15.134
  289   3HB   ALA  34           HB3      ALA  34   0.668 -28.641 -14.597
  290    H    ALA  35           HN       ALA  35   4.533 -30.657 -13.083
  291    HA   ALA  35           HA       ALA  35   4.373 -33.387 -14.210
  292   1HB   ALA  35           HB2      ALA  35   6.541 -31.428 -15.073
  293   2HB   ALA  35           HB1      ALA  35   6.515 -33.151 -15.441
  294   3HB   ALA  35           HB3      ALA  35   5.247 -32.110 -16.039
  295    H    SER  36           HN       SER  36   6.420 -31.016 -12.661
  296    HA   SER  36           HA       SER  36   8.034 -33.068 -11.349
  297   1HB   SER  36           HB2      SER  36   8.850 -30.751 -12.145
  298   2HB   SER  36           HB1      SER  36   7.978 -30.066 -10.765
  299    HG   SER  36           HG       SER  36   9.552 -30.666  -9.611
  300    H    LYS  37           HN       LYS  37   5.080 -32.495 -10.985
  301    HA   LYS  37           HA       LYS  37   4.459 -31.778  -8.332
  302   1HB   LYS  37           HB2      LYS  37   3.020 -33.858  -9.974
  303   2HB   LYS  37           HB1      LYS  37   2.333 -32.960  -8.641
  304   1HG   LYS  37           HG1      LYS  37   2.386 -30.893  -9.836
  305   2HG   LYS  37           HG2      LYS  37   3.330 -31.587 -11.147
  306   1HD   LYS  37           HD2      LYS  37   0.523 -32.489 -10.390
  307   2HD   LYS  37           HD1      LYS  37   0.871 -31.409 -11.711
  308   1HE   LYS  37           HE2      LYS  37   2.421 -33.277 -12.652
  309   2HE   LYS  37           HE1      LYS  37   1.711 -34.327 -11.439
  310   1HZ   LYS  37           HZ1      LYS  37  -0.369 -33.012 -12.724
  311   2HZ   LYS  37           HZ3      LYS  37   0.674 -33.644 -13.908
  312   3HZ   LYS  37           HZ2      LYS  37   0.018 -34.668 -12.719
  313    H    ASN  38           HN       ASN  38   5.554 -34.696  -9.600
  314    HA   ASN  38           HA       ASN  38   5.111 -36.212  -7.072
  315   1HB   ASN  38           HB2      ASN  38   6.101 -37.170  -9.799
  316   2HB   ASN  38           HB1      ASN  38   5.678 -38.205  -8.443
  317   1HD2  ASN  38          HD22      ASN  38   2.777 -36.894 -10.890
  318   2HD2  ASN  38          HD21      ASN  38   4.421 -36.609 -11.201
  319    H    THR  39           HN       THR  39   7.211 -34.079  -7.498
  320    HA   THR  39           HA       THR  39   9.468 -35.665  -6.415
  321    HB   THR  39           HB       THR  39  10.997 -34.889  -8.027
  322    HG1  THR  39           HG1      THR  39   9.923 -32.542  -8.876
  323   1HG2  THR  39          HG23      THR  39   8.551 -34.100  -9.583
  324   2HG2  THR  39          HG22      THR  39  10.175 -34.328 -10.222
  325   3HG2  THR  39          HG21      THR  39   9.278 -35.704  -9.588
  326    H    THR  40           HN       THR  40  11.078 -33.558  -6.096
  327    HA   THR  40           HA       THR  40   9.787 -31.978  -3.906
  328    HB   THR  40           HB       THR  40  12.229 -31.576  -3.211
  329    HG1  THR  40           HG1      THR  40  12.444 -32.800  -5.634
  330   1HG2  THR  40          HG23      THR  40  11.500 -34.550  -3.661
  331   2HG2  THR  40          HG22      THR  40  12.633 -33.947  -2.461
  332   3HG2  THR  40          HG21      THR  40  10.915 -33.612  -2.297
  333    H    GLU  41           HN       GLU  41  10.490 -29.732  -3.629
  334    HA   GLU  41           HA       GLU  41  10.082 -28.151  -5.837
  335   1HB   GLU  41           HB2      GLU  41  11.494 -27.649  -3.196
  336   2HB   GLU  41           HB1      GLU  41  11.597 -26.396  -4.409
  337   1HG   GLU  41           HG2      GLU  41   9.669 -25.935  -2.956
  338   2HG   GLU  41           HG1      GLU  41   9.077 -26.382  -4.543
  339    H    LYS  42           HN       LYS  42  13.190 -28.958  -4.459
  340    HA   LYS  42           HA       LYS  42  15.085 -27.792  -5.933
  341   1HB   LYS  42           HB2      LYS  42  15.251 -30.796  -5.951
  342   2HB   LYS  42           HB1      LYS  42  16.511 -29.624  -5.692
  343   1HG   LYS  42           HG2      LYS  42  14.332 -29.996  -3.602
  344   2HG   LYS  42           HG1      LYS  42  15.677 -31.097  -3.711
  345   1HD   LYS  42           HD2      LYS  42  17.274 -29.240  -3.382
  346   2HD   LYS  42           HD1      LYS  42  15.947 -28.085  -3.335
  347   1HE   LYS  42           HE2      LYS  42  16.752 -28.735  -1.046
  348   2HE   LYS  42           HE1      LYS  42  15.058 -29.129  -1.286
  349   1HZ   LYS  42           HZ3      LYS  42  16.619 -31.312  -2.110
  350   2HZ   LYS  42           HZ2      LYS  42  17.147 -30.828  -0.573
  351   3HZ   LYS  42           HZ1      LYS  42  15.517 -31.219  -0.827
  352    H    GLU  43           HN       GLU  43  13.291 -30.512  -7.117
  353    HA   GLU  43           HA       GLU  43  14.521 -30.608  -9.767
  354   1HB   GLU  43           HB2      GLU  43  11.992 -31.868  -8.794
  355   2HB   GLU  43           HB1      GLU  43  12.902 -32.337 -10.232
  356   1HG   GLU  43           HG2      GLU  43  14.858 -32.807  -8.912
  357   2HG   GLU  43           HG1      GLU  43  14.059 -32.262  -7.433
  358    H    THR  44           HN       THR  44  11.542 -29.481  -8.522
  359    HA   THR  44           HA       THR  44  10.084 -28.805 -10.862
  360    HB   THR  44           HB       THR  44  10.295 -27.140  -8.253
  361    HG1  THR  44           HG1      THR  44   9.336 -29.631  -8.847
  362   1HG2  THR  44          HG21      THR  44   7.916 -27.572 -10.138
  363   2HG2  THR  44          HG23      THR  44   7.931 -26.545  -8.717
  364   3HG2  THR  44          HG22      THR  44   8.877 -26.100 -10.119
  365    H    PHE  45           HN       PHE  45  12.396 -27.253  -8.943
  366    HA   PHE  45           HA       PHE  45  12.999 -24.957 -10.418
  367   1HB   PHE  45           HB2      PHE  45  13.963 -26.471  -8.043
  368   2HB   PHE  45           HB1      PHE  45  14.967 -25.221  -8.628
  369    HD1  PHE  45           HD2      PHE  45  13.090 -23.111  -9.509
  370    HD2  PHE  45           HD1      PHE  45  12.778 -25.804  -6.224
  371    HE1  PHE  45           HE2      PHE  45  11.583 -21.572  -8.414
  372    HE2  PHE  45           HE1      PHE  45  11.256 -24.263  -5.120
  373    HZ   PHE  45           HZ       PHE  45  10.629 -22.145  -6.194
  374    H    CYS  46           HN       CYS  46  14.443 -28.182 -10.409
  375    HA   CYS  46           HA       CYS  46  16.873 -27.519 -11.794
  376   1HB   CYS  46           HB2      CYS  46  16.140 -29.684 -10.671
  377   2HB   CYS  46           HB1      CYS  46  15.337 -30.104 -12.146
  378    NH1  ARG  47           NH1      ARG  47  12.044 -33.215 -12.750
  379    NH2  ARG  47           NH2      ARG  47   9.781 -33.208 -13.023
  380    H    ARG  47           HN       ARG  47  13.751 -28.599 -12.912
  381    HA   ARG  47           HA       ARG  47  14.347 -28.361 -15.759
  382   1HB   ARG  47           HB2      ARG  47  11.777 -28.685 -14.124
  383   2HB   ARG  47           HB1      ARG  47  11.779 -28.630 -15.882
  384   1HG   ARG  47           HG2      ARG  47  13.347 -30.558 -15.956
  385   2HG   ARG  47           HG1      ARG  47  13.383 -30.622 -14.207
  386   1HD   ARG  47           HD2      ARG  47  10.745 -30.846 -15.678
  387   2HD   ARG  47           HD1      ARG  47  11.775 -32.258 -15.475
  388    HE   ARG  47           HE       ARG  47  10.735 -30.657 -13.153
  389   1HH1  ARG  47          HH11      ARG  47  12.922 -32.748 -12.860
  390   2HH1  ARG  47          HH12      ARG  47  12.009 -34.127 -12.342
  391   1HH2  ARG  47          HH21      ARG  47   8.954 -32.734 -13.327
  392   2HH2  ARG  47          HH22      ARG  47   9.717 -34.123 -12.626
  393    H    ALA  48           HN       ALA  48  12.627 -26.485 -13.335
  394    HA   ALA  48           HA       ALA  48  11.608 -24.321 -14.669
  395   1HB   ALA  48           HB3      ALA  48  11.558 -24.659 -12.230
  396   2HB   ALA  48           HB2      ALA  48  13.267 -24.240 -12.185
  397   3HB   ALA  48           HB1      ALA  48  12.095 -23.030 -12.644
  398    H    ALA  49           HN       ALA  49  14.781 -24.289 -13.203
  399    HA   ALA  49           HA       ALA  49  15.921 -22.000 -14.238
  400   1HB   ALA  49           HB2      ALA  49  17.295 -24.713 -13.865
  401   2HB   ALA  49           HB1      ALA  49  18.123 -23.168 -13.952
  402   3HB   ALA  49           HB3      ALA  49  17.054 -23.524 -12.604
  403    H    THR  50           HN       THR  50  16.363 -25.201 -15.651
  404    HA   THR  50           HA       THR  50  17.585 -24.664 -18.050
  405    HB   THR  50           HB       THR  50  15.355 -26.733 -17.460
  406    HG1  THR  50           HG1      THR  50  16.965 -27.098 -16.101
  407   1HG2  THR  50          HG21      THR  50  15.971 -26.567 -19.937
  408   2HG2  THR  50          HG23      THR  50  17.642 -26.877 -19.469
  409   3HG2  THR  50          HG22      THR  50  16.400 -28.089 -19.183
  410    H    VAL  51           HN       VAL  51  14.105 -24.915 -17.703
  411    HA   VAL  51           HA       VAL  51  13.148 -24.052 -20.145
  412    HB   VAL  51           HB       VAL  51  11.958 -23.769 -17.289
  413   1HG1  VAL  51          HG13      VAL  51  10.884 -22.031 -18.867
  414   2HG1  VAL  51          HG12      VAL  51  10.528 -23.337 -19.983
  415   3HG1  VAL  51          HG11      VAL  51   9.767 -23.297 -18.401
  416   1HG2  VAL  51          HG21      VAL  51  12.295 -26.053 -18.277
  417   2HG2  VAL  51          HG23      VAL  51  10.591 -25.667 -18.095
  418   3HG2  VAL  51          HG22      VAL  51  11.351 -25.565 -19.673
  419    H    LEU  52           HN       LEU  52  13.356 -21.961 -17.369
  420    HA   LEU  52           HA       LEU  52  12.779 -19.491 -18.571
  421   1HB   LEU  52           HB2      LEU  52  12.873 -20.131 -16.120
  422   2HB   LEU  52           HB1      LEU  52  14.599 -20.012 -16.189
  423    HG   LEU  52           HG       LEU  52  13.684 -17.988 -15.177
  424   1HD1  LEU  52          HD11      LEU  52  15.627 -17.587 -16.765
  425   2HD1  LEU  52          HD13      LEU  52  14.466 -17.175 -18.011
  426   3HD1  LEU  52          HD12      LEU  52  14.562 -16.208 -16.574
  427   1HD2  LEU  52          HD21      LEU  52  11.391 -18.107 -16.136
  428   2HD2  LEU  52          HD23      LEU  52  12.080 -16.516 -16.369
  429   3HD2  LEU  52          HD22      LEU  52  12.007 -17.639 -17.711
  430    NH1  ARG  53           NH2      ARG  53  21.502 -21.236 -15.649
  431    NH2  ARG  53           NH1      ARG  53  22.451 -23.019 -16.716
  432    H    ARG  53           HN       ARG  53  15.964 -20.826 -17.823
  433    HA   ARG  53           HA       ARG  53  17.715 -18.927 -18.691
  434   1HB   ARG  53           HB2      ARG  53  18.237 -21.198 -17.721
  435   2HB   ARG  53           HB1      ARG  53  17.990 -21.911 -19.305
  436   1HG   ARG  53           HG2      ARG  53  19.806 -20.424 -20.212
  437   2HG   ARG  53           HG1      ARG  53  20.070 -19.799 -18.590
  438   1HD   ARG  53           HD2      ARG  53  20.339 -22.709 -19.441
  439   2HD   ARG  53           HD1      ARG  53  21.673 -21.633 -19.043
  440    HE   ARG  53           HE       ARG  53  19.592 -22.501 -17.060
  441   1HH1  ARG  53          HH21      ARG  53  20.744 -20.592 -15.552
  442   2HH1  ARG  53          HH22      ARG  53  22.282 -21.178 -15.026
  443   1HH2  ARG  53          HH11      ARG  53  22.397 -23.711 -17.436
  444   2HH2  ARG  53          HH12      ARG  53  23.243 -22.991 -16.106
  445    H    GLN  54           HN       GLN  54  16.489 -21.537 -20.693
  446    HA   GLN  54           HA       GLN  54  17.357 -20.659 -23.210
  447   1HB   GLN  54           HB2      GLN  54  14.684 -22.029 -22.597
  448   2HB   GLN  54           HB1      GLN  54  15.461 -21.992 -24.162
  449   1HG   GLN  54           HG2      GLN  54  16.717 -23.223 -21.702
  450   2HG   GLN  54           HG1      GLN  54  15.756 -24.140 -22.849
  451   1HE2  GLN  54          HE22      GLN  54  18.511 -24.668 -24.944
  452   2HE2  GLN  54          HE21      GLN  54  16.977 -25.156 -24.411
  453    H    PHE  55           HN       PHE  55  14.174 -20.097 -21.747
  454    HA   PHE  55           HA       PHE  55  12.917 -18.471 -23.537
  455   1HB   PHE  55           HB2      PHE  55  12.172 -19.040 -21.106
  456   2HB   PHE  55           HB1      PHE  55  12.973 -17.558 -20.621
  457    HD1  PHE  55           HD1      PHE  55  12.158 -15.761 -23.116
  458    HD2  PHE  55           HD2      PHE  55  10.028 -18.505 -20.678
  459    HE1  PHE  55           HE1      PHE  55  10.089 -14.649 -23.684
  460    HE2  PHE  55           HE2      PHE  55   7.924 -17.401 -21.284
  461    HZ   PHE  55           HZ       PHE  55   7.949 -15.440 -22.779
  462    OH   TYR  56           OH       TYR  56  20.951 -16.882 -18.649
  463    H    TYR  56           HN       TYR  56  14.812 -16.975 -20.983
  464    HA   TYR  56           HA       TYR  56  14.773 -14.398 -22.226
  465   1HB   TYR  56           HB2      TYR  56  16.255 -13.545 -20.668
  466   2HB   TYR  56           HB1      TYR  56  15.347 -14.726 -19.823
  467    HD1  TYR  56           HD1      TYR  56  18.660 -14.166 -21.448
  468    HD2  TYR  56           HD2      TYR  56  16.456 -16.428 -18.599
  469    HE1  TYR  56           HE1      TYR  56  20.731 -15.149 -20.622
  470    HE2  TYR  56           HE2      TYR  56  18.532 -17.374 -17.741
  471    HH   TYR  56           HH       TYR  56  20.720 -17.542 -17.990
  472    H    SER  57           HN       SER  57  17.420 -16.790 -22.148
  473    HA   SER  57           HA       SER  57  19.386 -15.438 -23.565
  474   1HB   SER  57           HB2      SER  57  19.727 -17.509 -22.260
  475   2HB   SER  57           HB1      SER  57  18.888 -18.447 -23.498
  476    HG   SER  57           HG       SER  57  21.396 -17.583 -23.475
  477    H    HIS  58           HN       HIS  58  16.839 -17.419 -24.920
  478    HA   HIS  58           HA       HIS  58  17.821 -17.248 -27.657
  479   1HB   HIS  58           HB2      HIS  58  16.679 -19.255 -26.613
  480   2HB   HIS  58           HB1      HIS  58  15.183 -18.341 -26.637
  481    HD1  HIS  58           HD1      HIS  58  14.667 -17.446 -29.255
  482    HD2  HIS  58           HD2      HIS  58  17.045 -20.743 -28.860
  483    HE1  HIS  58           HE1      HIS  58  14.643 -18.591 -31.441
  484    H    HIS  59           HN       HIS  59  15.133 -15.762 -25.821
  485    HA   HIS  59           HA       HIS  59  14.164 -14.462 -28.236
  486   1HB   HIS  59           HB2      HIS  59  13.313 -14.568 -25.360
  487   2HB   HIS  59           HB1      HIS  59  12.549 -13.383 -26.373
  488    HD1  HIS  59           HD1      HIS  59  12.240 -15.093 -28.932
  489    HD2  HIS  59           HD2      HIS  59  11.409 -16.363 -25.179
  490    HE1  HIS  59           HE1      HIS  59  10.633 -16.951 -29.197
  491    H    GLU  60           HN       GLU  60  16.697 -13.545 -26.236
  492    HA   GLU  60           HA       GLU  60  16.408 -10.815 -25.773
  493   1HB   GLU  60           HB2      GLU  60  18.915 -12.061 -26.996
  494   2HB   GLU  60           HB1      GLU  60  18.856 -10.573 -26.060
  495   1HG   GLU  60           HG2      GLU  60  17.870 -12.034 -24.149
  496   2HG   GLU  60           HG1      GLU  60  18.410 -13.401 -25.123
  497    H    LYS  61           HN       LYS  61  17.339 -12.245 -28.692
  498    HA   LYS  61           HA       LYS  61  16.703  -9.706 -30.171
  499   1HB   LYS  61           HB2      LYS  61  18.792 -11.852 -30.816
  500   2HB   LYS  61           HB1      LYS  61  18.348 -10.523 -31.885
  501   1HG   LYS  61           HG2      LYS  61  19.093  -8.856 -30.311
  502   2HG   LYS  61           HG1      LYS  61  19.359 -10.042 -29.051
  503   1HD   LYS  61           HD2      LYS  61  21.483  -9.332 -30.138
  504   2HD   LYS  61           HD1      LYS  61  21.214 -11.052 -30.313
  505   1HE   LYS  61           HE1      LYS  61  20.381 -10.670 -32.651
  506   2HE   LYS  61           HE2      LYS  61  20.654  -8.943 -32.461
  507   1HZ   LYS  61           HZ2      LYS  61  22.988 -10.293 -31.727
  508   2HZ   LYS  61           HZ3      LYS  61  22.461 -10.930 -33.209
  509   3HZ   LYS  61           HZ1      LYS  61  22.738  -9.264 -33.053
  510    H    ASP  62           HN       ASP  62  14.671 -11.059 -29.666
  511    HA   ASP  62           HA       ASP  62  13.897 -12.926 -31.802
  512   1HB   ASP  62           HB2      ASP  62  13.070 -13.596 -29.674
  513   2HB   ASP  62           HB1      ASP  62  12.702 -11.957 -29.169
  514    H    THR  63           HN       THR  63  13.946  -9.827 -30.976
  515    HA   THR  63           HA       THR  63  12.660  -7.897 -31.428
  516    HB   THR  63           HB       THR  63  13.894  -6.957 -33.285
  517    HG1  THR  63           HG1      THR  63  14.038  -8.290 -34.919
  518   1HG2  THR  63          HG21      THR  63  15.328  -7.766 -31.196
  519   2HG2  THR  63          HG23      THR  63  15.566  -9.252 -32.052
  520   3HG2  THR  63          HG22      THR  63  16.232  -7.767 -32.682
  521    NH1  ARG  64           NH1      ARG  64   8.434 -14.238 -32.304
  522    NH2  ARG  64           NH2      ARG  64   6.338 -13.563 -32.871
  523    H    ARG  64           HN       ARG  64  10.700  -9.562 -31.615
  524    HA   ARG  64           HA       ARG  64   9.147  -8.761 -34.035
  525   1HB   ARG  64           HB2      ARG  64   9.237 -11.365 -32.481
  526   2HB   ARG  64           HB1      ARG  64   7.804 -10.924 -33.382
  527   1HG   ARG  64           HG2      ARG  64   8.962 -10.963 -35.466
  528   2HG   ARG  64           HG1      ARG  64  10.546 -11.007 -34.706
  529   1HD   ARG  64           HD2      ARG  64   9.747 -13.275 -35.512
  530   2HD   ARG  64           HD1      ARG  64  10.091 -13.261 -33.792
  531    HE   ARG  64           HE       ARG  64   7.363 -13.176 -35.041
  532   1HH1  ARG  64          HH11      ARG  64   9.404 -14.321 -32.528
  533   2HH1  ARG  64          HH12      ARG  64   8.099 -14.577 -31.425
  534   1HH2  ARG  64          HH21      ARG  64   5.722 -13.140 -33.536
  535   2HH2  ARG  64          HH22      ARG  64   5.983 -13.885 -31.994
  536    H    CYS  65           HN       CYS  65   9.006  -9.889 -30.706
  537    HA   CYS  65           HA       CYS  65   6.453  -8.525 -30.179
  538   1HB   CYS  65           HB2      CYS  65   6.983 -10.710 -29.104
  539   2HB   CYS  65           HB1      CYS  65   8.348  -9.981 -28.294
  540    H    LEU  66           HN       LEU  66   9.880  -7.965 -29.641
  541    HA   LEU  66           HA       LEU  66   9.351  -5.663 -27.916
  542   1HB   LEU  66           HB2      LEU  66  11.809  -5.655 -27.827
  543   2HB   LEU  66           HB1      LEU  66  11.147  -7.216 -27.376
  544    HG   LEU  66           HG       LEU  66  11.551  -7.278 -30.114
  545   1HD1  LEU  66          HD11      LEU  66  13.114  -5.338 -29.917
  546   2HD1  LEU  66          HD13      LEU  66  14.033  -6.186 -28.676
  547   3HD1  LEU  66          HD12      LEU  66  14.010  -6.774 -30.311
  548   1HD2  LEU  66          HD22      LEU  66  13.222  -8.493 -27.851
  549   2HD2  LEU  66          HD21      LEU  66  11.821  -9.233 -28.610
  550   3HD2  LEU  66          HD23      LEU  66  13.314  -9.027 -29.500
  551    H    GLY  67           HN       GLY  67   8.676  -5.953 -30.890
  552   1HA   GLY  67           HA2      GLY  67   9.712  -3.295 -31.784
  553   2HA   GLY  67           HA1      GLY  67   9.694  -4.654 -32.901
  554    H    ALA  68           HN       ALA  68   7.801  -3.074 -30.604
  555    HA   ALA  68           HA       ALA  68   5.241  -3.614 -32.034
  556   1HB   ALA  68           HB3      ALA  68   5.439  -4.175 -29.565
  557   2HB   ALA  68           HB2      ALA  68   5.781  -2.478 -29.295
  558   3HB   ALA  68           HB1      ALA  68   4.201  -2.954 -29.851
  559    H    THR  69           HN       THR  69   6.998  -1.061 -30.427
  560    HA   THR  69           HA       THR  69   6.288   0.919 -32.469
  561    HB   THR  69           HB       THR  69   4.207   1.083 -31.219
  562    HG1  THR  69           HG1      THR  69   5.276   3.120 -29.841
  563   1HG2  THR  69          HG21      THR  69   4.973  -0.072 -29.038
  564   2HG2  THR  69          HG22      THR  69   5.762   1.420 -28.568
  565   3HG2  THR  69          HG23      THR  69   4.037   1.382 -28.785
  566    H    ALA  70           HN       ALA  70   7.292   0.904 -29.100
  567    HA   ALA  70           HA       ALA  70  10.023   1.566 -29.454
  568   1HB   ALA  70           HB2      ALA  70   9.100   3.802 -30.244
  569   2HB   ALA  70           HB1      ALA  70   8.231   3.954 -28.734
  570   3HB   ALA  70           HB3      ALA  70   9.984   3.970 -28.746
  571    H    GLN  71           HN       GLN  71   7.212   2.370 -27.463
  572    HA   GLN  71           HA       GLN  71   8.476   2.221 -24.928
  573   1HB   GLN  71           HB2      GLN  71   6.061   3.048 -25.510
  574   2HB   GLN  71           HB1      GLN  71   5.584   1.362 -25.357
  575   1HG   GLN  71           HG2      GLN  71   6.654   1.336 -23.040
  576   2HG   GLN  71           HG1      GLN  71   6.957   3.057 -23.213
  577   1HE2  GLN  71          HE22      GLN  71   3.704   3.952 -22.261
  578   2HE2  GLN  71          HE21      GLN  71   5.289   4.449 -22.603
  579    H    GLN  72           HN       GLN  72   6.481  -0.313 -26.542
  580    HA   GLN  72           HA       GLN  72   6.932  -2.385 -24.727
  581   1HB   GLN  72           HB2      GLN  72   6.851  -2.608 -27.728
  582   2HB   GLN  72           HB1      GLN  72   6.451  -3.901 -26.622
  583   1HG   GLN  72           HG2      GLN  72   4.974  -1.239 -26.735
  584   2HG   GLN  72           HG1      GLN  72   4.407  -2.697 -27.471
  585   1HE2  GLN  72          HE22      GLN  72   4.436  -3.921 -23.732
  586   2HE2  GLN  72          HE21      GLN  72   5.694  -4.086 -24.854
  587    H    PHE  73           HN       PHE  73   8.836  -1.572 -27.578
  588    HA   PHE  73           HA       PHE  73  10.837  -3.493 -27.566
  589   1HB   PHE  73           HB2      PHE  73  10.824  -1.542 -29.183
  590   2HB   PHE  73           HB1      PHE  73  11.268  -0.456 -27.889
  591    HD1  PHE  73           HD2      PHE  73  13.525  -0.605 -26.810
  592    HD2  PHE  73           HD1      PHE  73  12.580  -2.831 -30.327
  593    HE1  PHE  73           HE2      PHE  73  15.904  -0.975 -27.230
  594    HE2  PHE  73           HE1      PHE  73  14.953  -3.197 -30.730
  595    HZ   PHE  73           HZ       PHE  73  16.630  -2.271 -29.191
  596    H    HIS  74           HN       HIS  74  11.088  -0.477 -25.826
  597    HA   HIS  74           HA       HIS  74  13.312  -1.087 -24.241
  598   1HB   HIS  74           HB2      HIS  74  11.662   1.120 -24.655
  599   2HB   HIS  74           HB1      HIS  74  11.303   0.735 -22.990
  600    HD1  HIS  74           HD1      HIS  74  14.132  -0.123 -22.103
  601    HD2  HIS  74           HD2      HIS  74  13.460   3.170 -24.430
  602    HE1  HIS  74           HE1      HIS  74  16.094   1.349 -21.821
  603    NH1  ARG  75           NH2      ARG  75   5.501  -1.132 -22.823
  604    NH2  ARG  75           NH1      ARG  75   3.711  -1.690 -21.531
  605    H    ARG  75           HN       ARG  75   9.844  -1.540 -23.483
  606    HA   ARG  75           HA       ARG  75  10.269  -2.399 -20.783
  607   1HB   ARG  75           HB2      ARG  75   8.090  -1.652 -21.713
  608   2HB   ARG  75           HB1      ARG  75   7.995  -3.115 -22.677
  609   1HG   ARG  75           HG2      ARG  75   7.778  -4.516 -20.724
  610   2HG   ARG  75           HG1      ARG  75   8.319  -3.241 -19.655
  611   1HD   ARG  75           HD2      ARG  75   5.804  -3.676 -19.610
  612   2HD   ARG  75           HD1      ARG  75   6.266  -2.004 -19.883
  613    HE   ARG  75           HE       ARG  75   5.477  -3.835 -22.128
  614   1HH1  ARG  75          HH21      ARG  75   6.419  -1.343 -23.157
  615   2HH1  ARG  75          HH22      ARG  75   5.030  -0.303 -23.127
  616   1HH2  ARG  75          HH11      ARG  75   3.279  -2.332 -20.897
  617   2HH2  ARG  75          HH12      ARG  75   3.237  -0.859 -21.820
  618    H    HIS  76           HN       HIS  76   9.929  -4.357 -23.719
  619    HA   HIS  76           HA       HIS  76  10.074  -6.931 -22.591
  620   1HB   HIS  76           HB2      HIS  76   9.564  -6.682 -24.970
  621   2HB   HIS  76           HB1      HIS  76  11.109  -5.901 -25.278
  622    HD1  HIS  76           HD1      HIS  76  13.032  -7.471 -25.696
  623    HD2  HIS  76           HD2      HIS  76   9.822  -9.543 -24.264
  624    HE1  HIS  76           HE1      HIS  76  13.608  -9.863 -25.875
  625    H    LYS  77           HN       LYS  77  12.689  -4.808 -23.696
  626    HA   LYS  77           HA       LYS  77  14.913  -6.428 -23.168
  627   1HB   LYS  77           HB2      LYS  77  14.820  -4.032 -24.157
  628   2HB   LYS  77           HB1      LYS  77  14.842  -3.436 -22.505
  629   1HG   LYS  77           HG2      LYS  77  16.964  -4.564 -22.049
  630   2HG   LYS  77           HG1      LYS  77  16.923  -5.394 -23.589
  631   1HD   LYS  77           HD2      LYS  77  17.271  -2.396 -23.183
  632   2HD   LYS  77           HD1      LYS  77  18.510  -3.534 -23.679
  633   1HE   LYS  77           HE2      LYS  77  17.030  -4.062 -25.739
  634   2HE   LYS  77           HE1      LYS  77  16.073  -2.659 -25.272
  635   1HZ   LYS  77           HZ1      LYS  77  18.763  -1.919 -25.224
  636   2HZ   LYS  77           HZ3      LYS  77  18.455  -2.706 -26.696
  637   3HZ   LYS  77           HZ2      LYS  77  17.520  -1.363 -26.242
  638    H    GLN  78           HN       GLN  78  13.303  -4.196 -20.869
  639    HA   GLN  78           HA       GLN  78  14.814  -4.814 -18.570
  640   1HB   GLN  78           HB2      GLN  78  11.811  -4.252 -18.680
  641   2HB   GLN  78           HB1      GLN  78  12.780  -4.247 -17.220
  642   1HG   GLN  78           HG2      GLN  78  14.287  -2.513 -18.587
  643   2HG   GLN  78           HG1      GLN  78  12.821  -2.305 -19.537
  644   1HE2  GLN  78          HE22      GLN  78  11.385  -0.204 -17.117
  645   2HE2  GLN  78          HE21      GLN  78  11.463  -0.696 -18.740
  646    H    LEU  79           HN       LEU  79  11.784  -6.516 -19.697
  647    HA   LEU  79           HA       LEU  79  11.616  -8.401 -17.722
  648   1HB   LEU  79           HB2      LEU  79  10.815  -8.058 -20.533
  649   2HB   LEU  79           HB1      LEU  79  11.008  -9.720 -20.107
  650    HG   LEU  79           HG       LEU  79   9.391  -9.372 -18.192
  651   1HD1  LEU  79          HD13      LEU  79   9.858  -6.898 -17.837
  652   2HD1  LEU  79          HD12      LEU  79   9.073  -6.581 -19.383
  653   3HD1  LEU  79          HD11      LEU  79   8.153  -7.260 -18.047
  654   1HD2  LEU  79          HD22      LEU  79   8.498  -8.346 -20.892
  655   2HD2  LEU  79          HD21      LEU  79   8.631 -10.046 -20.436
  656   3HD2  LEU  79          HD23      LEU  79   7.437  -9.009 -19.645
  657    H    ILE  80           HN       ILE  80  13.412  -8.842 -20.813
  658    HA   ILE  80           HA       ILE  80  14.572 -11.316 -20.346
  659    HB   ILE  80           HB       ILE  80  15.887  -8.842 -21.559
  660   1HG1  ILE  80          HG12      ILE  80  13.638  -9.622 -22.496
  661   2HG1  ILE  80          HG11      ILE  80  14.939  -9.490 -23.622
  662   1HG2  ILE  80          HG22      ILE  80  16.655 -11.796 -21.916
  663   2HG2  ILE  80          HG21      ILE  80  17.349 -10.443 -22.788
  664   3HG2  ILE  80          HG23      ILE  80  17.596 -10.596 -21.062
  665   1HD1  ILE  80          HD12      ILE  80  13.968 -12.100 -22.314
  666   2HD1  ILE  80          HD11      ILE  80  13.589 -11.601 -23.947
  667   3HD1  ILE  80          HD13      ILE  80  15.235 -12.009 -23.522
  668    NH1  ARG  81           NH2      ARG  81  18.684  -2.328 -17.514
  669    NH2  ARG  81           NH1      ARG  81  19.138  -2.412 -19.743
  670    H    ARG  81           HN       ARG  81  16.016  -8.216 -19.353
  671    HA   ARG  81           HA       ARG  81  18.260  -9.165 -17.950
  672   1HB   ARG  81           HB2      ARG  81  16.469  -6.809 -17.242
  673   2HB   ARG  81           HB1      ARG  81  17.889  -7.204 -16.308
  674   1HG   ARG  81           HG2      ARG  81  19.175  -7.009 -18.578
  675   2HG   ARG  81           HG1      ARG  81  17.724  -6.204 -19.174
  676   1HD   ARG  81           HD2      ARG  81  17.842  -4.655 -17.148
  677   2HD   ARG  81           HD1      ARG  81  19.371  -5.409 -16.716
  678    HE   ARG  81           HE       ARG  81  20.231  -4.559 -18.963
  679   1HH1  ARG  81          HH21      ARG  81  18.659  -2.787 -16.625
  680   2HH1  ARG  81          HH22      ARG  81  18.399  -1.374 -17.595
  681   1HH2  ARG  81          HH11      ARG  81  19.453  -2.927 -20.540
  682   2HH2  ARG  81          HH12      ARG  81  18.855  -1.457 -19.838
  683    H    PHE  82           HN       PHE  82  15.087  -8.459 -16.477
  684    HA   PHE  82           HA       PHE  82  15.491  -9.561 -13.908
  685   1HB   PHE  82           HB2      PHE  82  13.055  -9.157 -15.566
  686   2HB   PHE  82           HB1      PHE  82  13.109  -9.489 -13.864
  687    HD1  PHE  82           HD1      PHE  82  15.956  -7.459 -14.501
  688    HD2  PHE  82           HD2      PHE  82  11.699  -7.230 -14.162
  689    HE1  PHE  82           HE1      PHE  82  16.121  -5.100 -14.016
  690    HE2  PHE  82           HE2      PHE  82  11.899  -4.842 -13.661
  691    HZ   PHE  82           HZ       PHE  82  14.104  -3.769 -13.592
  692    H    LEU  83           HN       LEU  83  14.185 -11.192 -16.776
  693    HA   LEU  83           HA       LEU  83  13.665 -13.700 -15.593
  694   1HB   LEU  83           HB2      LEU  83  14.783 -13.132 -18.405
  695   2HB   LEU  83           HB1      LEU  83  14.137 -14.689 -17.934
  696    HG   LEU  83           HG       LEU  83  12.572 -12.091 -18.087
  697   1HD1  LEU  83          HD11      LEU  83  13.162 -13.039 -20.278
  698   2HD1  LEU  83          HD13      LEU  83  12.489 -14.592 -19.804
  699   3HD1  LEU  83          HD12      LEU  83  11.440 -13.189 -19.974
  700   1HD2  LEU  83          HD22      LEU  83  11.726 -13.717 -16.284
  701   2HD2  LEU  83          HD21      LEU  83  10.587 -13.466 -17.581
  702   3HD2  LEU  83          HD23      LEU  83  11.562 -14.924 -17.545
  703    H    LYS  84           HN       LYS  84  16.673 -12.714 -17.243
  704    HA   LYS  84           HA       LYS  84  18.181 -15.010 -16.500
  705   1HB   LYS  84           HB2      LYS  84  18.918 -13.356 -18.220
  706   2HB   LYS  84           HB1      LYS  84  19.159 -12.158 -16.960
  707   1HG   LYS  84           HG2      LYS  84  20.926 -13.509 -15.923
  708   2HG   LYS  84           HG1      LYS  84  20.570 -14.864 -16.961
  709   1HD   LYS  84           HD2      LYS  84  22.630 -13.751 -17.671
  710   2HD   LYS  84           HD1      LYS  84  21.422 -13.635 -18.926
  711   1HE   LYS  84           HE1      LYS  84  21.963 -11.385 -16.935
  712   2HE   LYS  84           HE2      LYS  84  22.750 -11.498 -18.502
  713   1HZ   LYS  84           HZ3      LYS  84  20.007 -11.817 -18.892
  714   2HZ   LYS  84           HZ1      LYS  84  20.239 -10.449 -17.903
  715   3HZ   LYS  84           HZ2      LYS  84  21.013 -10.556 -19.416
  716    NH1  ARG  85           NH2      ARG  85  16.618  -7.058  -9.267
  717    NH2  ARG  85           NH1      ARG  85  18.109  -5.773 -10.432
  718    H    ARG  85           HN       ARG  85  18.082 -11.834 -14.965
  719    HA   ARG  85           HA       ARG  85  19.675 -12.034 -12.743
  720   1HB   ARG  85           HB2      ARG  85  18.473 -10.072 -13.532
  721   2HB   ARG  85           HB1      ARG  85  16.983 -10.735 -12.901
  722   1HG   ARG  85           HG2      ARG  85  17.529 -10.319 -10.691
  723   2HG   ARG  85           HG1      ARG  85  19.249 -10.549 -10.951
  724   1HD   ARG  85           HD2      ARG  85  19.504  -8.372 -11.933
  725   2HD   ARG  85           HD1      ARG  85  17.765  -8.170 -12.140
  726    HE   ARG  85           HE       ARG  85  18.950  -8.352  -9.392
  727   1HH1  ARG  85          HH21      ARG  85  16.336  -7.962  -8.949
  728   2HH1  ARG  85          HH22      ARG  85  16.055  -6.257  -9.067
  729   1HH2  ARG  85          HH11      ARG  85  18.960  -5.713 -10.956
  730   2HH2  ARG  85          HH12      ARG  85  17.556  -4.954 -10.281
  731    H    LEU  86           HN       LEU  86  16.311 -13.016 -12.881
  732    HA   LEU  86           HA       LEU  86  16.226 -14.093 -10.238
  733   1HB   LEU  86           HB2      LEU  86  13.961 -14.139 -10.743
  734   2HB   LEU  86           HB1      LEU  86  14.432 -13.240 -12.147
  735    HG   LEU  86           HG       LEU  86  14.523 -15.444 -13.429
  736   1HD1  LEU  86          HD12      LEU  86  12.945 -16.314 -10.985
  737   2HD1  LEU  86          HD11      LEU  86  13.137 -17.249 -12.461
  738   3HD1  LEU  86          HD13      LEU  86  14.520 -16.950 -11.424
  739   1HD2  LEU  86          HD23      LEU  86  12.710 -13.731 -13.621
  740   2HD2  LEU  86          HD22      LEU  86  12.053 -15.353 -13.766
  741   3HD2  LEU  86          HD21      LEU  86  11.876 -14.463 -12.260
  742    H    ASP  87           HN       ASP  87  16.359 -15.707 -13.460
  743    HA   ASP  87           HA       ASP  87  16.595 -18.355 -12.846
  744   1HB   ASP  87           HB2      ASP  87  16.662 -17.198 -15.090
  745   2HB   ASP  87           HB1      ASP  87  18.362 -16.885 -14.858
  746    NH1  ARG  88           NH1      ARG  88  25.291 -13.469 -13.342
  747    NH2  ARG  88           NH2      ARG  88  24.761 -11.620 -12.116
  748    H    ARG  88           HN       ARG  88  19.363 -16.186 -12.989
  749    HA   ARG  88           HA       ARG  88  21.486 -17.801 -12.224
  750   1HB   ARG  88           HB2      ARG  88  21.624 -15.351 -12.856
  751   2HB   ARG  88           HB1      ARG  88  21.021 -14.927 -11.266
  752   1HG   ARG  88           HG2      ARG  88  23.062 -16.397 -10.400
  753   2HG   ARG  88           HG1      ARG  88  23.674 -16.184 -12.031
  754   1HD   ARG  88           HD2      ARG  88  22.958 -13.959 -10.072
  755   2HD   ARG  88           HD1      ARG  88  24.583 -14.428 -10.567
  756    HE   ARG  88           HE       ARG  88  22.579 -13.300 -12.491
  757   1HH1  ARG  88          HH11      ARG  88  25.068 -14.403 -13.623
  758   2HH1  ARG  88          HH12      ARG  88  26.111 -13.020 -13.697
  759   1HH2  ARG  88          HH21      ARG  88  24.141 -11.164 -11.478
  760   2HH2  ARG  88          HH22      ARG  88  25.573 -11.144 -12.453
  761    H    ASN  89           HN       ASN  89  19.636 -15.764 -10.024
  762    HA   ASN  89           HA       ASN  89  20.568 -16.817  -7.583
  763   1HB   ASN  89           HB2      ASN  89  18.079 -15.300  -8.437
  764   2HB   ASN  89           HB1      ASN  89  18.271 -15.802  -6.767
  765   1HD2  ASN  89          HD22      ASN  89  20.531 -12.759  -8.216
  766   2HD2  ASN  89          HD21      ASN  89  19.481 -13.607  -9.234
  767    H    LEU  90           HN       LEU  90  17.640 -17.649  -9.336
  768    HA   LEU  90           HA       LEU  90  16.255 -19.437  -7.895
  769   1HB   LEU  90           HB2      LEU  90  15.940 -18.805 -10.336
  770   2HB   LEU  90           HB1      LEU  90  17.077 -20.068 -10.742
  771    HG   LEU  90           HG       LEU  90  15.138 -21.251  -8.963
  772   1HD1  LEU  90          HD13      LEU  90  13.960 -19.775 -11.358
  773   2HD1  LEU  90          HD12      LEU  90  13.091 -20.914 -10.341
  774   3HD1  LEU  90          HD11      LEU  90  13.647 -19.387  -9.672
  775   1HD2  LEU  90          HD21      LEU  90  15.620 -21.561 -11.958
  776   2HD2  LEU  90          HD23      LEU  90  16.493 -22.422 -10.698
  777   3HD2  LEU  90          HD22      LEU  90  14.780 -22.722 -10.941
  778    CH2  TRP  91           CH2      TRP  91  24.697 -25.119  -7.735
  779    H    TRP  91           HN       TRP  91  18.983 -20.368  -9.846
  780    HA   TRP  91           HA       TRP  91  19.430 -23.010  -9.459
  781   1HB   TRP  91           HB1      TRP  91  20.910 -21.248 -10.606
  782   2HB   TRP  91           HB2      TRP  91  21.697 -21.042  -9.049
  783    HD1  TRP  91           HD1      TRP  91  21.465 -23.417 -12.036
  784    HE1  TRP  91           HE1      TRP  91  23.116 -25.246 -11.611
  785    HE3  TRP  91           HE3      TRP  91  22.731 -22.418  -7.292
  786    HZ2  TRP  91           HZ2      TRP  91  24.828 -26.257  -9.531
  787    HZ3  TRP  91           HZ3      TRP  91  24.359 -23.806  -6.085
  788    HH2  TRP  91           HH2      TRP  91  25.412 -25.727  -7.201
  789    H    GLY  92           HN       GLY  92  20.457 -20.559  -7.171
  790   1HA   GLY  92           HA2      GLY  92  21.702 -22.016  -5.150
  791   2HA   GLY  92           HA1      GLY  92  20.741 -20.569  -4.850
  792    H    LEU  93           HN       LEU  93  18.339 -21.063  -5.125
  793    HA   LEU  93           HA       LEU  93  17.402 -22.587  -2.946
  794   1HB   LEU  93           HB2      LEU  93  15.746 -21.983  -5.444
  795   2HB   LEU  93           HB1      LEU  93  15.135 -22.355  -3.851
  796    HG   LEU  93           HG       LEU  93  16.629 -20.215  -3.162
  797   1HD1  LEU  93          HD11      LEU  93  17.422 -19.796  -5.608
  798   2HD1  LEU  93          HD13      LEU  93  15.728 -19.554  -5.991
  799   3HD1  LEU  93          HD12      LEU  93  16.542 -18.509  -4.845
  800   1HD2  LEU  93          HD22      LEU  93  13.931 -20.011  -4.552
  801   2HD2  LEU  93          HD21      LEU  93  14.149 -20.315  -2.835
  802   3HD2  LEU  93          HD23      LEU  93  14.612 -18.773  -3.534
  803    H    ALA  94           HN       ALA  94  17.244 -23.347  -6.349
  804    HA   ALA  94           HA       ALA  94  16.104 -25.894  -6.468
  805   1HB   ALA  94           HB3      ALA  94  16.960 -24.499  -8.430
  806   2HB   ALA  94           HB2      ALA  94  18.596 -24.969  -8.040
  807   3HB   ALA  94           HB1      ALA  94  17.442 -26.169  -8.546
  808    H    GLY  95           HN       GLY  95  19.634 -25.413  -6.085
  809   1HA   GLY  95           HA2      GLY  95  20.910 -26.590  -4.392
  810   2HA   GLY  95           HA1      GLY  95  19.621 -27.768  -4.248
  811    H    LEU  96           HN       LEU  96  19.463 -28.021  -7.171
  812    HA   LEU  96           HA       LEU  96  21.663 -29.980  -7.489
  813   1HB   LEU  96           HB2      LEU  96  19.975 -30.484  -9.609
  814   2HB   LEU  96           HB1      LEU  96  19.793 -31.167  -8.027
  815    HG   LEU  96           HG       LEU  96  18.149 -29.322  -7.454
  816   1HD1  LEU  96          HD13      LEU  96  18.343 -28.702 -10.437
  817   2HD1  LEU  96          HD12      LEU  96  17.163 -28.029  -9.351
  818   3HD1  LEU  96          HD11      LEU  96  18.853 -27.618  -9.156
  819   1HD2  LEU  96          HD23      LEU  96  17.496 -31.051  -9.848
  820   2HD2  LEU  96          HD22      LEU  96  17.386 -31.546  -8.166
  821   3HD2  LEU  96          HD21      LEU  96  16.330 -30.308  -8.776
  822    H    ASN  97           HN       ASN  97  20.921 -29.438 -10.651
  823    HA   ASN  97           HA       ASN  97  22.534 -26.979 -10.907
  824   1HB   ASN  97           HB2      ASN  97  24.221 -28.205 -12.407
  825   2HB   ASN  97           HB1      ASN  97  24.310 -28.625 -10.713
  826   1HD2  ASN  97          HD22      ASN  97  23.818 -32.029 -11.302
  827   2HD2  ASN  97          HD21      ASN  97  24.316 -30.801 -10.242
  828    H    SER  98           HN       SER  98  21.288 -29.659 -12.902
  829    HA   SER  98           HA       SER  98  19.580 -27.884 -14.436
  830   1HB   SER  98           HB1      SER  98  21.839 -27.373 -15.505
  831   2HB   SER  98           HB2      SER  98  22.016 -29.087 -15.881
  832    HG   SER  98           HG       SER  98  19.598 -27.886 -16.633
  833    H    CYS  99           HN       CYS  99  18.341 -29.096 -16.014
  834    HA   CYS  99           HA       CYS  99  18.561 -32.040 -15.950
  835   1HB   CYS  99           HB2      CYS  99  16.165 -30.494 -14.914
  836   2HB   CYS  99           HB1      CYS  99  16.039 -32.154 -15.412
  837    HA   PRO 100           HA       PRO 100  16.957 -31.527 -20.059
  838   1HB   PRO 100           HB2      PRO 100  15.334 -33.880 -20.123
  839   2HB   PRO 100           HB1      PRO 100  16.975 -33.735 -20.739
  840   1HG   PRO 100           HG2      PRO 100  16.024 -35.093 -18.294
  841   2HG   PRO 100           HG1      PRO 100  17.620 -35.151 -19.027
  842   1HD   PRO 100           HD1      PRO 100  16.929 -33.748 -16.648
  843   2HD   PRO 100           HD2      PRO 100  18.474 -33.649 -17.512
  844    H    VAL 101           HN       VAL 101  14.798 -31.265 -21.154
  845    HA   VAL 101           HA       VAL 101  12.698 -30.492 -19.158
  846    HB   VAL 101           HB       VAL 101  13.813 -28.547 -20.211
  847   1HG1  VAL 101          HG11      VAL 101  12.820 -29.619 -22.892
  848   2HG1  VAL 101          HG12      VAL 101  13.551 -28.053 -22.627
  849   3HG1  VAL 101          HG13      VAL 101  14.497 -29.508 -22.382
  850   1HG2  VAL 101          HG22      VAL 101  10.939 -28.926 -21.131
  851   2HG2  VAL 101          HG21      VAL 101  11.461 -28.311 -19.573
  852   3HG2  VAL 101          HG23      VAL 101  11.769 -27.386 -21.029
  853    H    LYS 102           HN       LYS 102  10.880 -31.465 -19.326
  854    HA   LYS 102           HA       LYS 102  10.040 -32.802 -21.871
  855   1HB   LYS 102           HB2      LYS 102   9.779 -33.804 -19.008
  856   2HB   LYS 102           HB1      LYS 102   8.944 -34.538 -20.369
  857   1HG   LYS 102           HG2      LYS 102  11.461 -34.569 -21.383
  858   2HG   LYS 102           HG1      LYS 102  11.883 -34.521 -19.680
  859   1HD   LYS 102           HD2      LYS 102  10.010 -36.562 -20.953
  860   2HD   LYS 102           HD1      LYS 102  11.696 -36.852 -20.585
  861   1HE   LYS 102           HE2      LYS 102  11.304 -36.670 -18.202
  862   2HE   LYS 102           HE1      LYS 102   9.660 -36.088 -18.441
  863   1HZ   LYS 102           HZ2      LYS 102   9.962 -38.494 -19.832
  864   2HZ   LYS 102           HZ1      LYS 102  10.552 -38.722 -18.257
  865   3HZ   LYS 102           HZ3      LYS 102   8.968 -38.160 -18.499
  866    H    GLU 103           HN       GLU 103   8.763 -31.132 -22.452
  867    HA   GLU 103           HA       GLU 103   7.115 -29.418 -21.245
  868   1HB   GLU 103           HB2      GLU 103   5.736 -29.367 -23.211
  869   2HB   GLU 103           HB1      GLU 103   7.322 -29.840 -23.731
  870   1HG   GLU 103           HG2      GLU 103   5.934 -31.329 -24.921
  871   2HG   GLU 103           HG1      GLU 103   6.525 -32.288 -23.572
  872    H    ALA 104           HN       ALA 104   5.299 -29.281 -20.117
  873    HA   ALA 104           HA       ALA 104   3.545 -31.628 -19.702
  874   1HB   ALA 104           HB3      ALA 104   4.932 -30.103 -17.486
  875   2HB   ALA 104           HB2      ALA 104   3.713 -31.358 -17.261
  876   3HB   ALA 104           HB1      ALA 104   5.260 -31.763 -18.001
  877    H    ASN 105           HN       ASN 105   2.744 -29.862 -21.156
  878    HA   ASN 105           HA       ASN 105   0.819 -28.577 -21.586
  879   1HB   ASN 105           HB2      ASN 105   0.705 -27.756 -18.600
  880   2HB   ASN 105           HB1      ASN 105  -0.534 -27.639 -19.821
  881   1HD2  ASN 105          HD22      ASN 105  -0.445 -31.534 -19.409
  882   2HD2  ASN 105          HD21      ASN 105   0.548 -30.648 -20.464
  883    H    GLN 106           HN       GLN 106   0.402 -26.084 -21.394
  884    HA   GLN 106           HA       GLN 106   3.075 -24.798 -21.114
  885   1HB   GLN 106           HB2      GLN 106   0.939 -24.534 -23.159
  886   2HB   GLN 106           HB1      GLN 106   1.839 -23.092 -22.773
  887   1HG   GLN 106           HG2      GLN 106   2.958 -24.284 -24.602
  888   2HG   GLN 106           HG1      GLN 106   3.976 -24.328 -23.178
  889   1HE2  GLN 106          HE22      GLN 106   4.100 -27.839 -23.259
  890   2HE2  GLN 106          HE21      GLN 106   4.893 -26.384 -22.885
  891    H    SER 107           HN       SER 107   3.351 -22.889 -20.553
  892    HA   SER 107           HA       SER 107   1.336 -21.463 -18.948
  893   1HB   SER 107           HB2      SER 107   2.971 -22.564 -17.436
  894   2HB   SER 107           HB1      SER 107   4.303 -21.770 -18.278
  895    HG   SER 107           HG       SER 107   2.404 -19.966 -17.677
  896    H    THR 108           HN       THR 108   1.072 -19.417 -19.389
  897    HA   THR 108           HA       THR 108   2.675 -18.080 -21.503
  898    HB   THR 108           HB       THR 108   0.946 -16.177 -21.018
  899    HG1  THR 108           HG1      THR 108  -0.096 -16.472 -19.246
  900   1HG2  THR 108          HG22      THR 108  -0.216 -18.925 -21.700
  901   2HG2  THR 108          HG21      THR 108  -1.018 -17.381 -21.992
  902   3HG2  THR 108          HG23      THR 108   0.461 -17.764 -22.845
  903    H    LEU 109           HN       LEU 109   4.580 -17.810 -20.458
  904    HA   LEU 109           HA       LEU 109   5.917 -17.294 -18.339
  905   1HB   LEU 109           HB2      LEU 109   6.497 -16.173 -20.520
  906   2HB   LEU 109           HB1      LEU 109   5.633 -14.794 -19.908
  907    HG   LEU 109           HG       LEU 109   7.141 -14.683 -17.879
  908   1HD1  LEU 109          HD11      LEU 109   7.825 -17.081 -17.709
  909   2HD1  LEU 109          HD13      LEU 109   8.756 -16.903 -19.184
  910   3HD1  LEU 109          HD12      LEU 109   9.192 -15.997 -17.754
  911   1HD2  LEU 109          HD22      LEU 109   7.852 -13.357 -19.924
  912   2HD2  LEU 109          HD21      LEU 109   9.208 -13.926 -18.981
  913   3HD2  LEU 109          HD23      LEU 109   8.768 -14.748 -20.454
  914    H    GLU 110           HN       GLU 110   3.649 -14.568 -18.793
  915    HA   GLU 110           HA       GLU 110   3.889 -13.279 -16.376
  916   1HB   GLU 110           HB2      GLU 110   2.217 -12.649 -18.125
  917   2HB   GLU 110           HB1      GLU 110   1.261 -14.063 -17.738
  918   1HG   GLU 110           HG2      GLU 110   1.260 -12.932 -15.255
  919   2HG   GLU 110           HG1      GLU 110   1.548 -11.491 -16.215
  920    H    ASN 111           HN       ASN 111   1.805 -16.033 -16.920
  921    HA   ASN 111           HA       ASN 111   0.885 -16.515 -14.293
  922   1HB   ASN 111           HB2      ASN 111   0.032 -17.418 -16.569
  923   2HB   ASN 111           HB1      ASN 111   1.297 -18.626 -16.467
  924   1HD2  ASN 111          HD22      ASN 111  -2.095 -19.556 -14.839
  925   2HD2  ASN 111          HD21      ASN 111  -1.800 -18.588 -16.206
  926    H    PHE 112           HN       PHE 112   3.381 -18.284 -16.105
  927    HA   PHE 112           HA       PHE 112   4.436 -20.007 -14.241
  928   1HB   PHE 112           HB2      PHE 112   5.304 -19.719 -16.607
  929   2HB   PHE 112           HB1      PHE 112   6.126 -18.252 -16.108
  930    HD1  PHE 112           HD1      PHE 112   5.874 -21.880 -15.184
  931    HD2  PHE 112           HD2      PHE 112   8.340 -18.407 -15.340
  932    HE1  PHE 112           HE1      PHE 112   7.795 -23.205 -14.439
  933    HE2  PHE 112           HE2      PHE 112  10.262 -19.740 -14.600
  934    HZ   PHE 112           HZ       PHE 112   9.993 -22.142 -14.148
  935    H    LEU 113           HN       LEU 113   5.491 -16.695 -14.713
  936    HA   LEU 113           HA       LEU 113   7.250 -16.428 -12.519
  937   1HB   LEU 113           HB2      LEU 113   5.478 -14.309 -13.796
  938   2HB   LEU 113           HB1      LEU 113   6.888 -13.976 -12.810
  939    HG   LEU 113           HG       LEU 113   6.960 -15.491 -15.455
  940   1HD1  LEU 113          HD13      LEU 113   6.273 -13.124 -15.714
  941   2HD1  LEU 113          HD12      LEU 113   7.670 -12.623 -14.778
  942   3HD1  LEU 113          HD11      LEU 113   7.896 -13.371 -16.349
  943   1HD2  LEU 113          HD22      LEU 113   8.859 -16.001 -13.876
  944   2HD2  LEU 113          HD21      LEU 113   9.399 -15.115 -15.293
  945   3HD2  LEU 113          HD23      LEU 113   9.193 -14.276 -13.756
  946    H    GLU 114           HN       GLU 114   3.859 -15.244 -12.706
  947    HA   GLU 114           HA       GLU 114   3.336 -14.416 -10.188
  948   1HB   GLU 114           HB2      GLU 114   1.598 -16.108 -12.043
  949   2HB   GLU 114           HB1      GLU 114   0.976 -15.554 -10.511
  950   1HG   GLU 114           HG2      GLU 114   2.255 -13.605 -12.464
  951   2HG   GLU 114           HG1      GLU 114   0.580 -14.093 -12.660
  952    NH1  ARG 115           NH2      ARG 115  -0.326 -23.539 -11.649
  953    NH2  ARG 115           NH1      ARG 115  -1.545 -21.975 -12.769
  954    H    ARG 115           HN       ARG 115   3.109 -17.784 -11.124
  955    HA   ARG 115           HA       ARG 115   2.533 -18.859  -8.533
  956   1HB   ARG 115           HB2      ARG 115   4.082 -20.262 -10.775
  957   2HB   ARG 115           HB1      ARG 115   3.315 -21.042  -9.404
  958   1HG   ARG 115           HG2      ARG 115   1.102 -20.142 -10.186
  959   2HG   ARG 115           HG1      ARG 115   1.905 -19.508 -11.620
  960   1HD   ARG 115           HD2      ARG 115   2.701 -21.844 -12.137
  961   2HD   ARG 115           HD1      ARG 115   1.725 -22.447 -10.803
  962    HE   ARG 115           HE       ARG 115   0.635 -21.009 -13.184
  963   1HH1  ARG 115          HH21      ARG 115   0.552 -23.841 -11.278
  964   2HH1  ARG 115          HH22      ARG 115  -1.139 -24.112 -11.539
  965   1HH2  ARG 115          HH11      ARG 115  -1.577 -21.097 -13.246
  966   2HH2  ARG 115          HH12      ARG 115  -2.376 -22.523 -12.671
  967    H    LEU 116           HN       LEU 116   5.601 -18.848 -10.282
  968    HA   LEU 116           HA       LEU 116   7.381 -19.780  -8.398
  969   1HB   LEU 116           HB2      LEU 116   7.649 -18.725 -10.880
  970   2HB   LEU 116           HB1      LEU 116   8.178 -17.328  -9.971
  971    HG   LEU 116           HG       LEU 116   9.827 -18.900  -8.758
  972   1HD1  LEU 116          HD12      LEU 116   9.070 -20.699 -11.113
  973   2HD1  LEU 116          HD13      LEU 116  10.395 -20.994 -10.013
  974   3HD1  LEU 116          HD11      LEU 116   8.745 -21.074  -9.431
  975   1HD2  LEU 116          HD21      LEU 116  10.127 -18.498 -11.765
  976   2HD2  LEU 116          HD23      LEU 116  10.540 -17.310 -10.534
  977   3HD2  LEU 116          HD22      LEU 116  11.445 -18.812 -10.640
  978    H    LYS 117           HN       LYS 117   6.477 -16.432  -8.811
  979    HA   LYS 117           HA       LYS 117   7.862 -15.163  -6.755
  980   1HB   LYS 117           HB2      LYS 117   6.453 -14.054  -8.555
  981   2HB   LYS 117           HB1      LYS 117   5.022 -14.459  -7.635
  982   1HG   LYS 117           HG2      LYS 117   6.571 -13.296  -5.660
  983   2HG   LYS 117           HG1      LYS 117   7.205 -12.493  -7.065
  984   1HD   LYS 117           HD2      LYS 117   4.332 -12.475  -6.093
  985   2HD   LYS 117           HD1      LYS 117   5.439 -11.131  -6.048
  986   1HE   LYS 117           HE2      LYS 117   4.148 -10.589  -7.932
  987   2HE   LYS 117           HE1      LYS 117   5.491 -11.429  -8.690
  988   1HZ   LYS 117           HZ2      LYS 117   3.567 -13.332  -7.926
  989   2HZ   LYS 117           HZ1      LYS 117   2.793 -12.071  -8.740
  990   3HZ   LYS 117           HZ3      LYS 117   4.073 -12.888  -9.489
  991    H    THR 118           HN       THR 118   4.414 -16.125  -6.654
  992    HA   THR 118           HA       THR 118   3.769 -15.744  -4.014
  993    HB   THR 118           HB       THR 118   2.937 -18.043  -5.879
  994    HG1  THR 118           HG1      THR 118   2.536 -16.120  -6.723
  995   1HG2  THR 118          HG21      THR 118   1.437 -16.756  -3.510
  996   2HG2  THR 118          HG23      THR 118   0.846 -18.053  -4.534
  997   3HG2  THR 118          HG22      THR 118   2.163 -18.353  -3.410
  998    H    ILE 119           HN       ILE 119   5.067 -18.746  -5.313
  999    HA   ILE 119           HA       ILE 119   5.421 -20.263  -3.008
 1000    HB   ILE 119           HB       ILE 119   6.996 -19.997  -5.586
 1001   1HG1  ILE 119          HG12      ILE 119   5.414 -22.349  -4.566
 1002   2HG1  ILE 119          HG11      ILE 119   4.631 -21.006  -5.380
 1003   1HG2  ILE 119          HG23      ILE 119   7.630 -22.024  -3.409
 1004   2HG2  ILE 119          HG22      ILE 119   8.303 -22.018  -5.037
 1005   3HG2  ILE 119          HG21      ILE 119   8.688 -20.722  -3.938
 1006   1HD1  ILE 119          HD11      ILE 119   6.901 -22.679  -6.522
 1007   2HD1  ILE 119          HD13      ILE 119   5.209 -22.788  -6.986
 1008   3HD1  ILE 119          HD12      ILE 119   6.121 -21.324  -7.328
 1009    H    MET 120           HN       MET 120   7.993 -18.367  -4.484
 1010    HA   MET 120           HA       MET 120   9.963 -18.380  -2.568
 1011   1HB   MET 120           HB2      MET 120   8.983 -16.019  -4.188
 1012   2HB   MET 120           HB1      MET 120  10.509 -16.042  -3.324
 1013   1HG   MET 120           HG2      MET 120   9.724 -17.943  -5.531
 1014   2HG   MET 120           HG1      MET 120  10.726 -16.548  -5.737
 1015   1HE   MET 120           HE1      MET 120  10.476 -19.805  -5.935
 1016   2HE   MET 120           HE3      MET 120  12.166 -20.140  -6.242
 1017   3HE   MET 120           HE2      MET 120  11.413 -20.659  -4.717
 1018    NH1  ARG 121           NH2      ARG 121   3.210 -11.556   0.007
 1019    NH2  ARG 121           NH1      ARG 121   2.105 -11.298  -1.975
 1020    H    ARG 121           HN       ARG 121   7.401 -16.024  -2.725
 1021    HA   ARG 121           HA       ARG 121   7.851 -14.599  -0.347
 1022   1HB   ARG 121           HB2      ARG 121   5.663 -14.910  -2.299
 1023   2HB   ARG 121           HB1      ARG 121   5.056 -14.580  -0.690
 1024   1HG   ARG 121           HG2      ARG 121   6.402 -12.558  -0.516
 1025   2HG   ARG 121           HG1      ARG 121   7.245 -12.932  -2.012
 1026   1HD   ARG 121           HD2      ARG 121   5.326 -11.197  -2.169
 1027   2HD   ARG 121           HD1      ARG 121   5.303 -12.500  -3.352
 1028    HE   ARG 121           HE       ARG 121   3.583 -13.624  -1.930
 1029   1HH1  ARG 121          HH21      ARG 121   3.945 -11.989   0.529
 1030   2HH1  ARG 121          HH22      ARG 121   2.594 -10.906   0.455
 1031   1HH2  ARG 121          HH11      ARG 121   2.013 -11.541  -2.940
 1032   2HH2  ARG 121          HH12      ARG 121   1.474 -10.642  -1.560
 1033    H    GLU 122           HN       GLU 122   5.536 -17.207  -0.774
 1034    HA   GLU 122           HA       GLU 122   4.374 -17.599   1.632
 1035   1HB   GLU 122           HB2      GLU 122   4.320 -19.050  -0.583
 1036   2HB   GLU 122           HB1      GLU 122   5.590 -19.984   0.166
 1037   1HG   GLU 122           HG2      GLU 122   3.626 -21.174   0.722
 1038   2HG   GLU 122           HG1      GLU 122   3.982 -20.278   2.187
 1039    H    LYS 123           HN       LYS 123   7.501 -18.843   0.740
 1040    HA   LYS 123           HA       LYS 123   8.182 -19.867   3.392
 1041   1HB   LYS 123           HB2      LYS 123   9.972 -19.320   0.975
 1042   2HB   LYS 123           HB1      LYS 123  10.449 -20.212   2.411
 1043   1HG   LYS 123           HG2      LYS 123   8.623 -21.872   1.959
 1044   2HG   LYS 123           HG1      LYS 123   8.221 -20.999   0.486
 1045   1HD   LYS 123           HD2      LYS 123  10.544 -21.381  -0.363
 1046   2HD   LYS 123           HD1      LYS 123  10.921 -22.286   1.092
 1047   1HE   LYS 123           HE2      LYS 123   9.142 -23.952   0.526
 1048   2HE   LYS 123           HE1      LYS 123   8.765 -23.048  -0.933
 1049   1HZ   LYS 123           HZ2      LYS 123  11.521 -23.527  -0.880
 1050   2HZ   LYS 123           HZ1      LYS 123  10.724 -24.992  -0.563
 1051   3HZ   LYS 123           HZ3      LYS 123  10.362 -24.119  -1.971
 1052    OH   TYR 124           OH       TYR 124  12.549  -9.793   2.762
 1053    H    TYR 124           HN       TYR 124   9.372 -17.171   1.425
 1054    HA   TYR 124           HA       TYR 124  11.188 -15.824   2.844
 1055   1HB   TYR 124           HB2      TYR 124  10.165 -15.058   0.729
 1056   2HB   TYR 124           HB1      TYR 124   8.780 -14.454   1.618
 1057    HD1  TYR 124           HD1      TYR 124  12.517 -14.199   1.735
 1058    HD2  TYR 124           HD2      TYR 124   8.776 -12.234   2.266
 1059    HE1  TYR 124           HE1      TYR 124  13.685 -12.095   2.191
 1060    HE2  TYR 124           HE2      TYR 124   9.941 -10.133   2.724
 1061    HH   TYR 124           HH       TYR 124  12.959  -9.932   3.617
 1062    H    SER 125           HN       SER 125   7.785 -15.179   3.359
 1063    HA   SER 125           HA       SER 125   8.279 -13.844   5.954
 1064   1HB   SER 125           HB2      SER 125   5.711 -14.080   4.309
 1065   2HB   SER 125           HB1      SER 125   5.925 -13.083   5.755
 1066    HG   SER 125           HG       SER 125   6.756 -12.628   3.233
 1067    H    LYS 126           HN       LYS 126   8.481 -16.809   5.826
 1068    HA   LYS 126           HA       LYS 126   6.547 -17.409   8.017
 1069   1HB   LYS 126           HB2      LYS 126   5.702 -18.398   5.913
 1070   2HB   LYS 126           HB1      LYS 126   7.220 -19.245   5.667
 1071   1HG   LYS 126           HG2      LYS 126   6.879 -20.599   7.641
 1072   2HG   LYS 126           HG1      LYS 126   5.536 -19.602   8.179
 1073   1HD   LYS 126           HD2      LYS 126   4.256 -20.319   6.123
 1074   2HD   LYS 126           HD1      LYS 126   5.595 -21.373   5.694
 1075   1HE   LYS 126           HE2      LYS 126   5.318 -22.664   7.767
 1076   2HE   LYS 126           HE1      LYS 126   4.098 -21.544   8.353
 1077   1HZ   LYS 126           HZ3      LYS 126   3.321 -22.452   5.822
 1078   2HZ   LYS 126           HZ1      LYS 126   3.748 -23.800   6.765
 1079   3HZ   LYS 126           HZ2      LYS 126   2.573 -22.711   7.324
 1080    H    CYS 127           HN       CYS 127   9.352 -18.608   6.292
 1081    HA   CYS 127           HA       CYS 127  10.444 -20.205   8.413
 1082   1HB   CYS 127           HB2      CYS 127  11.356 -20.754   6.349
 1083   2HB   CYS 127           HB1      CYS 127  11.452 -19.100   5.797
 1084    H    SER 128           HN       SER 128  10.608 -16.938   7.450
 1085    HA   SER 128           HA       SER 128  12.736 -16.107   9.259
 1086   1HB   SER 128           HB2      SER 128  10.732 -14.581   7.512
 1087   2HB   SER 128           HB1      SER 128  11.989 -13.768   8.434
 1088    HG   SER 128           HG       SER 128  13.180 -15.748   7.251
 1089    H    SER 129           HN       SER 129   9.691 -14.456   9.094
 1090    HA   SER 129           HA       SER 129   9.118 -14.990  11.974
 1091   1HB   SER 129           HB1      SER 129   8.491 -12.513  12.158
 1092   2HB   SER 129           HB2      SER 129  10.195 -12.745  11.761
 1093    HG   SER 129           HG       SER 129   8.865 -12.852   9.487