NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
13986 1wcr cing 1-original 5 XPLOR/CNS distance NOE simple


!@ BEGIN_XPLR_NOE_FILE
!
! A1

! E2

! E3

! L4

! E5

! E6

! V7


assign (segid A and resid   7 and name HG1# ) (segid A and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid A and resid   7 and name HG1# ) (segid A and resid 58 and name  HD2# )  2.5  0.7  1.2
assign (segid A and resid   7 and name HG2# ) (segid A and resid 58 and name  HD1# )  4.0  2.2  2.0
assign (segid A and resid   7 and name HG2# ) (segid A and resid 58 and name  HD2# )  4.0  2.2  2.0

assign (segid B and resid   7 and name HG1# ) (segid B and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid B and resid   7 and name HG1# ) (segid B and resid 58 and name  HD2# )  2.5  0.7  1.2
assign (segid B and resid   7 and name HG2# ) (segid B and resid 58 and name  HD1# )  4.0  2.2  2.0
assign (segid B and resid   7 and name HG2# ) (segid B and resid 58 and name  HD2# )  4.0  2.2  2.0

assign (segid C and resid   7 and name HG1# ) (segid C and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid C and resid   7 and name HG1# ) (segid C and resid 58 and name  HD2# )  2.5  0.7  1.2
assign (segid C and resid   7 and name HG2# ) (segid C and resid 58 and name  HD1# )  4.0  2.2  2.0
assign (segid C and resid   7 and name HG2# ) (segid C and resid 58 and name  HD2# )  4.0  2.2  2.0


! V8
assign (segid A and resid   8 and name HG2# ) (segid A and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid A and resid   8 and name HG2# ) (segid A and resid 58 and name  HD2# )  3.0  1.2  1.3
assign (segid A and resid   8 and name HG2# ) (segid A and resid 73 and name  HG2# )  3.0  1.2  1.3
assign (segid A and resid   8 and name HG2# ) (segid A and resid 77 and name  HN   )  4.0  2.2  1.5
assign (segid A and resid   8 and name HG1# ) (segid A and resid 77 and name  HN   )  3.0  1.2  1.0

assign (segid B and resid   8 and name HG2# ) (segid B and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid B and resid   8 and name HG2# ) (segid B and resid 58 and name  HD2# )  3.0  1.2  1.3
assign (segid B and resid   8 and name HG2# ) (segid B and resid 73 and name  HG2# )  3.0  1.2  1.3
assign (segid B and resid   8 and name HG2# ) (segid B and resid 77 and name  HN   )  4.0  2.2  1.5
assign (segid B and resid   8 and name HG1# ) (segid B and resid 77 and name  HN   )  3.0  1.2  1.0

assign (segid C and resid   8 and name HG2# ) (segid C and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid C and resid   8 and name HG2# ) (segid C and resid 58 and name  HD2# )  3.0  1.2  1.3
assign (segid C and resid   8 and name HG2# ) (segid C and resid 73 and name  HG2# )  3.0  1.2  1.3
assign (segid C and resid   8 and name HG2# ) (segid C and resid 77 and name  HN   )  4.0  2.2  1.5
assign (segid C and resid   8 and name HG1# ) (segid C and resid 77 and name  HN   )  3.0  1.2  1.0

! M9

! G10

! L11
assign (segid A and resid   11 and name HD1# ) (segid A and resid 54 and name  HG1# )  3.0  1.2  1.3
assign (segid A and resid   11 and name HD1# ) (segid A and resid 54 and name  HG2# )  4.0  2.2  2.0
assign (segid A and resid   11 and name HD1# ) (segid A and resid 55 and name  HN   )  4.0  2.2  1.5
assign (segid A and resid   11 and name HD1# ) (segid A and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid A and resid   11 and name HD1# ) (segid A and resid 58 and name  HD2# )  4.0  2.2  2.0

assign (segid B and resid   11 and name HD1# ) (segid B and resid 54 and name  HG1# )  3.0  1.2  1.3
assign (segid B and resid   11 and name HD1# ) (segid B and resid 54 and name  HG2# )  4.0  2.2  2.0
assign (segid B and resid   11 and name HD1# ) (segid B and resid 55 and name  HN   )  4.0  2.2  1.5
assign (segid B and resid   11 and name HD1# ) (segid B and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid B and resid   11 and name HD1# ) (segid B and resid 58 and name  HD2# )  4.0  2.2  2.0

assign (segid C and resid   11 and name HD1# ) (segid C and resid 54 and name  HG1# )  3.0  1.2  1.3
assign (segid C and resid   11 and name HD1# ) (segid C and resid 54 and name  HG2# )  4.0  2.2  2.0
assign (segid C and resid   11 and name HD1# ) (segid C and resid 55 and name  HN   )  4.0  2.2  1.5
assign (segid C and resid   11 and name HD1# ) (segid C and resid 58 and name  HD1# )  3.0  1.2  1.3
assign (segid C and resid   11 and name HD1# ) (segid C and resid 58 and name  HD2# )  4.0  2.2  2.0
 
! I12
! assign (segid A and resid  12 and name HD1# ) (segid C and resid 59 and name  HG2# )  4.0  2.2  2.0
! assign (segid A and resid  12 and name HD1# ) (segid C and resid 59 and name  HB   )  3.0  1.2  0.8

! assign (segid B and resid  12 and name HD1# ) (segid A and resid 59 and name  HG2# )  4.0  2.2  2.0
! assign (segid B and resid  12 and name HD1# ) (segid A and resid 59 and name  HB   )  3.0  1.2  0.8

! assign (segid C and resid  12 and name HD1# ) (segid B and resid 59 and name  HG2# )  4.0  2.2  2.0
! assign (segid C and resid  12 and name HD1# ) (segid B and resid 59 and name  HB   )  3.0  1.2  0.8

! I13

! N14

! S15

! G16

! Q17

! A18

! R19

! S20

! L21
assign (segid A and resid  21 and name HD1# ) (segid A and resid 44 and name   HN )  4.0  2.2  1.5
assign (segid A and resid  21 and name HD2# ) (segid A and resid 44 and name   HN )  4.0  2.2  1.5

assign (segid B and resid  21 and name HD1# ) (segid B and resid 44 and name   HN )  4.0  2.2  1.5
assign (segid B and resid  21 and name HD2# ) (segid B and resid 44 and name   HN )  4.0  2.2  1.5

assign (segid C and resid  21 and name HD1# ) (segid C and resid 44 and name   HN )  4.0  2.2  1.5
assign (segid C and resid  21 and name HD2# ) (segid C and resid 44 and name   HN )  4.0  2.2  1.5

! A22

! Y23

! A24

! A25

! L26
assign (segid A and resid  26 and name HD2# ) (segid C and resid 90 and name   HD2# )  4.0  2.2  2.0
assign (segid A and resid  26 and name HD2# ) (segid C and resid 90 and name   HA   )  4.0  2.2  2.5
assign (segid A and resid  26 and name HD1# ) (segid A and resid 91 and name   HD1# )  4.0  2.2  2.0 
assign (segid A and resid  26 and name HD2# ) (segid A and resid 91 and name   HD1# )  3.0  1.2  1.3 
assign (segid A and resid  26 and name HN   ) (segid A and resid 95 and name   HD1# )  3.0  1.2  1.0
assign (segid A and resid  26 and name HD1# ) (segid A and resid 95 and name   HD1# )  4.0  2.2  2.0
assign (segid A and resid  26 and name HD2# ) (segid A and resid 95 and name   HD1# )  4.0  2.2  3.0
assign (segid A and resid  26 and name HD1# ) (segid A and resid 95 and name   HN   )  3.0  1.2  1.0

assign (segid B and resid  26 and name HD2# ) (segid A and resid 90 and name   HD2# )  4.0  2.2  2.0
assign (segid B and resid  26 and name HD2# ) (segid A and resid 90 and name   HA   )  4.0  2.2  2.5
assign (segid B and resid  26 and name HD1# ) (segid B and resid 91 and name   HD1# )  4.0  2.2  2.0 
assign (segid B and resid  26 and name HD2# ) (segid B and resid 91 and name   HD1# )  3.0  1.2  1.3 
assign (segid B and resid  26 and name HN   ) (segid B and resid 95 and name   HD1# )  3.0  1.2  1.0
assign (segid B and resid  26 and name HD1# ) (segid B and resid 95 and name   HD1# )  4.0  2.2  2.0
assign (segid B and resid  26 and name HD2# ) (segid B and resid 95 and name   HD1# )  4.0  2.2  3.0
assign (segid B and resid  26 and name HD1# ) (segid B and resid 95 and name   HN   )  3.0  1.2  1.0

assign (segid C and resid  26 and name HD2# ) (segid B and resid 90 and name   HD2# )  4.0  2.2  2.0
assign (segid C and resid  26 and name HD2# ) (segid B and resid 90 and name   HA   )  4.0  2.2  2.5
assign (segid C and resid  26 and name HD1# ) (segid C and resid 91 and name   HD1# )  4.0  2.2  2.0 
assign (segid C and resid  26 and name HD2# ) (segid C and resid 91 and name   HD1# )  3.0  1.2  1.3 
assign (segid C and resid  26 and name HN   ) (segid C and resid 95 and name   HD1# )  3.0  1.2  1.0
assign (segid C and resid  26 and name HD1# ) (segid C and resid 95 and name   HD1# )  4.0  2.2  2.0
assign (segid C and resid  26 and name HD2# ) (segid C and resid 95 and name   HD1# )  4.0  2.2  3.0
assign (segid C and resid  26 and name HD1# ) (segid C and resid 95 and name   HN   )  3.0  1.2  1.0


! K27

! Q28

! A29

! K30

! Q31

! G32

! D33

! F34

! A35

! A36

! A37

! K38

! A39

! M40

! M41

! D42

! Q43

! S44

! R45

! M46

! A47

! L48
assign (segid A and resid  48 and name HD* ) (segid A and resid 85 and name   HN )  3.0  1.2  1.5 

assign (segid B and resid  48 and name HD* ) (segid B and resid 85 and name   HN )  3.0  1.2  1.5 

assign (segid C and resid  48 and name HD* ) (segid C and resid 85 and name   HN )  3.0  1.2  1.5 

! N49

! E50

! A51

! H52

! L53

! V54

! Q55

! T56

! K57

! L58
assign (segid A and resid  58 and name HD1# ) (segid A and resid 73 and name   HG1# )  4.0  2.2  2.0
assign (segid A and resid  58 and name HD1# ) (segid A and resid 73 and name   HG2# )  4.0  2.2  3.0
assign (segid A and resid  58 and name HD2# ) (segid A and resid 73 and name   HG1# )  4.0  2.2  2.0
assign (segid A and resid  58 and name HD2# ) (segid A and resid 73 and name   HG2# )  4.0  2.2  3.0

assign (segid B and resid  58 and name HD1# ) (segid B and resid 73 and name   HG1# )  4.0  2.2  2.0
assign (segid B and resid  58 and name HD1# ) (segid B and resid 73 and name   HG2# )  4.0  2.2  3.0
assign (segid B and resid  58 and name HD2# ) (segid B and resid 73 and name   HG1# )  4.0  2.2  2.0
assign (segid B and resid  58 and name HD2# ) (segid B and resid 73 and name   HG2# )  4.0  2.2  3.0

assign (segid C and resid  58 and name HD1# ) (segid C and resid 73 and name   HG1# )  4.0  2.2  2.0
assign (segid C and resid  58 and name HD1# ) (segid C and resid 73 and name   HG2# )  4.0  2.2  3.0
assign (segid C and resid  58 and name HD2# ) (segid C and resid 73 and name   HG1# )  4.0  2.2  2.0
assign (segid C and resid  58 and name HD2# ) (segid C and resid 73 and name   HG2# )  4.0  2.2  3.0

! I59
assign (segid A and resid  59 and name HD1# ) (segid A and resid 70 and name   HG* )  4.0  2.2  3.0
assign (segid B and resid  59 and name HD1# ) (segid B and resid 70 and name   HG* )  4.0  2.2  3.0
assign (segid C and resid  59 and name HD1# ) (segid C and resid 70 and name   HG* )  4.0  2.2  3.0

! E60

! G61

! D62

! A63

! G64

! E65

! G66

! K67

! M68

! K69

! V70
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  72 and name HD*  )  4.0  2.2  2.0
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  73 and name HG1# )  4.0  2.2  3.0
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  73 and name HG2# )  4.0  2.2  3.0
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  75 and name HG2# )  4.0  2.2  3.0
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  75 and name HB   )  4.0  2.2  2.5 
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  76 and name HE1  )  4.0  2.2  2.5 
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  76 and name HD2  )  4.0  2.2  2.5 
assign (segid A and resid  70 and name  HG* ) ((segid B or segid C) and resid  76 and name HB#  )  4.0  2.2  2.5 

assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  72 and name HD*  )  4.0  2.2  2.0 
assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  73 and name HG1# )  4.0  2.2  3.0
assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  73 and name HG2# )  4.0  2.2  3.0
assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  75 and name HG2# )  4.0  2.2  3.0
assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  75 and name HB   )  4.0  2.2  2.5 
assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  76 and name HE1  )  4.0  2.2  2.5 
assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  76 and name HD2  )  4.0  2.2  2.5 
assign (segid B and resid  70 and name  HG* ) ((segid C or segid A) and resid  76 and name HB#  )  4.0  2.2  2.5

assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  72 and name HD*  )  4.0  2.2  2.0
assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  73 and name HG1# )  4.0  2.2  3.0
assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  73 and name HG2# )  4.0  2.2  3.0
assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  75 and name HG2# )  4.0  2.2  3.0
assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  75 and name HB   )  4.0  2.2  2.5 
assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  76 and name HE1  )  4.0  2.2  2.5 
assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  76 and name HD2  )  4.0  2.2  2.5 
assign (segid C and resid  70 and name  HG* ) ((segid A or segid B) and resid  76 and name HB#  )  4.0  2.2  2.5

! S71

! L72
assign (segid A and resid  72 and name  HD* ) ((segid B or segid C) and resid 59 and name  HG2# )  4.0  2.2  3.0
! assign (segid A and resid  72 and name  HD* ) ((segid B or segid C) and resid 62 and name  HA   )  4.0  2.2  2.5 
assign (segid A and resid  72 and name  HD* ) ((segid B or segid C) and resid 75 and name  HG2# )  4.0  2.2  2.0

assign (segid B and resid  72 and name  HD* ) ((segid C or segid A) and resid 59 and name  HG2# )  4.0  2.2  3.0
! assign (segid B and resid  72 and name  HD* ) ((segid C or segid A) and resid 62 and name  HA   )  4.0  2.2  2.5 
assign (segid B and resid  72 and name  HD* ) ((segid C or segid A) and resid 75 and name  HG2# )  4.0  2.2  2.0

assign (segid C and resid  72 and name  HD* ) ((segid A or segid B) and resid 59 and name  HG2# )  4.0  2.2  3.0
! assign (segid C and resid  72 and name  HD* ) ((segid A or segid B) and resid 62 and name  HA   )  4.0  2.2  2.5 
assign (segid C and resid  72 and name  HD* ) ((segid A or segid B) and resid 75 and name  HG2# )  4.0  2.2  2.0

! V73
! assign (segid A and resid  73 and name HG2# ) (segid C and resid 60 and name  HB# )  4.0  2.2  1.5
! assign (segid A and resid  73 and name HG1# ) (segid C and resid 60 and name  HB# )  4.0  2.2  1.5

! assign (segid B and resid  73 and name HG2# ) (segid A and resid 60 and name  HB# )  4.0  2.2  1.5
! assign (segid B and resid  73 and name HG1# ) (segid A and resid 60 and name  HB# )  4.0  2.2  1.5

! assign (segid C and resid  73 and name HG2# ) (segid B and resid 60 and name  HB# )  4.0  2.2  1.5
! assign (segid C and resid  73 and name HG1# ) (segid B and resid 60 and name  HB# )  4.0  2.2  1.5


! L74

! V75
assign (segid A and resid  75 and name HG1# ) ((segid B or segid C) and resid 75 and name HA   )  4.0  2.2  2.5
assign (segid A and resid  75 and name HG1# ) ((segid B or segid C) and resid 76 and name HD2  )  4.0  2.2  2.5
assign (segid A and resid  75 and name HG1# ) ((segid B or segid C) and resid 76 and name HA   )  4.0  2.2  2.5
assign (segid A and resid  75 and name HG1# ) ((segid B or segid C) and resid 79 and name HD2# )  3.0  1.2  1.3
assign (segid A and resid  75 and name HG2# ) ((segid B or segid C) and resid 75 and name HB   )  4.0  2.2  2.0
assign (segid A and resid  75 and name HG2# ) ((segid B or segid C) and resid 75 and name HG2# )  4.0  2.2  2.0
assign (segid A and resid  75 and name HG2# ) ((segid B or segid C) and resid 76 and name HB#  )  4.0  2.2  1.5 
assign (segid A and resid  75 and name HG2# ) ((segid B or segid C) and resid 76 and name HD2  )  4.0  2.2  1.5 
assign (segid A and resid  75 and name HG2# ) ((segid B or segid C) and resid 76 and name HA   )  4.0  2.2  1.5
assign (segid A and resid  75 and name HG2# ) ((segid B or segid C) and resid 79 and name HD2# )  4.0  2.2  3.0 

assign (segid B and resid  75 and name HG1# ) ((segid C or segid A) and resid 75 and name HA   )  4.0  2.2  2.5
assign (segid B and resid  75 and name HG1# ) ((segid C or segid A) and resid 76 and name HD2  )  4.0  2.2  2.5
assign (segid B and resid  75 and name HG1# ) ((segid C or segid A) and resid 76 and name HA   )  4.0  2.2  2.5
assign (segid B and resid  75 and name HG1# ) ((segid C or segid A) and resid 79 and name HD2# )  3.0  1.2  1.3
assign (segid B and resid  75 and name HG2# ) ((segid C or segid A) and resid 75 and name HB   )  4.0  2.2  2.0
assign (segid B and resid  75 and name HG2# ) ((segid C or segid A) and resid 75 and name HG2# )  4.0  2.2  2.0
assign (segid B and resid  75 and name HG2# ) ((segid C or segid A) and resid 76 and name HB#  )  4.0  2.2  1.5 
assign (segid B and resid  75 and name HG2# ) ((segid C or segid A) and resid 76 and name HD2  )  4.0  2.2  1.5 
assign (segid B and resid  75 and name HG2# ) ((segid C or segid A) and resid 76 and name HA   )  4.0  2.2  1.5
assign (segid B and resid  75 and name HG2# ) ((segid C or segid A) and resid 79 and name HD2# )  4.0  2.2  3.0

assign (segid C and resid  75 and name HG1# ) ((segid A or segid B) and resid 75 and name HA   )  4.0  2.2  2.5
assign (segid C and resid  75 and name HG1# ) ((segid A or segid B) and resid 76 and name HD2  )  4.0  2.2  2.5
assign (segid C and resid  75 and name HG1# ) ((segid A or segid B) and resid 76 and name HA   )  4.0  2.2  2.5
assign (segid C and resid  75 and name HG1# ) ((segid A or segid B) and resid 79 and name HD2# )  3.0  1.2  1.3
assign (segid C and resid  75 and name HG2# ) ((segid A or segid B) and resid 75 and name HB   )  4.0  2.2  2.0
assign (segid C and resid  75 and name HG2# ) ((segid A or segid B) and resid 75 and name HG2# )  4.0  2.2  2.0
assign (segid C and resid  75 and name HG2# ) ((segid A or segid B) and resid 76 and name HB#  )  4.0  2.2  1.5 
assign (segid C and resid  75 and name HG2# ) ((segid A or segid B) and resid 76 and name HD2  )  4.0  2.2  1.5 
assign (segid C and resid  75 and name HG2# ) ((segid A or segid B) and resid 76 and name HA   )  4.0  2.2  1.5
assign (segid C and resid  75 and name HG2# ) ((segid A or segid B) and resid 79 and name HD2# )  4.0  2.2  3.0

! H76

! A77

! Q78

! L79
  
assign (segid A and resid  79 and name HD1# ) ((segid B or segid C) and resid 79 and name HA   )  2.5  0.7  0.7
assign (segid A and resid  79 and name HD1# ) ((segid B or segid C) and resid 79 and name HG   )  4.0  2.2  2.5 
assign (segid A and resid  79 and name HD1# ) ((segid B or segid C) and resid 79 and name HB#  )  4.0  2.2  2.5
assign (segid A and resid  79 and name HD1# ) ((segid B or segid C) and resid 79 and name HD1# )  3.0  1.2  1.3
assign (segid A and resid  79 and name HD2# ) ((segid B or segid C) and resid 55 and name HG#  )  4.0  2.2  2.5 
assign (segid A and resid  79 and name HD2# ) ((segid B or segid C) and resid 79 and name HA   )  3.0  1.2  0.8
assign (segid A and resid  79 and name HD2# ) ((segid B or segid C) and resid 79 and name HD1# )  4.0  2.2  2.0

assign (segid B and resid  79 and name HD1# ) ((segid C or segid A) and resid 79 and name HA   )  2.5  0.7  0.7
assign (segid B and resid  79 and name HD1# ) ((segid C or segid A) and resid 79 and name HG   )  4.0  2.2  2.5 
assign (segid B and resid  79 and name HD1# ) ((segid C or segid A) and resid 79 and name HB#  )  4.0  2.2  2.5
assign (segid B and resid  79 and name HD1# ) ((segid C or segid A) and resid 79 and name HD1# )  3.0  1.2  1.3
assign (segid B and resid  79 and name HD2# ) ((segid C or segid A) and resid 55 and name HG#  )  4.0  2.2  2.5 
assign (segid B and resid  79 and name HD2# ) ((segid C or segid A) and resid 79 and name HA   )  3.0  1.2  0.8
assign (segid B and resid  79 and name HD2# ) ((segid C or segid A) and resid 79 and name HD1# )  4.0  2.2  2.0
 
assign (segid C and resid  79 and name HD1# ) ((segid A or segid B) and resid 79 and name HA   )  2.5  0.7  0.7
assign (segid C and resid  79 and name HD1# ) ((segid A or segid B) and resid 79 and name HG   )  4.0  2.2  2.5 
assign (segid C and resid  79 and name HD1# ) ((segid A or segid B) and resid 79 and name HB#  )  4.0  2.2  2.5
assign (segid C and resid  79 and name HD1# ) ((segid A or segid B) and resid 79 and name HD1# )  3.0  1.2  1.3
assign (segid C and resid  79 and name HD2# ) ((segid A or segid B) and resid 55 and name HG#  )  4.0  2.2  2.5 
assign (segid C and resid  79 and name HD2# ) ((segid A or segid B) and resid 79 and name HA   )  3.0  1.2  0.8
assign (segid C and resid  79 and name HD2# ) ((segid A or segid B) and resid 79 and name HD1# )  4.0  2.2  2.0

! H80

! L81
assign (segid A and resid  81 and name HD1# ) (segid A and resid 52 and name   HN )  4.0  2.2  2.5
assign (segid B and resid  81 and name HD1# ) (segid B and resid 52 and name   HN )  4.0  2.2  2.5
assign (segid C and resid  81 and name HD1# ) (segid C and resid 52 and name   HN )  4.0  2.2  2.5

! M82

! T83

! S84

! M85

! L86
assign (segid A and resid  86 and name HD1# ) ((segid B or segid C) and resid 23 and name  HE#  )  4.0  2.2  2.5
assign (segid A and resid  86 and name HD1# ) ((segid B or segid C) and resid 84 and name  HA   )  4.0  2.2  2.5 
assign (segid A and resid  86 and name HD1# ) ((segid B or segid C) and resid 86 and name  HD2# )  3.0  1.2  2.0
assign (segid A and resid  86 and name HD1# ) ((segid B or segid C) and resid 86 and name  HD1# )  4.0  2.2  3.0
assign (segid A and resid  86 and name HD1# ) ((segid B or segid C) and resid 90 and name  HD1# )  4.0  2.2  2.0
assign (segid A and resid  86 and name HD1# ) ((segid B or segid C) and resid 87 and name  HA   )  3.0  1.2  0.8
assign (segid A and resid  86 and name HD2# ) ((segid B or segid C) and resid 83 and name  HG2# )  4.0  2.2  2.0
assign (segid A and resid  86 and name HD2# ) ((segid B or segid C) and resid 84 and name  HA   )  4.0  2.2  1.5 
assign (segid A and resid  86 and name HD2# ) ((segid B or segid C) and resid 86 and name  HD2# )  3.0  1.2  1.3
assign (segid A and resid  86 and name HD2# ) ((segid B or segid C) and resid 86 and name  HD1# )  4.0  2.2  2.0
assign (segid A and resid  86 and name HD2# ) ((segid B or segid C) and resid 87 and name  HA   )  3.0  1.2  0.8 
assign (segid A and resid  86 and name HD2# ) ((segid B or segid C) and resid 90 and name  HD1# )  4.0  2.2  3.0

assign (segid B and resid  86 and name HD1# ) ((segid C or segid A) and resid 23 and name  HE#  )  4.0  2.2  2.5
assign (segid B and resid  86 and name HD1# ) ((segid C or segid A) and resid 84 and name  HA   )  4.0  2.2  2.5 
assign (segid B and resid  86 and name HD1# ) ((segid C or segid A) and resid 86 and name  HD2# )  3.0  1.2  2.0
assign (segid B and resid  86 and name HD1# ) ((segid C or segid A) and resid 86 and name  HD1# )  4.0  2.2  3.0
assign (segid B and resid  86 and name HD1# ) ((segid C or segid A) and resid 90 and name  HD1# )  4.0  2.2  2.0
assign (segid B and resid  86 and name HD1# ) ((segid C or segid A) and resid 87 and name  HA   )  3.0  1.2  0.8
assign (segid B and resid  86 and name HD2# ) ((segid C or segid A) and resid 83 and name  HG2# )  4.0  2.2  2.0
assign (segid B and resid  86 and name HD2# ) ((segid C or segid A) and resid 84 and name  HA   )  4.0  2.2  1.5 
assign (segid B and resid  86 and name HD2# ) ((segid C or segid A) and resid 86 and name  HD2# )  3.0  1.2  1.3
assign (segid B and resid  86 and name HD2# ) ((segid C or segid A) and resid 86 and name  HD1# )  4.0  2.2  2.0
assign (segid B and resid  86 and name HD2# ) ((segid C or segid A) and resid 87 and name  HA   )  3.0  1.2  0.8 
assign (segid B and resid  86 and name HD2# ) ((segid C or segid A) and resid 90 and name  HD1# )  4.0  2.2  3.0

assign (segid C and resid  86 and name HD1# ) ((segid A or segid B) and resid 23 and name  HE#  )  4.0  2.2  2.5
assign (segid C and resid  86 and name HD1# ) ((segid A or segid B) and resid 84 and name  HA   )  4.0  2.2  2.5 
assign (segid C and resid  86 and name HD1# ) ((segid A or segid B) and resid 86 and name  HD2# )  3.0  1.2  2.0
assign (segid C and resid  86 and name HD1# ) ((segid A or segid B) and resid 86 and name  HD1# )  4.0  2.2  3.0
assign (segid C and resid  86 and name HD1# ) ((segid A or segid B) and resid 90 and name  HD1# )  4.0  2.2  2.0
assign (segid C and resid  86 and name HD1# ) ((segid A or segid B) and resid 87 and name  HA   )  3.0  1.2  0.8
assign (segid C and resid  86 and name HD2# ) ((segid A or segid B) and resid 83 and name  HG2# )  4.0  2.2  2.0
assign (segid C and resid  86 and name HD2# ) ((segid A or segid B) and resid 84 and name  HA   )  4.0  2.2  1.5 
assign (segid C and resid  86 and name HD2# ) ((segid A or segid B) and resid 86 and name  HD2# )  3.0  1.2  1.3
assign (segid C and resid  86 and name HD2# ) ((segid A or segid B) and resid 86 and name  HD1# )  4.0  2.2  2.0
assign (segid C and resid  86 and name HD2# ) ((segid A or segid B) and resid 87 and name  HA   )  3.0  1.2  0.8 
assign (segid C and resid  86 and name HD2# ) ((segid A or segid B) and resid 90 and name  HD1# )  4.0  2.2  3.0

! A87

! R88

! E89

! L90

assign (segid A and resid  90 and name HD1# ) ((segid B or segid C) and resid 87 and name HA   )  4.0  2.2  1.5
assign (segid A and resid  90 and name HD1# ) ((segid B or segid C) and resid 90 and name HD1# )  2.5  0.7  1.2
assign (segid A and resid  90 and name HD1# ) ((segid B or segid C) and resid 90 and name HD2# )  4.0  2.2  2.0
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 23 and name HE#  )  4.0  2.2  1.5 
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 23 and name HD#  )  4.0  2.2  2.5 
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 87 and name HA   )  4.0  2.2  1.5  
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 90 and name HD1# )  4.0  2.2  2.0
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 90 and name HD2# )  4.0  2.2  3.0
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 91 and name HD1# )  4.0  2.2  2.0 
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 91 and name HA   )  4.0  2.2  2.5
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 94 and name HG   )  4.0  2.2  1.5 
assign (segid A and resid  90 and name HD2# ) ((segid B or segid C) and resid 94 and name HD2# )  3.0  1.2  1.3 
assign (segid A and resid  90 and name HA   ) ((segid B or segid C) and resid 94 and name HD2# )  4.0  2.2  1.5 

assign (segid B and resid  90 and name HD1# ) ((segid C or segid A) and resid 87 and name HA   )  4.0  2.2  1.5
assign (segid B and resid  90 and name HD1# ) ((segid C or segid A) and resid 90 and name HD1# )  2.5  0.7  1.2
assign (segid B and resid  90 and name HD1# ) ((segid C or segid A) and resid 90 and name HD2# )  4.0  2.2  2.0
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 23 and name HE#  )  4.0  2.2  1.5 
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 23 and name HD#  )  4.0  2.2  2.5 
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 87 and name HA   )  4.0  2.2  1.5  
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 90 and name HD1# )  4.0  2.2  2.0
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 90 and name HD2# )  4.0  2.2  3.0
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 91 and name HD1# )  4.0  2.2  2.0 
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 91 and name HA   )  4.0  2.2  2.5
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 94 and name HG   )  4.0  2.2  1.5 
assign (segid B and resid  90 and name HD2# ) ((segid C or segid A) and resid 94 and name HD2# )  3.0  1.2  1.3 
assign (segid B and resid  90 and name HA   ) ((segid C or segid A) and resid 94 and name HD2# )  4.0  2.2  1.5 

assign (segid C and resid  90 and name HD1# ) ((segid A or segid B) and resid 87 and name HA   )  4.0  2.2  1.5
assign (segid C and resid  90 and name HD1# ) ((segid A or segid B) and resid 90 and name HD1# )  2.5  0.7  1.2
assign (segid C and resid  90 and name HD1# ) ((segid A or segid B) and resid 90 and name HD2# )  4.0  2.2  2.0
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 23 and name HE#  )  4.0  2.2  1.5 
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 23 and name HD#  )  4.0  2.2  2.5 
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 87 and name HA   )  4.0  2.2  1.5  
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 90 and name HD1# )  4.0  2.2  2.0
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 90 and name HD2# )  4.0  2.2  3.0
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 91 and name HD1# )  4.0  2.2  2.0 
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 91 and name HA   )  4.0  2.2  2.5
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 94 and name HG   )  4.0  2.2  1.5 
assign (segid C and resid  90 and name HD2# ) ((segid A or segid B) and resid 94 and name HD2# )  3.0  1.2  1.3 
assign (segid C and resid  90 and name HA   ) ((segid A or segid B) and resid 94 and name HD2# )  4.0  2.2  1.5 

! I91
assign (segid A and resid  91 and name HD1# ) (segid A and resid 23 and name   HN )  3.0  1.2  1.0

assign (segid B and resid  91 and name HD1# ) (segid B and resid 23 and name   HN )  3.0  1.2  1.0

assign (segid C and resid  91 and name HD1# ) (segid C and resid 23 and name   HN )  3.0  1.2  1.0

! T92

! E93

! L94
assign (segid A and resid  94 and name HD1# ) ((segid B or segid C) and resid 97 and name   HD1# )  3.0  1.2  1.3
assign (segid A and resid  94 and name HD2# ) ((segid B or segid C) and resid 97 and name   HD1# )  4.0  2.2  2.0
assign (segid A and resid  94 and name HD2# ) ((segid B or segid C) and resid 94 and name   HD1# )  3.0  1.2  1.3

assign (segid B and resid  94 and name HD1# ) ((segid C or segid A) and resid 97 and name   HD1# )  3.0  1.2  1.3
assign (segid B and resid  94 and name HD2# ) ((segid C or segid A) and resid 97 and name   HD1# )  4.0  2.2  2.0
assign (segid B and resid  94 and name HD2# ) ((segid C or segid A) and resid 94 and name   HD1# )  3.0  1.2  1.3

assign (segid C and resid  94 and name HD1# ) ((segid A or segid B) and resid 97 and name   HD1# )  3.0  1.2  1.3
assign (segid C and resid  94 and name HD2# ) ((segid A or segid B) and resid 97 and name   HD1# )  4.0  2.2  2.0
assign (segid C and resid  94 and name HD2# ) ((segid A or segid B) and resid 94 and name   HD1# )  3.0  1.2  1.3

! I95

! E96

! L97
assign (segid A and resid  97 and name HD1# ) ((segid B or segid C) and resid  97 and name HD1# )  3.0  1.2  1.3
assign (segid A and resid  97 and name HD1# ) ((segid B or segid C) and resid  97 and name HD2# )  4.0  2.2  2.0
assign (segid A and resid  97 and name HD1# ) ((segid B or segid C) and resid  97 and name HA   )  4.0  2.2  2.5
assign (segid A and resid  97 and name HD1# ) ((segid B or segid C) and resid  97 and name HG   )  4.0  2.2  2.5
assign (segid A and resid  97 and name HD1# ) ((segid B or segid C) and resid  98 and name HD2  )  4.0  2.2  2.5
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid  97 and name   HA )  4.0  2.2  1.5
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid  97 and name   HG )  4.0  2.2  1.5
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid  97 and name HD2# )  4.0  2.2  3.0
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid  98 and name  HE1 )  4.0  2.2  1.5
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid  98 and name  HD2 )  4.0  2.2  1.5
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid 101 and name   HG )  4.0  2.2  1.5 
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid 101 and name HD1# )  3.0  1.2  1.3 
assign (segid A and resid  97 and name HD2# ) ((segid B or segid C) and resid 101 and name HD2# )  4.0  2.2  2.0
assign (segid A and resid  97 and name HA   ) ((segid B or segid C) and resid 101 and name HD1# )  4.0  2.2  1.5 

assign (segid B and resid  97 and name HD1# ) ((segid C or segid A) and resid  97 and name HD1# )  3.0  1.2  1.3
assign (segid B and resid  97 and name HD1# ) ((segid C or segid A) and resid  97 and name HD2# )  4.0  2.2  2.0
assign (segid B and resid  97 and name HD1# ) ((segid C or segid A) and resid  97 and name HA   )  4.0  2.2  2.5
assign (segid B and resid  97 and name HD1# ) ((segid C or segid A) and resid  97 and name HG   )  4.0  2.2  2.5
assign (segid B and resid  97 and name HD1# ) ((segid C or segid A) and resid  98 and name HD2  )  4.0  2.2  2.5
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid  97 and name   HA )  4.0  2.2  1.5
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid  97 and name   HG )  4.0  2.2  1.5
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid  97 and name HD2# )  4.0  2.2  3.0
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid  98 and name  HE1 )  4.0  2.2  1.5
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid  98 and name  HD2 )  4.0  2.2  1.5
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid 101 and name   HG )  4.0  2.2  1.5 
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid 101 and name HD1# )  3.0  1.2  1.3 
assign (segid B and resid  97 and name HD2# ) ((segid C or segid A) and resid 101 and name HD2# )  4.0  2.2  2.0
assign (segid B and resid  97 and name HA   ) ((segid C or segid A) and resid 101 and name HD1# )  4.0  2.2  1.5 

assign (segid C and resid  97 and name HD1# ) ((segid A or segid B) and resid  97 and name HD1# )  3.0  1.2  1.3
assign (segid C and resid  97 and name HD1# ) ((segid A or segid B) and resid  97 and name HD2# )  4.0  2.2  2.0
assign (segid C and resid  97 and name HD1# ) ((segid A or segid B) and resid  97 and name HA   )  4.0  2.2  2.5
assign (segid C and resid  97 and name HD1# ) ((segid A or segid B) and resid  97 and name HG   )  4.0  2.2  2.5
assign (segid C and resid  97 and name HD1# ) ((segid A or segid B) and resid  98 and name HD2  )  4.0  2.2  2.5
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid  97 and name   HA )  4.0  2.2  1.5
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid  97 and name   HG )  4.0  2.2  1.5
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid  97 and name HD2# )  4.0  2.2  3.0
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid  98 and name  HE1 )  4.0  2.2  1.5
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid  98 and name  HD2 )  4.0  2.2  1.5
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid 101 and name   HG )  4.0  2.2  1.5 
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid 101 and name HD1# )  3.0  1.2  1.3 
assign (segid C and resid  97 and name HD2# ) ((segid A or segid B) and resid 101 and name HD2# )  4.0  2.2  2.0
assign (segid C and resid  97 and name HA   ) ((segid A or segid B) and resid 101 and name HD1# )  4.0  2.2  1.5 

! H98

! E99

! K100

! L101
assign (segid A and resid 101 and name HD1# ) ((segid B or segid C) and resid 100 and name    HA )  4.0  2.2  1.5
assign (segid A and resid 101 and name HD1# ) ((segid B or segid C) and resid 101 and name    HA )  4.0  2.2  2.5 
assign (segid A and resid 101 and name HD1# ) ((segid B or segid C) and resid 101 and name  HD1# )  4.0  2.2  2.0
assign (segid A and resid 101 and name HD1# ) ((segid B or segid C) and resid 101 and name  HD2# )  3.0  1.2  1.3 
assign (segid A and resid 101 and name HD2# ) ((segid B or segid C) and resid 100 and name    HA )  4.0  2.2  1.5 
assign (segid A and resid 101 and name HD2# ) ((segid B or segid C) and resid 101 and name    HA )  3.0  1.2  0.8
assign (segid A and resid 101 and name HD2# ) ((segid B or segid C) and resid 101 and name  HD1# )  3.0  1.2  1.3
assign (segid A and resid 101 and name HD2# ) ((segid B or segid C) and resid 101 and name  HD2# )  2.5  0.7  1.2

assign (segid B and resid 101 and name HD1# ) ((segid C or segid A) and resid 100 and name    HA )  4.0  2.2  1.5
assign (segid B and resid 101 and name HD1# ) ((segid C or segid A) and resid 101 and name    HA )  4.0  2.2  2.5 
assign (segid B and resid 101 and name HD1# ) ((segid C or segid A) and resid 101 and name  HD1# )  4.0  2.2  2.0
assign (segid B and resid 101 and name HD1# ) ((segid C or segid A) and resid 101 and name  HD2# )  3.0  1.2  1.3 
assign (segid B and resid 101 and name HD2# ) ((segid C or segid A) and resid 100 and name    HA )  4.0  2.2  1.5 
assign (segid B and resid 101 and name HD2# ) ((segid C or segid A) and resid 101 and name    HA )  3.0  1.2  0.8
assign (segid B and resid 101 and name HD2# ) ((segid C or segid A) and resid 101 and name  HD1# )  3.0  1.2  1.3
assign (segid B and resid 101 and name HD2# ) ((segid C or segid A) and resid 101 and name  HD2# )  2.5  0.7  1.2

assign (segid C and resid 101 and name HD1# ) ((segid A or segid B) and resid 100 and name    HA )  4.0  2.2  1.5
assign (segid C and resid 101 and name HD1# ) ((segid A or segid B) and resid 101 and name    HA )  4.0  2.2  2.5 
assign (segid C and resid 101 and name HD1# ) ((segid A or segid B) and resid 101 and name  HD1# )  4.0  2.2  2.0
assign (segid C and resid 101 and name HD1# ) ((segid A or segid B) and resid 101 and name  HD2# )  3.0  1.2  1.3 
assign (segid C and resid 101 and name HD2# ) ((segid A or segid B) and resid 100 and name    HA )  4.0  2.2  1.5 
assign (segid C and resid 101 and name HD2# ) ((segid A or segid B) and resid 101 and name    HA )  3.0  1.2  0.8
assign (segid C and resid 101 and name HD2# ) ((segid A or segid B) and resid 101 and name  HD1# )  3.0  1.2  1.3
assign (segid C and resid 101 and name HD2# ) ((segid A or segid B) and resid 101 and name  HD2# )  2.5  0.7  1.2

! K102

! A103

!@ END_XPLR_NOE_FILE


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