NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
15861 1z23 cing 1-original 5 XPLOR/CNS chemical shift



{  !!   G1
! assign ( resid 0 and name c ) ( resid 1 and name n )
!        ( resid 1 and name ca) ( resid 1 and name c )
!        ( resid 2 and name n )                           <.....> 

  !!   S2
! assign ( resid 1 and name c ) ( resid 2 and name n )
!        ( resid 2 and name ca) ( resid 2 and name c )
!        ( resid 3 and name n )                           <.....> 

  !!   G3
 assign ( resid 2 and name c ) ( resid 3 and name n )
        ( resid 3 and name ca) ( resid 3 and name c )
        ( resid 4 and name n )                           45.35 0.00

  !!   R4
 assign ( resid 3 and name c ) ( resid 4 and name n )
        ( resid 4 and name ca) ( resid 4 and name c )
        ( resid 5 and name n )                           55.75 30.98

  !!   E5
 assign ( resid 4 and name c ) ( resid 5 and name n )
        ( resid 5 and name ca) ( resid 5 and name c )
        ( resid 6 and name n )                           54.60 29.78

  !!   P6
! assign ( resid 5 and name c ) ( resid 6 and name n )
!        ( resid 6 and name ca) ( resid 6 and name c )
!        ( resid 7 and name n )                           62.89 32.43

  !!   L7
 assign ( resid 6 and name c ) ( resid 7 and name n )
        ( resid 7 and name ca) ( resid 7 and name c )
        ( resid 8 and name n )                           55.07 43.58

  !!   E8
 assign ( resid 7 and name c ) ( resid 8 and name n )
        ( resid 8 and name ca) ( resid 8 and name c )
        ( resid 9 and name n )                           56.90 30.23 

  !!   L9
 assign ( resid 8 and name c ) ( resid 9 and name n )
        ( resid 9 and name ca) ( resid 9 and name c )
        ( resid 10 and name n )                           59.73 42.51

  !!   E10
 assign ( resid 9 and name c ) ( resid 10 and name n )
        ( resid 10 and name ca) ( resid 10 and name c )
        ( resid 11 and name n )                           60.49 28.87 

  !!   V11
 assign ( resid 10 and name c ) ( resid 11 and name n )
        ( resid 11 and name ca) ( resid 11 and name c )
        ( resid 12 and name n )                           64.79 32.13

  !!   A12
 assign ( resid 11 and name c ) ( resid 12 and name n )
        ( resid 12 and name ca) ( resid 12 and name c )
        ( resid 13 and name n )                           55.83 17.08

  !!   V13
 assign ( resid 12 and name c ) ( resid 13 and name n )
        ( resid 13 and name ca) ( resid 13 and name c )
        ( resid 14 and name n )                           66.77 31.67

  !!   E14
 assign ( resid 13 and name c ) ( resid 14 and name n )
        ( resid 14 and name ca) ( resid 14 and name c )
        ( resid 15 and name n )                           59.30 29.48

  !!   T15
 assign ( resid 14 and name c ) ( resid 15 and name n )
        ( resid 15 and name ca) ( resid 15 and name c )
        ( resid 16 and name n )                           66.97 68.47

  !!   L16
 assign ( resid 15 and name c ) ( resid 16 and name n )
        ( resid 16 and name ca) ( resid 16 and name c )
        ( resid 17 and name n )                           57.99 41.83

  !!   A17
 assign ( resid 16 and name c ) ( resid 17 and name n )
        ( resid 17 and name ca) ( resid 17 and name c )
        ( resid 18 and name n )                           55.36 17.75

  !!   R18
 assign ( resid 17 and name c ) ( resid 18 and name n )
        ( resid 18 and name ca) ( resid 18 and name c )
        ( resid 19 and name n )                           59.60 29.91

  !!   L19
 assign ( resid 18 and name c ) ( resid 19 and name n )
        ( resid 19 and name ca) ( resid 19 and name c )
        ( resid 20 and name n )                           57.13 42.41

  !!   Q20
 assign ( resid 19 and name c ) ( resid 20 and name n )
        ( resid 20 and name ca) ( resid 20 and name c )
        ( resid 21 and name n )                           60.29 28.61

  !!   Q21
 assign ( resid 20 and name c ) ( resid 21 and name n )
        ( resid 21 and name ca) ( resid 21 and name c )
        ( resid 22 and name n )                           58.68 28.00

  !!   G22
 assign ( resid 21 and name c ) ( resid 22 and name n )
        ( resid 22 and name ca) ( resid 22 and name c )
        ( resid 23 and name n )                           47.26  0.00

  !!   V23
 assign ( resid 22 and name c ) ( resid 23 and name n )
        ( resid 23 and name ca) ( resid 23 and name c )
        ( resid 24 and name n )                           67.21 31.33

  !!   S24
 assign ( resid 23 and name c ) ( resid 24 and name n )
        ( resid 24 and name ca) ( resid 24 and name c )
        ( resid 25 and name n )                           63.1 62.85

  !!   T25
 assign ( resid 24 and name c ) ( resid 25 and name n )
        ( resid 25 and name ca) ( resid 25 and name c )
        ( resid 26 and name n )                           66.47 69.07

  !!   T26
 assign ( resid 25 and name c ) ( resid 26 and name n )
        ( resid 26 and name ca) ( resid 26 and name c )
        ( resid 27 and name n )                           65.65 68.40

  !!   V27
 assign ( resid 26 and name c ) ( resid 27 and name n )
        ( resid 27 and name ca) ( resid 27 and name c )
        ( resid 28 and name n )                           67.66 31.47

  !!   A28
 assign ( resid 27 and name c ) ( resid 28 and name n )
        ( resid 28 and name ca) ( resid 28 and name c )
        ( resid 29 and name n )                           55.65 17.73

  !!   H29
 assign ( resid 28 and name c ) ( resid 29 and name n )
        ( resid 29 and name ca) ( resid 29 and name c )
        ( resid 30 and name n )                           59.45 30.20

  !!   L30
 assign ( resid 29 and name c ) ( resid 30 and name n )
        ( resid 30 and name ca) ( resid 30 and name c )
        ( resid 31 and name n )                           58.98 41.65

  !!   L31
 assign ( resid 30 and name c ) ( resid 31 and name n )
        ( resid 31 and name ca) ( resid 31 and name c )
        ( resid 32 and name n )                           57.94 40.46

  !!   D32
 assign ( resid 31 and name c ) ( resid 32 and name n )
        ( resid 32 and name ca) ( resid 32 and name c )
        ( resid 33 and name n )                           57.21 41.07

  !!   L33
 assign ( resid 32 and name c ) ( resid 33 and name n )
        ( resid 33 and name ca) ( resid 33 and name c )
        ( resid 34 and name n )                           57.82 42.28

  !!   V34
 assign ( resid 33 and name c ) ( resid 34 and name n )
        ( resid 34 and name ca) ( resid 34 and name c )
        ( resid 35 and name n )                           64.98 31.93

  !!   G35
 assign ( resid 34 and name c ) ( resid 35 and name n )
        ( resid 35 and name ca) ( resid 35 and name c )
        ( resid 36 and name n )                           46.43 0.00

  !!   S36
 assign ( resid 35 and name c ) ( resid 36 and name n )
        ( resid 36 and name ca) ( resid 36 and name c )
        ( resid 37 and name n )                           59.42 63.62 

  !!   A37
 assign ( resid 36 and name c ) ( resid 37 and name n )
        ( resid 37 and name ca) ( resid 37 and name c )
        ( resid 38 and name n )                           53.47 18.94 

  !!   S38
 assign ( resid 37 and name c ) ( resid 38 and name n )
        ( resid 38 and name ca) ( resid 38 and name c )
        ( resid 39 and name n )                           58.43 64.00

  !!   G39
 assign ( resid 38 and name c ) ( resid 39 and name n )
        ( resid 39 and name ca) ( resid 39 and name c )
        ( resid 40 and name n )                           44.82 0.00

!  !!   P40
! assign ( resid 39 and name c ) ( resid 40 and name n )
!        ( resid 40 and name ca) ( resid 40 and name c )
!        ( resid 41 and name n )                           <.....> 

  !!   G41
 assign ( resid 40 and name c ) ( resid 41 and name n )
        ( resid 41 and name ca) ( resid 41 and name c )
        ( resid 42 and name n )                           45.31 0.00

  !!   G42
 assign ( resid 41 and name c ) ( resid 42 and name n )
        ( resid 42 and name ca) ( resid 42 and name c )
        ( resid 43 and name n )                           45.28 0.00

  !!   W43
 assign ( resid 42 and name c ) ( resid 43 and name n )
        ( resid 43 and name ca) ( resid 43 and name c )
        ( resid 44 and name n )                           58.17 29.01

  !!   R44
 assign ( resid 43 and name c ) ( resid 44 and name n )
        ( resid 44 and name ca) ( resid 44 and name c )
        ( resid 45 and name n )                           55.83 30.53

!  !!   S45
! assign ( resid 44 and name c ) ( resid 45 and name n )
!        ( resid 45 and name ca) ( resid 45 and name c )
!        ( resid 46 and name n )                           <.....>

!  !!   T46
! assign ( resid 45 and name c ) ( resid 46 and name n )
!        ( resid 46 and name ca) ( resid 46 and name c )
!        ( resid 47 and name n )                           <.....> 

  !!   S47
 assign ( resid 46 and name c ) ( resid 47 and name n )
        ( resid 47 and name ca) ( resid 47 and name c )
        ( resid 48 and name n )                           59.07 63.65

  !!   E48
 assign ( resid 47 and name c ) ( resid 48 and name n )
        ( resid 48 and name ca) ( resid 48 and name c )
        ( resid 49 and name n )                           54.40 29.80

!  !!   P49
! assign ( resid 48 and name c ) ( resid 49 and name n )
!        ( resid 49 and name ca) ( resid 49 and name c )
!        ( resid 50 and name n )                           63.64 32.04

  !!   Q50
 assign ( resid 49 and name c ) ( resid 50 and name n )
        ( resid 50 and name ca) ( resid 50 and name c )
        ( resid 51 and name n )                           54.94 30.48

  !!   E51
 assign ( resid 50 and name c ) ( resid 51 and name n )
        ( resid 51 and name ca) ( resid 51 and name c )
        ( resid 52 and name n )                           54.82 30.48

!  !!   P52
! assign ( resid 51 and name c ) ( resid 52 and name n )
!        ( resid 52 and name ca) ( resid 52 and name c )
!        ( resid 53 and name n )                           <.....>

!  !!   P53
! assign ( resid 52 and name c ) ( resid 53 and name n )
!        ( resid 53 and name ca) ( resid 53 and name c )
!        ( resid 54 and name n )                           <.....>

  !!   V54
 assign ( resid 53 and name c ) ( resid 54 and name n )
        ( resid 54 and name ca) ( resid 54 and name c )
        ( resid 55 and name n )                           66.58 32.14

  !!   Q55
 assign ( resid 54 and name c ) ( resid 55 and name n )
        ( resid 55 and name ca) ( resid 55 and name c )
        ( resid 56 and name n )                           59.08 27.81 

  !!   D56
 assign ( resid 55 and name c ) ( resid 56 and name n )
        ( resid 56 and name ca) ( resid 56 and name c )
        ( resid 57 and name n )                           56.89 40.42 

  !!   L57
 assign ( resid 56 and name c ) ( resid 57 and name n )
        ( resid 57 and name ca) ( resid 57 and name c )
        ( resid 58 and name n )                           57.98 42.17

  !!   K58
 assign ( resid 57 and name c ) ( resid 58 and name n )
        ( resid 58 and name ca) ( resid 58 and name c )
        ( resid 59 and name n )                           60.37 32.02

  !!   A59
 assign ( resid 58 and name c ) ( resid 59 and name n )
        ( resid 59 and name ca) ( resid 59 and name c )
        ( resid 60 and name n )                           54.93 17.86

  !!   A60
 assign ( resid 59 and name c ) ( resid 60 and name n )
        ( resid 60 and name ca) ( resid 60 and name c )
        ( resid 61 and name n )                           54.78 19.45

  !!   V61
 assign ( resid 60 and name c ) ( resid 61 and name n )
        ( resid 61 and name ca) ( resid 61 and name c )
        ( resid 62 and name n )                           67.11 31.73

  !!   A62
 assign ( resid 61 and name c ) ( resid 62 and name n )
        ( resid 62 and name ca) ( resid 62 and name c )
        ( resid 63 and name n )                           54.43 17.39

  !!   A63
 assign ( resid 62 and name c ) ( resid 63 and name n )
        ( resid 63 and name ca) ( resid 63 and name c )
        ( resid 64 and name n )                           54.78 17.83

  !!   V64
 assign ( resid 63 and name c ) ( resid 64 and name n )
        ( resid 64 and name ca) ( resid 64 and name c )
        ( resid 65 and name n )                           65.72 31.70

  !!   H65
 assign ( resid 64 and name c ) ( resid 65 and name n )
        ( resid 65 and name ca) ( resid 65 and name c )
        ( resid 66 and name n )                           59.54 29.97

  !!   G66
 assign ( resid 65 and name c ) ( resid 66 and name n )
        ( resid 66 and name ca) ( resid 66 and name c )
        ( resid 67 and name n )                           47.44 0.00

  !!   A67
 assign ( resid 66 and name c ) ( resid 67 and name n )
        ( resid 67 and name ca) ( resid 67 and name c )
        ( resid 68 and name n )                           55.20 17.96

  !!   V68
 assign ( resid 67 and name c ) ( resid 68 and name n )
        ( resid 68 and name ca) ( resid 68 and name c )
        ( resid 69 and name n )                           67.21 31.65

  !!   H69
 assign ( resid 68 and name c ) ( resid 69 and name n )
        ( resid 69 and name ca) ( resid 69 and name c )
        ( resid 70 and name n )                           61.26 29.99

  !!   E70
 assign ( resid 69 and name c ) ( resid 70 and name n )
        ( resid 70 and name ca) ( resid 70 and name c )
        ( resid 71 and name n )                           59.93 29.71

  !!   L71
 assign ( resid 70 and name c ) ( resid 71 and name n )
        ( resid 71 and name ca) ( resid 71 and name c )
        ( resid 72 and name n )                           58.06 41.50

  !!   L72
 assign ( resid 71 and name c ) ( resid 72 and name n )
        ( resid 72 and name ca) ( resid 72 and name c )
        ( resid 73 and name n )                           58.33 41.89

  !!   E73
 assign ( resid 72 and name c ) ( resid 73 and name n )
        ( resid 73 and name ca) ( resid 73 and name c )
        ( resid 74 and name n )                           59.27 29.62

  !!   F74
 assign ( resid 73 and name c ) ( resid 74 and name n )
        ( resid 74 and name ca) ( resid 74 and name c )
        ( resid 75 and name n )                           61.54 39.84

  !!   A75
 assign ( resid 74 and name c ) ( resid 75 and name n )
        ( resid 75 and name ca) ( resid 75 and name c )
        ( resid 76 and name n )                           55.33 19.70

  !!   R76
 assign ( resid 75 and name c ) ( resid 76 and name n )
        ( resid 76 and name ca) ( resid 76 and name c )
        ( resid 77 and name n )                           59.91 30.69

  !!   S77
 assign ( resid 76 and name c ) ( resid 77 and name n )
        ( resid 77 and name ca) ( resid 77 and name c )
        ( resid 78 and name n )                           61.05 62.75

  !!   A78
 assign ( resid 77 and name c ) ( resid 78 and name n )
        ( resid 78 and name ca) ( resid 78 and name c )
        ( resid 79 and name n )                           54.30 18.21 

  !!   V79
 assign ( resid 78 and name c ) ( resid 79 and name n )
        ( resid 79 and name ca) ( resid 79 and name c )
        ( resid 80 and name n )                           65.85 31.91

  !!   S80
 assign ( resid 79 and name c ) ( resid 80 and name n )
        ( resid 80 and name ca) ( resid 80 and name c )
        ( resid 81 and name n )                           60.92 63.21

  !!   S81
 assign ( resid 80 and name c ) ( resid 81 and name n )
        ( resid 81 and name ca) ( resid 81 and name c )
        ( resid 82 and name n )                           59.75 63.59 

  !!   A82
 assign ( resid 81 and name c ) ( resid 82 and name n )
        ( resid 82 and name ca) ( resid 82 and name c )
        ( resid 83 and name n )                           52.86 18.72

  !!   T83
 assign ( resid 82 and name c ) ( resid 83 and name n )
        ( resid 83 and name ca) ( resid 83 and name c )
        ( resid 84 and name n )                           63.29 69.39 

!  !!   H84
! assign ( resid 83 and name c ) ( resid 84 and name n )
!        ( resid 84 and name ca) ( resid 84 and name c )
!        ( resid 85 and name n )                           <.....>

!  !!   T85
! assign ( resid 84 and name c ) ( resid 85 and name n )
!        ( resid 85 and name ca) ( resid 85 and name c )
!        ( resid 86 and name n )                           <.....>

!  !!   S86
! assign ( resid 85 and name c ) ( resid 86 and name n )
!        ( resid 86 and name ca) ( resid 86 and name c )
!        ( resid 87 and name n )                           <.....>

!  !!   D87
! assign ( resid 86 and name c ) ( resid 87 and name n )
!        ( resid 87 and name ca) ( resid 87 and name c )
!        ( resid 88 and name n )                           <.....> 

!  !!   R88
! assign ( resid 87 and name c ) ( resid 88 and name n )
!        ( resid 88 and name ca) ( resid 88 and name c )
!        ( resid 89 and name n )                           <.....>

  !!   T89
 assign ( resid 88 and name c ) ( resid 89 and name n )
        ( resid 89 and name ca) ( resid 89 and name c )
        ( resid 90 and name n )                           65.08 68.88

  !!   L90
 assign ( resid 89 and name c ) ( resid 90 and name n )
        ( resid 90 and name ca) ( resid 90 and name c )
        ( resid 91 and name n )                           58.05 41.54

  !!   H91
 assign ( resid 90 and name c ) ( resid 91 and name n )
        ( resid 91 and name ca) ( resid 91 and name c )
        ( resid 92 and name n )                           60.84 30.69

  !!   A92
 assign ( resid 91 and name c ) ( resid 92 and name n )
        ( resid 92 and name ca) ( resid 92 and name c )
        ( resid 93 and name n )                           55.20 18.30

  !!   K93
 assign ( resid 92 and name c ) ( resid 93 and name n )
        ( resid 93 and name ca) ( resid 93 and name c )
        ( resid 94 and name n )                           59.81 33.11

  !!   L94
 assign ( resid 93 and name c ) ( resid 94 and name n )
        ( resid 94 and name ca) ( resid 94 and name c )
        ( resid 95 and name n )                           57.78 41.67

  !!   S95
 assign ( resid 94 and name c ) ( resid 95 and name n )
        ( resid 95 and name ca) ( resid 95 and name c )
        ( resid 96 and name n )                           62.33 62.33

  !!   R96
 assign ( resid 95 and name c ) ( resid 96 and name n )
        ( resid 96 and name ca) ( resid 96 and name c )
        ( resid 97 and name n )                           59.23 29.74

  !!   Q97
 assign ( resid 96 and name c ) ( resid 97 and name n )
        ( resid 97 and name ca) ( resid 97 and name c )
        ( resid 98 and name n )                           58.01 27.72

  !!   L98
 assign ( resid 97 and name c ) ( resid 98 and name n )
        ( resid 98 and name ca) ( resid 98 and name c )
        ( resid 99 and name n )                           58.02 41.65

  !!   Q99
 assign ( resid 98 and name c ) ( resid 99 and name n )
        ( resid 99 and name ca) ( resid 99 and name c )
        ( resid 100 and name n )                           58.79 28.25 

  !!   K100
 assign ( resid 99 and name c ) ( resid 100 and name n )
        ( resid 100 and name ca) ( resid 100 and name c )
        ( resid 101 and name n )                           59.29 32.02 

  !!   M101
 assign ( resid 100 and name c ) ( resid 101 and name n )
        ( resid 101 and name ca) ( resid 101 and name c )
        ( resid 102 and name n )                           56.85 32.60

  !!   E102
 assign ( resid 101 and name c ) ( resid 102 and name n )
        ( resid 102 and name ca) ( resid 102 and name c )
        ( resid 103 and name n )                           59.71 29.07

  !!   D103
 assign ( resid 102 and name c ) ( resid 103 and name n )
        ( resid 103 and name ca) ( resid 103 and name c )
        ( resid 104 and name n )                           57.58 40.39

  !!   V104
 assign ( resid 103 and name c ) ( resid 104 and name n )
        ( resid 104 and name ca) ( resid 104 and name c )
        ( resid 105 and name n )                           66.80 31.96

  !!   Y105
 assign ( resid 104 and name c ) ( resid 105 and name n )
        ( resid 105 and name ca) ( resid 105 and name c )
        ( resid 106 and name n )                           62.25 38.57

  !!   Q106
 assign ( resid 105 and name c ) ( resid 106 and name n )
        ( resid 106 and name ca) ( resid 106 and name c )
        ( resid 107 and name n )                           58.67 27.70

  !!   T107
 assign ( resid 106 and name c ) ( resid 107 and name n )
        ( resid 107 and name ca) ( resid 107 and name c )
        ( resid 108 and name n )                           66.80 68.57

  !!   L108
 assign ( resid 107 and name c ) ( resid 108 and name n )
        ( resid 108 and name ca) ( resid 108 and name c )
        ( resid 109 and name n )                           58.11 42.80

  !!   V109
 assign ( resid 108 and name c ) ( resid 109 and name n )
        ( resid 109 and name ca) ( resid 109 and name c )
        ( resid 110 and name n )                           66.35 31.16

  !!   V110
 assign ( resid 109 and name c ) ( resid 110 and name n )
        ( resid 110 and name ca) ( resid 110 and name c )
        ( resid 111 and name n )                           66.72 30.80

  !!   H111
 assign ( resid 110 and name c ) ( resid 111 and name n )
        ( resid 111 and name ca) ( resid 111 and name c )
        ( resid 112 and name n )                           59.85 30.89 

  !!   G112
 assign ( resid 111 and name c ) ( resid 112 and name n )
        ( resid 112 and name ca) ( resid 112 and name c )
        ( resid 113 and name n )                           47.00 0.00

  !!   Q113
 assign ( resid 112 and name c ) ( resid 113 and name n )
        ( resid 113 and name ca) ( resid 113 and name c )
        ( resid 114 and name n )                           58.03 28.32

  !!   V114
 assign ( resid 113 and name c ) ( resid 114 and name n )
        ( resid 114 and name ca) ( resid 114 and name c )
        ( resid 115 and name n )                           64.82 32.30

  !!   L115
 assign ( resid 114 and name c ) ( resid 115 and name n )
        ( resid 115 and name ca) ( resid 115 and name c )
        ( resid 116 and name n )                           56.02 41.83

  !!   D116
 assign ( resid 115 and name c ) ( resid 116 and name n )
        ( resid 116 and name ca) ( resid 116 and name c )
        ( resid 117 and name n )                           54.54 41.66

  !!   S117
 assign ( resid 116 and name c ) ( resid 117 and name n )
        ( resid 117 and name ca) ( resid 117 and name c )
        ( resid 118 and name n )                           59.46 63.66

  !!   G118
 assign ( resid 117 and name c ) ( resid 118 and name n )
        ( resid 118 and name ca) ( resid 118 and name c )
        ( resid 119 and name n )                           45.93 0.00

!  !!   R119
! assign ( resid 118 and name c ) ( resid 119 and name n )
!        ( resid 119 and name ca) ( resid 119 and name c )
!        ( resid 120 and name n )                           <.....>

  !!   G120
 assign ( resid 119 and name c ) ( resid 120 and name n )
        ( resid 120 and name ca) ( resid 120 and name c )
        ( resid 121 and name n )                           45.16 0.00

  !!   G121
 assign ( resid 120 and name c ) ( resid 121 and name n )
        ( resid 121 and name ca) ( resid 121 and name c )
        ( resid 122 and name n )                           44.82 0.00

!  !!   P122
! assign ( resid 121 and name c ) ( resid 122 and name n )
!        ( resid 122 and name ca) ( resid 122 and name c )
!        ( resid 123 and name n )                           63.62 32.07

  !!   G123
 assign ( resid 122 and name c ) ( resid 123 and name n )
        ( resid 123 and name ca) ( resid 123 and name c )
        ( resid 124 and name n )                           44.94 0.00

  !!   F124
 assign ( resid 123 and name c ) ( resid 124 and name n )
        ( resid 124 and name ca) ( resid 124 and name c )
        ( resid 125 and name n )                           57.44 40.61

  !!   T125
 assign ( resid 124 and name c ) ( resid 125 and name n )
        ( resid 125 and name ca) ( resid 125 and name c )
        ( resid 126 and name n )                           60.20 72.38

  !!   L126
 assign ( resid 125 and name c ) ( resid 126 and name n )
        ( resid 126 and name ca) ( resid 126 and name c )
        ( resid 127 and name n )                           57.98 40.80

  !!   D127
 assign ( resid 126 and name c ) ( resid 127 and name n )
        ( resid 127 and name ca) ( resid 127 and name c )
        ( resid 128 and name n )                           57.29 40.66

  !!   D128
 assign ( resid 127 and name c ) ( resid 128 and name n )
        ( resid 128 and name ca) ( resid 128 and name c )
        ( resid 129 and name n )                           57.39 40.95

  !!   L129
 assign ( resid 128 and name c ) ( resid 129 and name n )
        ( resid 129 and name ca) ( resid 129 and name c )
        ( resid 130 and name n )                           57.58 41.09

  !!   D130
 assign ( resid 129 and name c ) ( resid 130 and name n )
        ( resid 130 and name ca) ( resid 130 and name c )
        ( resid 131 and name n )                           57.68 40.34

  !!   R131
 assign ( resid 130 and name c ) ( resid 131 and name n )
        ( resid 131 and name ca) ( resid 131 and name c )
        ( resid 132 and name n )                           59.63 30.48

  !!   L132
 assign ( resid 131 and name c ) ( resid 132 and name n )
        ( resid 132 and name ca) ( resid 132 and name c )
        ( resid 133 and name n )                           58.44 41.52

  !!   V133
 assign ( resid 132 and name c ) ( resid 133 and name n )
        ( resid 133 and name ca) ( resid 133 and name c )
        ( resid 134 and name n )                           67.45 31.71

  !!   A134
 assign ( resid 133 and name c ) ( resid 134 and name n )
        ( resid 134 and name ca) ( resid 134 and name c )
        ( resid 135 and name n )                           55.46 17.83

  !!   C135
 assign ( resid 134 and name c ) ( resid 135 and name n )
        ( resid 135 and name ca) ( resid 135 and name c )
        ( resid 136 and name n )                           58.26 42.10

  !!   S136
 assign ( resid 135 and name c ) ( resid 136 and name n )
        ( resid 136 and name ca) ( resid 136 and name c )
        ( resid 137 and name n )                           63.30 63.30

  !!   R137
 assign ( resid 136 and name c ) ( resid 137 and name n )
        ( resid 137 and name ca) ( resid 137 and name c )
        ( resid 138 and name n )                           59.46 30.43

  !!   A138
 assign ( resid 137 and name c ) ( resid 138 and name n )
        ( resid 138 and name ca) ( resid 138 and name c )
        ( resid 139 and name n )                           53.04 19.67

  !!   V139
 assign ( resid 138 and name c ) ( resid 139 and name n )
        ( resid 139 and name ca) ( resid 139 and name c )
        ( resid 140 and name n )                           67.45 30.09

!  !!   P140
! assign ( resid 139 and name c ) ( resid 140 and name n )
!        ( resid 140 and name ca) ( resid 140 and name c )
!        ( resid 141 and name n )                           66.64 31.15

  !!   E141
 assign ( resid 140 and name c ) ( resid 141 and name n )
        ( resid 141 and name ca) ( resid 141 and name c )
        ( resid 142 and name n )                           58.86 28.75

  !!   D142
 assign ( resid 141 and name c ) ( resid 142 and name n )
        ( resid 142 and name ca) ( resid 142 and name c )
        ( resid 143 and name n )                           58.18 40.68

  !!   A143
 assign ( resid 142 and name c ) ( resid 143 and name n )
        ( resid 143 and name ca) ( resid 143 and name c )
        ( resid 144 and name n )                           55.36 18.60 

  !!   K144
 assign ( resid 143 and name c ) ( resid 144 and name n )
        ( resid 144 and name ca) ( resid 144 and name c )
        ( resid 145 and name n )                           59.75 32.33 

  !!   Q145
 assign ( resid 144 and name c ) ( resid 145 and name n )
        ( resid 145 and name ca) ( resid 145 and name c )
        ( resid 146 and name n )                           59.27 28.09 

  !!   L146
 assign ( resid 145 and name c ) ( resid 146 and name n )
        ( resid 146 and name ca) ( resid 146 and name c )
        ( resid 147 and name n )                           58.21 41.50

  !!   A147
 assign ( resid 146 and name c ) ( resid 147 and name n )
        ( resid 147 and name ca) ( resid 147 and name c )
        ( resid 148 and name n )                           55.83 17.87

  !!   S148
 assign ( resid 147 and name c ) ( resid 148 and name n )
        ( resid 148 and name ca) ( resid 148 and name c )
        ( resid 149 and name n )                           61.85 63.10

  !!   F149
 assign ( resid 148 and name c ) ( resid 149 and name n )
        ( resid 149 and name ca) ( resid 149 and name c )
        ( resid 150 and name n )                           61.11 39.16 

  !!   L150
 assign ( resid 149 and name c ) ( resid 150 and name n )
        ( resid 150 and name ca) ( resid 150 and name c )
        ( resid 151 and name n )                           58.18 42.45

  !!   H151
 assign ( resid 150 and name c ) ( resid 151 and name n )
        ( resid 151 and name ca) ( resid 151 and name c )
        ( resid 152 and name n )                           60.26 31.60

  !!   G152
 assign ( resid 151 and name c ) ( resid 152 and name n )
        ( resid 152 and name ca) ( resid 152 and name c )
        ( resid 153 and name n )                           46.48 0.00

  !!   N153
 assign ( resid 152 and name c ) ( resid 153 and name n )
        ( resid 153 and name ca) ( resid 153 and name c )
        ( resid 154 and name n )                           53.11 39.73

  !!   A154
 assign ( resid 153 and name c ) ( resid 154 and name n )
        ( resid 154 and name ca) ( resid 154 and name c )
        ( resid 155 and name n )                           56.30 18.72

  !!   S155
 assign ( resid 154 and name c ) ( resid 155 and name n )
        ( resid 155 and name ca) ( resid 155 and name c )
        ( resid 156 and name n )                           61.09 62.55

  !!   L156
 assign ( resid 155 and name c ) ( resid 156 and name n )
        ( resid 156 and name ca) ( resid 156 and name c )
        ( resid 157 and name n )                           55.66 42.94

  !!   L157
 assign ( resid 156 and name c ) ( resid 157 and name n )
        ( resid 157 and name ca) ( resid 157 and name c )
        ( resid 158 and name n )                           55.85 43.34

  !!   F158
 assign ( resid 157 and name c ) ( resid 158 and name n )
        ( resid 158 and name ca) ( resid 158 and name c )
        ( resid 159 and name n )                           55.70 40.19

  !!   R159
 assign ( resid 158 and name c ) ( resid 159 and name n )
        ( resid 159 and name ca) ( resid 159 and name c )
        ( resid 160 and name n )                           55.79 32.04

  !!   R160
 assign ( resid 159 and name c ) ( resid 160 and name n )
        ( resid 160 and name ca) ( resid 160 and name c )
        ( resid 161 and name n )                           56.05 31.20 

  !!   T161
 assign ( resid 160 and name c ) ( resid 161 and name n )
        ( resid 161 and name ca) ( resid 161 and name c )
        ( resid 162 and name n )                           62.41 69.83

  !!   K162
 assign ( resid 161 and name c ) ( resid 162 and name n )
        ( resid 162 and name ca) ( resid 162 and name c )
        ( resid 163 and name n )                           56.40 33.15

  !!   A163
 assign ( resid 162 and name c ) ( resid 163 and name n )
        ( resid 163 and name ca) ( resid 163 and name c )
        ( resid 164 and name n )                           53.97 20.02

}


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