NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type
9000 1n8c 5730 cing 1-original 3 AMBER dihedral angle


# B-DNA DIHEDRAL ANGLE RESTRAINTS FOR TetraH11mer
# Excluding residues 5,6,7 and 16,17,18


# Torsional Angle: gamma = 36
 &rst
 iat(1) =   1 , iat(2) =   1 , iat(3) =   1 , iat(4) =   1 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =   1 , iat(2) =   1 , iat(3) =   1 , iat(4) =   1 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =   1 , iat(2) =   1 , iat(3) =   1 , iat(4) =   2 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =   1 , iat(2) =   1 , iat(3) =   2 , iat(4) =   2 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =   1 , iat(2) =   2 , iat(3) =   2 , iat(4) =   2 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =   2 , iat(2) =   2 , iat(3) =   2 , iat(4) =   2 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =   2 , iat(2) =   2 , iat(3) =   2 , iat(4) =   2 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =   2 , iat(2) =   2 , iat(3) =   2 , iat(4) =   2 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =   2 , iat(2) =   2 , iat(3) =   2 , iat(4) =   3 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =   2 , iat(2) =   2 , iat(3) =   3 , iat(4) =   3 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end


# Torsional Angle: alpha = -46
 &rst
 iat(1) =   2 , iat(2) =   3 , iat(3) =   3 , iat(4) =   3 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =   3 , iat(2) =   3 , iat(3) =   3 , iat(4) =   3 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =   3 , iat(2) =   3 , iat(3) =   3 , iat(4) =   3 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =   3 , iat(2) =   3 , iat(3) =   3 , iat(4) =   3 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =   3 , iat(2) =   3 , iat(3) =   3 , iat(4) =   4 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =   3 , iat(2) =   3 , iat(3) =   4 , iat(4) =   4 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =   3 , iat(2) =   4 , iat(3) =   4 , iat(4) =   4 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =   4 , iat(2) =   4 , iat(3) =   4 , iat(4) =   4 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =   4 , iat(2) =   4 , iat(3) =   4 , iat(4) =   4 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =   4 , iat(2) =   4 , iat(3) =   4 , iat(4) =   4 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =   4 , iat(2) =   4 , iat(3) =   4 , iat(4) =   5 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: alpha = -46
 &rst
 iat(1) =   7 , iat(2) =   8 , iat(3) =   8 , iat(4) =   8 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =   8 , iat(2) =   8 , iat(3) =   8 , iat(4) =   8 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =   8 , iat(2) =   8 , iat(3) =   8 , iat(4) =   8 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =   8 , iat(2) =   8 , iat(3) =   8 , iat(4) =   8 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =   8 , iat(2) =   8 , iat(3) =   8 , iat(4) =   9 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =   8 , iat(2) =   8 , iat(3) =   9 , iat(4) =   9 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =   8 , iat(2) =   9 , iat(3) =   9 , iat(4) =   9 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =   9 , iat(2) =   9 , iat(3) =   9 , iat(4) =   9 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =   9 , iat(2) =   9 , iat(3) =   9 , iat(4) =   9 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =   9 , iat(2) =   9 , iat(3) =   9 , iat(4) =   9 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =   9 , iat(2) =   9 , iat(3) =   9 , iat(4) =  10 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =   9 , iat(2) =   9 , iat(3) =  10 , iat(4) =  10 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =   9 , iat(2) =  10 , iat(3) =  10 , iat(4) =  10 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  10 , iat(2) =  10 , iat(3) =  10 , iat(4) =  10 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  10 , iat(2) =  10 , iat(3) =  10 , iat(4) =  10 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  10 , iat(2) =  10 , iat(3) =  10 , iat(4) =  10 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  10 , iat(2) =  10 , iat(3) =  10 , iat(4) =  11 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =  10 , iat(2) =  10 , iat(3) =  11 , iat(4) =  11 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
************

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  10 , iat(2) =  11 , iat(3) =  11 , iat(4) =  11 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  11 , iat(2) =  11 , iat(3) =  11 , iat(4) =  11 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  11 , iat(2) =  11 , iat(3) =  11 , iat(4) =  11 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  11 , iat(2) =  11 , iat(3) =  11 , iat(4) =  11 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# STRAND TWO **********************************
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  12 , iat(2) =  12 , iat(3) =  12 , iat(4) =  12 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  12 , iat(2) =  12 , iat(3) =  12 , iat(4) =  12 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  12 , iat(2) =  12 , iat(3) =  12 , iat(4) =  13 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =  12 , iat(2) =  12 , iat(3) =  13 , iat(4) =  13 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  12 , iat(2) =  13 , iat(3) =  13 , iat(4) =  13 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  13 , iat(2) =  13 , iat(3) =  13 , iat(4) =  13 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  13 , iat(2) =  13 , iat(3) =  13 , iat(4) =  13 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  13 , iat(2) =  13 , iat(3) =  13 , iat(4) =  13 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  13 , iat(2) =  13 , iat(3) =  13 , iat(4) =  14 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =  13 , iat(2) =  13 , iat(3) =  14 , iat(4) =  14 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  13 , iat(2) =  14 , iat(3) =  14 , iat(4) =  14 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  14 , iat(2) =  14 , iat(3) =  14 , iat(4) =  14 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  14 , iat(2) =  14 , iat(3) =  14 , iat(4) =  14 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  14 , iat(2) =  14 , iat(3) =  14 , iat(4) =  14 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  14 , iat(2) =  14 , iat(3) =  14 , iat(4) =  15 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =  14 , iat(2) =  14 , iat(3) =  15 , iat(4) =  15 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  14 , iat(2) =  15 , iat(3) =  15 , iat(4) =  15 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  15 , iat(2) =  15 , iat(3) =  15 , iat(4) =  15 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  15 , iat(2) =  15 , iat(3) =  15 , iat(4) =  15 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  15 , iat(2) =  15 , iat(3) =  15 , iat(4) =  15 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  15 , iat(2) =  15 , iat(3) =  15 , iat(4) =  16 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  18 , iat(2) =  19 , iat(3) =  19 ,  iat(4) =  19 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  19 , iat(2) =  19 , iat(3) =  19 , iat(4) =  19 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  19 , iat(2) =  19 , iat(3) =  19 , iat(4) =  19 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  19 , iat(2) =  19 , iat(3) =  19 , iat(4) =  19 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  19 , iat(2) =  19 , iat(3) =  19 , iat(4) =  20 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =  19 , iat(2) =  19 , iat(3) =  20 , iat(4) =  20 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  19 , iat(2) =  20 , iat(3) =  20 ,  iat(4) =  20 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  20 , iat(2) =  20 , iat(3) =  20 , iat(4) =  20 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  20 , iat(2) =  20 , iat(3) =  20 , iat(4) =  20 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  20 , iat(2) =  20 , iat(3) =  20 , iat(4) =  20 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  20 , iat(2) =  20 , iat(3) =  20 , iat(4) =  21 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =  20 , iat(2) =  20 , iat(3) =  21 , iat(4) =  21 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  20 , iat(2) =  21 , iat(3) =  21 ,  iat(4) =  21 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  21 , iat(2) =  21 , iat(3) =  21 , iat(4) =  21 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  21 , iat(2) =  21 , iat(3) =  21 , iat(4) =  21 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  21 , iat(2) =  21 , iat(3) =  21 , iat(4) =  21 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: epsilon = 155
 &rst
 iat(1) =  21 , iat(2) =  21 , iat(3) =  21 , iat(4) =  22 ,
 atnam(1) = 'C4''' , atnam(2) = 'C3''', atnam(3) = 'O3'''  ,
 atnam(4) = 'P   ' , iresid = 1,
 r1  =  125.0 , r2  =  130.0 , r3  =  180.0 , r4  =  185.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: zeta = -96
 &rst
 iat(1) =  21 , iat(2) =  21 , iat(3) =  22 , iat(4) =  22 ,
 atnam(1) = 'C3''' , atnam(2) = 'O3''', atnam(3) = 'P   '  ,
 atnam(4) = 'O5''' , iresid = 1,
 r1  = -126.0 , r2  = -121.0 , r3  =  -71.0 , r4  =  -66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end

# Torsional Angle: alpha = -46
 &rst
 iat(1) =  21 , iat(2) =  22 , iat(3) =  22 ,  iat(4) =  22 ,
 atnam(1) = 'O3''' , atnam(2) = 'P   ', atnam(3) = 'O5'''  ,
 atnam(4) = 'C5''' , iresid = 1,
 r1  =  -76.0 , r2  =  -71.0 , r3  =  -21.0 , r4  =  -19.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: beta = -147
 &rst
 iat(1) =  22 , iat(2) =  22 , iat(3) =  22 , iat(4) =  22 ,
 atnam(1) = 'P   ' , atnam(2) = 'O5''', atnam(3) = 'C5'''  ,
 atnam(4) = 'C4''' , iresid = 1,
 r1  = -177.0 , r2  = -172.0 , r3  = -122.0 , r4  = -117.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: gamma = 36
 &rst
 iat(1) =  22 , iat(2) =  22 , iat(3) =  22 , iat(4) =  22 ,
 atnam(1) = 'O5''' , atnam(2) = 'C5''', atnam(3) = 'C4'''  ,
 atnam(4) = 'C3''' , iresid = 1,
 r1  =    6.0 , r2  =   11.0 , r3  =   61.0 , r4  =   66.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end
# Torsional Angle: delta = 157
 &rst
 iat(1) =  22 , iat(2) =  22 , iat(3) =  22 , iat(4) =  22 ,
 atnam(1) = 'C5''' , atnam(2) = 'C4''', atnam(3) = 'C3'''  ,
 atnam(4) = 'O3''' , iresid = 1,
 r1  =  127.0 , r2  =  132.0 , r3  =  182.0 , r4  =  187.0 ,
 rk2 =   25.0 , rk3 =   25.0
 &end


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