NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id cing stage position program type
649046 6m0b cing 1-original 4 AMBER dihedral angle 

# Restraints file 2: rst
# 261 atoms read from pdb file min.pdb.
# 1 DC NU1:  (1 DC5 H1')-(1 DC5 C1')-(1 DC5 C2')-(1 DC5 H2') 142.4 172.4
 &rst     iat =     10,     9,    25,    26,
	  r1 = 141.4, r2 = 142.4, r3 = 172.4, r4 = 173.4,
	  rk2 =1000, rk3 =1000,				/

# 2 DT NU1:  (2 DT H1')-(2 DT C1')-(2 DT C2')-(2 DT H2') 142.8 172.8
 &rst     iat =    40,    39,    57,    58,
	  r1 = 141.8, r2 = 142.8, r3 = 172.8, r4 = 173.8,
	/

# 3 DT NU1:  (3 DT H1')-(3 DT C1')-(3 DT C2')-(3 DT H2') 153.5 183.5
 &rst     iat =    72,    71,    89,    90,
	  r1 = 152.5, r2 = 153.5, r3 = 183.5, r4 = 184.5,
	/

# 5 DC NU1:  (5 DC H1')-(5 DC C1')-(5 DC C2')-(5 DC H2') 141.8 171.8
 &rst     iat =   137,   136,   152,   153,
	  r1 = 140.8, r2 = 141.8, r3 = 171.8, r4 = 172.8,
	/

# 6 DG NU1:  (6 DG H1')-(6 DG C1')-(6 DG C2')-(6 DG H2') 142.2 172.2
 &rst     iat =   167,   166,   185,   186,
	  r1 = 141.2, r2 = 142.2, r3 = 172.2, r4 = 173.2,
	/

# 7 DT NU1:  (7 DT H1')-(7 DT C1')-(7 DT C2')-(7 DT H2') 147.6 177.6
 &rst     iat =   200,   199,   217,   218,
	  r1 = 146.6, r2 = 147.6, r3 = 177.6, r4 = 178.6,
	/

# 8 DG NU1:  (8 DG3 H1')-(8 DG3 C1')-(8 DG3 C2')-(8 DG3 H2') 109.8 139.8
 &rst     iat =   232,   231,   250,   251,
	  r1 = 108.8, r2 = 109.8, r3 = 139.8, r4 = 140.8,
	/

# 4 DG GAMMA:  (4 DG O5')-(4 DG C5')-(4 DG C4')-(4 DG C3') 150.0 210.0
 &rst     iat =    96,    97,   100,   120,
	  r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
	/

# 5 DC GAMMA:  (5 DC O5')-(5 DC C5')-(5 DC C4')-(5 DC C3') 150.0 210.0
 &rst     iat =   129,   130,   133,   150,
	  r1 = 149.0, r2 = 150.0, r3 = 210.0, r4 = 211.0,
	/

# 1 DC CHI:  (1 DC5 O4')-(1 DC5 C1')-(1 DC5 N1)-(1 DC5 C2)  90.0 270.0
 &rst     iat =     8,     9,    11,    21,
	  r1 =  89.0, r2 =  90.0, r3 = 270.0, r4 = 271.0,
	/

# 2 DT CHI:  (2 DT O4')-(2 DT C1')-(2 DT N1)-(2 DT C2)  90.0 270.0
 &rst     iat =    38,    39,    41,    53,
	  r1 =  89.0, r2 =  90.0, r3 = 270.0, r4 = 271.0,
	/

# 4 DG CHI:  (4 DG O4')-(4 DG C1')-(4 DG N9)-(4 DG C4)  90.0 270.0
 &rst     iat =   102,   103,   105,   119,
	  r1 =  89.0, r2 =  90.0, r3 = 270.0, r4 = 271.0,
	/

# 5 DC CHI:  (5 DC O4')-(5 DC C1')-(5 DC N1)-(5 DC C2)  90.0 270.0
 &rst     iat =   135,   136,   138,   148,
	  r1 =  89.0, r2 =  90.0, r3 = 270.0, r4 = 271.0,
	/

# 6 DG CHI:  (6 DG O4')-(6 DG C1')-(6 DG N9)-(6 DG C4)  90.0 270.0
 &rst     iat =   165,   166,   168,   182,
	  r1 =  89.0, r2 =  90.0, r3 = 270.0, r4 = 271.0,
	/

# 8 DG CHI:  (8 DG3 O4')-(8 DG3 C1')-(8 DG3 N9)-(8 DG3 C4)  90.0 330.0
 &rst     iat =   230,   231,   233,   247,
	  r1 =  89.0, r2 =  90.0, r3 = 330.0, r4 = 331.0,
	/

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