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
626440 5nyt 34136 cing 1-original 2 AMBER dihedral angle


# 645 atoms read from pdb file M42P1.pdb.
# 1 DT CHI:  (1 DT5 O4')-(1 DT5 C1')-(1 DT5 N1)-(1 DT5 C2) 170.0 310.0
 &rst     iat =     8,     9,    11,    23,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	  rk2 =   400.0, rk3 =   400.0,				&end


# 3 DG CHI:  (3 DG O4')-(3 DG C1')-(3 DG N9)-(3 DG C4) 170.0 310.0
 &rst     iat =    72,    73,    75,    89,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 4 DG CHI:  (4 DG O4')-(4 DG C1')-(4 DG N9)-(4 DG C4) 170.0 310.0
 &rst     iat =   105,   106,   108,   122,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 5 DG CHI:  (5 DG O4')-(5 DG C1')-(5 DG N9)-(5 DG C4) 170.0 310.0
 &rst     iat =   138,   139,   141,   155,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end


# 7 DC CHI:  (7 DC O4')-(7 DC C1')-(7 DC N1)-(7 DC C2) 170.0 310.0
 &rst     iat =   203,   204,   206,   216,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 8 DG CHI:  (8 DG O4')-(8 DG C1')-(8 DG N9)-(8 DG C4) 170.0 310.0
 &rst     iat =   233,   234,   236,   250,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 9 DG CHI:  (9 DG O4')-(9 DG C1')-(9 DG N9)-(9 DG C4) 170.0 310.0
 &rst     iat =   266,   267,   269,   283,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 10 DG CHI:  (10 DG O4')-(10 DG C1')-(10 DG N9)-(10 DG C4) 170.0 310.0
 &rst     iat =   299,   300,   302,   316,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 11 DC CHI:  (11 DC O4')-(11 DC C1')-(11 DC N1)-(11 DC C2) 170.0 310.0
 &rst     iat =   332,   333,   335,   345,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 12 DG CHI:  (12 DG O4')-(12 DG C1')-(12 DG N9)-(12 DG C4) 170.0 310.0
 &rst     iat =   362,   363,   365,   379,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 13 DG CHI:  (13 DG O4')-(13 DG C1')-(13 DG N9)-(13 DG C4) 170.0 310.0
 &rst     iat =   395,   396,   398,   412,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 14 DG CHI:  (14 DG O4')-(14 DG C1')-(14 DG N9)-(14 DG C4) 170.0 310.0
 &rst     iat =   428,   429,   431,   445,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 15 DC CHI:  (15 DC O4')-(15 DC C1')-(15 DC N1)-(15 DC C2) 170.0 310.0
 &rst     iat =   461,   462,   464,   474,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end


# 17 DG CHI:  (17 DG O4')-(17 DG C1')-(17 DG N9)-(17 DG C4) 170.0 310.0
 &rst     iat =   523,   524,   526,   540,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 18 DG CHI:  (18 DG O4')-(18 DG C1')-(18 DG N9)-(18 DG C4) 170.0 310.0
 &rst     iat =   556,   557,   559,   573,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 19 DG CHI:  (19 DG O4')-(19 DG C1')-(19 DG N9)-(19 DG C4) 170.0 310.0
 &rst     iat =   589,   590,   592,   606,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

# 20 DT CHI:  (20 DT3 O4')-(20 DT3 C1')-(20 DT3 N1)-(20 DT3 C2) 170.0 310.0
 &rst     iat =   622,   623,   625,   637,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	&end

#


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