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
639403 6r9l 34390 cing 1-original 2 AMBER dihedral angle


# 806 atoms read from pdb file reference.pdb.
# 1 DG CHI:  (1 DG5 O4')-(1 DG5 C1')-(1 DG5 N9)-(1 DG5 C4) 170.0 310.0
 &rst     iat =     8,     9,    11,    25,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	  rk2 = 200.0, rk3 = 200.0,				/

# 2 DC CHI:  (2 DC O4')-(2 DC C1')-(2 DC N1)-(2 DC C2) 170.0 310.0
 &rst     iat =    41,    42,    44,    54,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 3 DG CHI:  (3 DG O4')-(3 DG C1')-(3 DG N9)-(3 DG C4) 170.0 310.0
 &rst     iat =    71,    72,    74,    88,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 4 DT CHI:  (4 DT O4')-(4 DT C1')-(4 DT N1)-(4 DT C2) 170.0 310.0
 &rst     iat =   104,   105,   107,   119,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 5 DG CHI:  (5 DG O4')-(5 DG C1')-(5 DG N9)-(5 DG C4)  25.0  95.0
 &rst     iat =   136,   137,   139,   153,
	  r1 =  24.0, r2 =  25.0, r3 =  95.0, r4 =  96.0,
	/

# 6 DG CHI:  (6 DG O4')-(6 DG C1')-(6 DG N9)-(6 DG C4)  25.0  95.0
 &rst     iat =   169,   170,   172,   186,
	  r1 =  24.0, r2 =  25.0, r3 =  95.0, r4 =  96.0,
	/

# 7 DG CHI:  (7 DG O4')-(7 DG C1')-(7 DG N9)-(7 DG C4) 200.0 280.0
 &rst     iat =   202,   203,   205,   219,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	/

# 8 DT CHI:  (8 DT O4')-(8 DT C1')-(8 DT N1)-(8 DT C2) 170.0 310.0
 &rst     iat =   235,   236,   238,   250,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 9 DC CHI:  (9 DC O4')-(9 DC C1')-(9 DC N1)-(9 DC C2) 170.0 310.0
 &rst     iat =   267,   268,   270,   280,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 10 DA CHI:  (10 DA O4')-(10 DA C1')-(10 DA N9)-(10 DA C4) 170.0 310.0
 &rst     iat =   297,   298,   300,   313,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 11 DG CHI:  (11 DG O4')-(11 DG C1')-(11 DG N9)-(11 DG C4)  25.0  95.0
 &rst     iat =   329,   330,   332,   346,
	  r1 =  24.0, r2 =  25.0, r3 =  95.0, r4 =  96.0,
	/

# 12 DG CHI:  (12 DG O4')-(12 DG C1')-(12 DG N9)-(12 DG C4) 200.0 280.0
 &rst     iat =   362,   363,   365,   379,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	/

# 13 DG CHI:  (13 DG O4')-(13 DG C1')-(13 DG N9)-(13 DG C4) 200.0 280.0
 &rst     iat =   395,   396,   398,   412,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	/

# 14 DT CHI:  (14 DT O4')-(14 DT C1')-(14 DT N1)-(14 DT C2) 170.0 310.0
 &rst     iat =   428,   429,   431,   443,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 15 BG CHI:  (5 DG O4')-(5 DG C1')-(5 DG N9)-(5 DG C4)  25.0  95.0
 &rst     iat =   136,   137,   139,   153,
	  r1 =  24.0, r2 =  25.0, r3 =  95.0, r4 =  96.0,
	/

# 16 DG CHI:  (16 DG O4')-(16 DG C1')-(16 DG N9)-(16 DG C4) 200.0 280.0
 &rst     iat =   493,   494,   496,   510,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	/

# 17 DG CHI:  (17 DG O4')-(17 DG C1')-(17 DG N9)-(17 DG C4) 200.0 280.0
 &rst     iat =   526,   527,   529,   543,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	/

# 18 DT CHI:  (18 DT O4')-(18 DT C1')-(18 DT N1)-(18 DT C2) 170.0 310.0
 &rst     iat =   559,   560,   562,   574,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 19 BG CHI:  (5 DG O4')-(5 DG C1')-(5 DG N9)-(5 DG C4)  25.0  95.0
 &rst     iat =   136,   137,   139,   153,
	  r1 =  24.0, r2 =  25.0, r3 =  95.0, r4 =  96.0,
	/

# 20 DG CHI:  (20 DG O4')-(20 DG C1')-(20 DG N9)-(20 DG C4) 200.0 280.0
 &rst     iat =   624,   625,   627,   641,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	/

# 21 DG CHI:  (21 DG O4')-(21 DG C1')-(21 DG N9)-(21 DG C4) 200.0 280.0
 &rst     iat =   657,   658,   660,   674,
	  r1 = 199.0, r2 = 200.0, r3 = 280.0, r4 = 281.0,
	/

# 22 DA CHI:  (22 DA O4')-(22 DA C1')-(22 DA N9)-(22 DA C4) 170.0 310.0
 &rst     iat =   690,   691,   693,   706,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 23 DC CHI:  (23 DC O4')-(23 DC C1')-(23 DC N1)-(23 DC C2) 170.0 310.0
 &rst     iat =   722,   723,   725,   735,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 24 DG CHI:  (24 DG O4')-(24 DG C1')-(24 DG N9)-(24 DG C4) 170.0 310.0
 &rst     iat =   752,   753,   755,   769,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

# 25 DC CHI:  (25 DC3 O4')-(25 DC3 C1')-(25 DC3 N1)-(25 DC3 C2) 170.0 310.0
 &rst     iat =   785,   786,   788,   798,
	  r1 = 169.0, r2 = 170.0, r3 = 310.0, r4 = 311.0,
	/

#


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