NMR Restraints Grid

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

image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype
	648719	6iy5	cing	1-original	4	AMBER	stereochemistry	chirality

# Restraints file 5: rst_chir.txt
# chiral rst
#  chirality for residue 1 atoms:  C2' O4' N9 H1'
 &rst iat=27,8,11,10, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 10., rk3=10.,  &end
bad constraint for residue 1 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 1 atoms:  O3' C2' C4' H3'
 &rst iat=30,27,6,26, &end
#
#  chirality for residue 1 atoms:  C3' C5' O4' H4'
 &rst iat=25,3,8,7, &end
bad constraint for residue 1 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 2 atoms:  C2' O4' N1 H1'
 &rst iat=59,40,43,42, &end
bad constraint for residue 2 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 2 atoms:  O3' C2' C4' H3'
 &rst iat=62,59,38,58, &end
#
#  chirality for residue 2 atoms:  C3' C5' O4' H4'
 &rst iat=57,35,40,39, &end
bad constraint for residue 2 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 3 atoms:  C2' O4' N1 H1'
 &rst iat=91,72,75,74, &end
bad constraint for residue 3 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 3 atoms:  O3' C2' C4' H3'
 &rst iat=94,91,70,90, &end
#
#  chirality for residue 3 atoms:  C3' C5' O4' H4'
 &rst iat=89,67,72,71, &end
bad constraint for residue 3 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 4 atoms:  C2' O4' N1 H1'
 &rst iat=121,104,107,106, &end
bad constraint for residue 4 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 4 atoms:  O3' C2' C4' H3'
 &rst iat=124,121,102,120, &end
#
#  chirality for residue 4 atoms:  C3' C5' O4' H4'
 &rst iat=119,99,104,103, &end
bad constraint for residue 4 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 5 atoms:  C2' O4' N1 H1'
 &rst iat=153,134,137,136, &end
bad constraint for residue 5 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 5 atoms:  O3' C2' C4' H3'
 &rst iat=156,153,132,152, &end
#
#  chirality for residue 5 atoms:  C3' C5' O4' H4'
 &rst iat=151,129,134,133, &end
bad constraint for residue 5 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 6 atoms:  C2' O4' N9 H1'
 &rst iat=185,166,169,168, &end
bad constraint for residue 6 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 6 atoms:  O3' C2' C4' H3'
 &rst iat=188,185,164,184, &end
#
#  chirality for residue 6 atoms:  C3' C5' O4' H4'
 &rst iat=183,161,166,165, &end
bad constraint for residue 6 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 7 atoms:  C2' O4' N1 H1'
 &rst iat=217,198,201,200, &end
bad constraint for residue 7 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 7 atoms:  O3' C2' C4' H3'
 &rst iat=220,217,196,216, &end
#
#  chirality for residue 7 atoms:  C3' C5' O4' H4'
 &rst iat=215,193,198,197, &end
bad constraint for residue 7 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 8 atoms:  C2' O4' N1 H1'
 &rst iat=249,230,233,232, &end
bad constraint for residue 8 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 8 atoms:  O3' C2' C4' H3'
 &rst iat=252,249,228,248, &end
#
#  chirality for residue 8 atoms:  C3' C5' O4' H4'
 &rst iat=247,225,230,229, &end
bad constraint for residue 8 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 9 atoms:  C2' O4' N1 H1'
 &rst iat=279,262,265,264, &end
bad constraint for residue 9 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 9 atoms:  O3' C2' C4' H3'
 &rst iat=282,279,260,278, &end
#
#  chirality for residue 9 atoms:  C3' C5' O4' H4'
 &rst iat=277,257,262,261, &end
bad constraint for residue 9 atoms:  C4' O5' H5'1 H5'2
#
#  chirality for residue 10 atoms:  C2' O4' N1 H1'
 &rst iat=311,292,295,294, &end
bad constraint for residue 10 atoms:  C3' C1' H2'1 H2'2
#
#  chirality for residue 10 atoms:  O3' C2' C4' H3'
 &rst iat=314,311,290,310, &end
#
#  chirality for residue 10 atoms:  C3' C5' O4' H4'
 &rst iat=309,287,292,291, &end
bad constraint for residue 10 atoms:  C4' O5' H5'1 H5'2

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