NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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544092 |
2ll5   |
18023 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! # = atoms with coincident chemical shifts or that cannot be stereospecifically assigned ! lower and upper distance bounds are generated by subtracting and adding d- and d+ respectively to d ! Residue numbers in this file differ from those in the PDB file. ! sequence cyclo(gly asp ala tyr ala glu trp leu ala asp gly gly pro ser ser gly arg pro pro pro ser gly) ! PDB file -1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 ! this file 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 ! ! atom1 atom2 d d- d+ ! Start Here !i,i assign (residue 10 and name hb2 ) (residue 10 and name hn ) 2.65 0.32 0.27 assign (residue 10 and name hb1 ) (residue 10 and name hn ) 3.07 0.46 0.36 assign (residue 10 and name ha ) (residue 10 and name hn ) 3.08 0.46 0.37 assign (residue 11 and name ha2 ) (residue 11 and name hn ) 2.50 0.27 0.24 assign (residue 11 and name ha1 ) (residue 11 and name hn ) 3.11 0.47 0.37 assign (residue 12 and name ha2 ) (residue 12 and name hn ) 2.48 0.27 0.24 assign (residue 12 and name ha1 ) (residue 12 and name hn ) 2.90 0.40 0.32 assign (residue 13 and name ha ) (residue 13 and name hb1 ) 2.80 0.37 0.30 assign (residue 13 and name ha ) (residue 13 and name hg# ) 3.55 0.59 0.48 assign (residue 13 and name hd1 ) (residue 13 and name hb2 ) 3.83 0.69 0.63 assign (residue 14 and name ha ) (residue 14 and name hb# ) 2.49 0.25 0.23 assign (residue 14 and name hb# ) (residue 14 and name hn ) 2.92 0.39 0.31 assign (residue 14 and name ha ) (residue 14 and name hn ) 2.96 0.42 0.34 assign (residue 15 and name hb1 ) (residue 15 and name hn ) 2.71 0.34 0.28 assign (residue 15 and name ha ) (residue 15 and name hn ) 2.74 0.35 0.29 assign (residue 15 and name hb2 ) (residue 15 and name hn ) 3.08 0.46 0.37 assign (residue 17 and name hb# ) (residue 17 and name hn ) 3.33 0.54 0.64 assign (residue 18 and name ha ) (residue 18 and name hb1 ) 2.48 0.27 0.24 assign (residue 17 and name hd# ) (residue 17 and name he ) 3.01 0.44 0.55 assign (residue 19 and name ha ) (residue 19 and name hb1 ) 2.76 0.36 0.29 assign (residue 19 and name ha ) (residue 19 and name hb2 ) 3.40 0.56 0.46 assign (residue 1 and name ha# ) (residue 1 and name hn ) 2.86 0.39 0.51 assign (residue 20 and name ha ) (residue 20 and name hb1 ) 2.79 0.37 0.30 assign (residue 20 and name ha ) (residue 20 and name hb2 ) 3.04 0.45 0.36 assign (residue 21 and name hb# ) (residue 21 and name hn ) 2.77 0.34 0.28 assign (residue 21 and name ha ) (residue 21 and name hn ) 2.79 0.37 0.30 assign (residue 22 and name ha# ) (residue 22 and name hn ) 2.49 0.27 0.44 assign (residue 2 and name ha ) (residue 2 and name hb# ) 2.79 0.37 0.50 assign (residue 2 and name hb# ) (residue 2 and name hn ) 3.17 0.49 0.59 assign (residue 2 and name ha ) (residue 2 and name hn ) 3.42 0.57 0.47 assign (residue 3 and name ha ) (residue 3 and name hn ) 3.12 0.47 0.38 assign (residue 3 and name hb# ) (residue 3 and name hn ) 3.13 0.37 0.31 assign (residue 4 and name he# ) (residue 4 and name hd# ) 1.95 0.06 1.02 assign (residue 4 and name hb2 ) (residue 4 and name hd# ) 2.37 0.21 0.63 assign (residue 4 and name hb1 ) (residue 4 and name hd# ) 2.43 0.23 0.64 assign (residue 4 and name hb2 ) (residue 4 and name hn ) 2.53 0.28 0.24 assign (residue 4 and name hb1 ) (residue 4 and name hn ) 2.66 0.33 0.27 assign (residue 4 and name ha ) (residue 4 and name hb2 ) 2.72 0.34 0.28 assign (residue 4 and name ha ) (residue 4 and name hd# ) 2.82 0.36 0.71 assign (residue 4 and name ha ) (residue 4 and name hn ) 3.01 0.44 0.35 assign (residue 5 and name ha ) (residue 5 and name hb# ) 2.71 0.24 0.24 assign (residue 5 and name hb# ) (residue 5 and name hn ) 2.76 0.25 0.25 assign (residue 5 and name ha ) (residue 5 and name hn ) 2.83 0.38 0.31 assign (residue 6 and name ha ) (residue 6 and name hg# ) 2.66 0.33 0.47 assign (residue 6 and name hb# ) (residue 6 and name hn ) 2.67 0.33 0.47 assign (residue 6 and name ha ) (residue 6 and name hn ) 2.83 0.38 0.31 assign (residue 6 and name ha ) (residue 6 and name hb# ) 3.03 0.44 0.55 assign (residue 6 and name hg# ) (residue 6 and name hn ) 3.29 0.52 0.63 assign (residue 7 and name hz2 ) (residue 7 and name hh2 ) 1.80 0.00 0.54 assign (residue 7 and name hh2 ) (residue 7 and name hz3 ) 1.99 0.11 0.56 assign (residue 7 and name hz3 ) (residue 7 and name he3 ) 2.11 0.15 0.58 assign (residue 7 and name hd1 ) (residue 7 and name he1 ) 2.16 0.17 0.59 assign (residue 7 and name hb1 ) (residue 7 and name he3 ) 2.55 0.29 0.45 assign (residue 7 and name hb1 ) (residue 7 and name hn ) 2.56 0.30 0.25 assign (residue 7 and name hb2 ) (residue 7 and name hn ) 2.58 0.30 0.25 assign (residue 7 and name hz2 ) (residue 7 and name he1 ) 2.59 0.30 0.66 assign (residue 7 and name hb2 ) (residue 7 and name hd1 ) 2.65 0.32 0.47 assign (residue 7 and name ha ) (residue 7 and name hb2 ) 2.88 0.39 0.32 assign (residue 7 and name ha ) (residue 7 and name hd1 ) 2.97 0.42 0.54 assign (residue 7 and name ha ) (residue 7 and name hn ) 3.03 0.44 0.35 assign (residue 7 and name hb2 ) (residue 7 and name he3 ) 3.32 0.53 0.63 assign (residue 7 and name hb1 ) (residue 7 and name hd1 ) 4.03 0.76 0.93 assign (residue 8 and name hg ) (residue 8 and name hd2# ) 2.47 0.16 0.21 assign (residue 8 and name hb2 ) (residue 8 and name hn ) 2.50 0.27 0.24 assign (residue 8 and name hg ) (residue 8 and name hd1# ) 2.59 0.20 0.22 assign (residue 8 and name hg ) (residue 8 and name hn ) 2.69 0.33 0.27 assign (residue 8 and name ha ) (residue 8 and name hn ) 2.72 0.35 0.28 assign (residue 8 and name ha ) (residue 8 and name hb1 ) 2.79 0.37 0.30 assign (residue 8 and name ha ) (residue 8 and name hb2 ) 2.89 0.40 0.32 assign (residue 8 and name ha ) (residue 8 and name hd2# ) 3.07 0.35 0.30 assign (residue 8 and name hb1 ) (residue 8 and name hd1# ) 3.10 0.36 0.30 assign (residue 8 and name hb1 ) (residue 8 and name hd2# ) 3.15 0.38 0.31 assign (residue 8 and name hb1 ) (residue 8 and name hn ) 3.17 0.49 0.39 assign (residue 8 and name hb2 ) (residue 8 and name hd1# ) 3.24 0.41 0.33 assign (residue 8 and name hb2 ) (residue 8 and name hd2# ) 3.64 0.53 0.42 assign (residue 8 and name ha ) (residue 8 and name hd1# ) 4.08 0.67 0.56 assign (residue 9 and name ha ) (residue 9 and name hb# ) 2.22 0.17 0.19 assign (residue 9 and name hb# ) (residue 9 and name hn ) 2.45 0.24 0.22 assign (residue 9 and name ha ) (residue 9 and name hn ) 2.92 0.41 0.33 !i,i+1 assign (residue 10 and name ha ) (residue 11 and name hn ) 3.80 0.69 0.62 assign (residue 10 and name hn ) (residue 11 and name hn ) 2.74 0.35 0.28 assign (residue 11 and name hn ) (residue 12 and name hn ) 2.49 0.27 0.24 assign (residue 11 and name ha1 ) (residue 12 and name hn ) 3.66 0.64 0.56 assign (residue 12 and name ha1 ) (residue 13 and name hd2 ) 2.64 0.32 0.27 assign (residue 12 and name ha1 ) (residue 13 and name hd1 ) 2.71 0.34 0.28 assign (residue 13 and name hd2 ) (residue 14 and name hn ) 3.57 0.61 0.52 assign (residue 13 and name hd1 ) (residue 14 and name hn ) 3.77 0.68 0.60 assign (residue 13 and name ha ) (residue 14 and name hn ) 3.84 0.70 0.64 assign (residue 14 and name hn ) (residue 15 and name hn ) 2.63 0.32 0.26 assign (residue 14 and name ha ) (residue 15 and name hn ) 3.43 0.57 0.47 assign (residue 15 and name ha ) (residue 16 and name hn ) 3.61 0.63 0.54 assign (residue 15 and name hn ) (residue 16 and name hn ) 2.76 0.36 0.29 assign (residue 16 and name ha1 ) (residue 17 and name hn ) 3.49 0.59 0.49 assign (residue 16 and name ha2 ) (residue 17 and name hn ) 3.74 0.67 0.59 assign (residue 17 and name ha ) (residue 18 and name hd1 ) 2.71 0.34 0.28 assign (residue 17 and name ha ) (residue 18 and name hd2 ) 2.96 0.40 0.74 assign (residue 18 and name ha ) (residue 19 and name hd# ) 2.50 0.25 0.23 assign (residue 18 and name hb1 ) (residue 19 and name hd# ) 3.38 0.53 0.43 assign (residue 1 and name hn ) (residue 22 and name hn ) 3.84 0.70 0.64 assign (residue 1 and name ha# ) (residue 2 and name hn ) 3.12 0.47 0.58 assign (residue 1 and name hn ) (residue 2 and name hn ) 3.70 0.65 0.58 assign (residue 19 and name ha ) (residue 20 and name hd1 ) 2.36 0.23 0.22 assign (residue 19 and name ha ) (residue 20 and name hd2 ) 2.52 0.28 0.24 assign (residue 20 and name ha ) (residue 21 and name hn ) 2.32 0.22 0.21 assign (residue 21 and name ha ) (residue 22 and name hn ) 2.74 0.35 0.29 assign (residue 1 and name hn ) (residue 22 and name ha# ) 2.68 0.33 0.47 assign (residue 2 and name hb# ) (residue 3 and name hn ) 3.32 0.53 0.63 assign (residue 2 and name ha ) (residue 3 and name hn ) 3.89 0.72 0.66 assign (residue 2 and name hn ) (residue 3 and name hn ) 3.17 0.49 0.39 assign (residue 3 and name hb# ) (residue 4 and name hn ) 3.74 0.56 0.45 assign (residue 3 and name ha ) (residue 4 and name hn ) 4.04 0.76 0.74 assign (residue 3 and name hn ) (residue 4 and name hn ) 3.00 0.43 0.34 assign (residue 4 and name hb1 ) (residue 5 and name hn ) 2.91 0.41 0.32 assign (residue 4 and name ha ) (residue 5 and name hn ) 3.42 0.57 0.47 assign (residue 4 and name hb2 ) (residue 5 and name hn ) 3.75 0.67 0.60 assign (residue 4 and name hn ) (residue 5 and name hn ) 2.61 0.31 0.26 assign (residue 4 and name hd# ) (residue 5 and name ha ) 3.48 0.57 0.88 assign (residue 5 and name hb# ) (residue 6 and name hn ) 3.25 0.41 0.34 assign (residue 5 and name ha ) (residue 6 and name hn ) 3.67 0.65 0.56 assign (residue 6 and name ha ) (residue 7 and name hn ) 3.11 0.47 0.37 assign (residue 6 and name hb# ) (residue 7 and name hn ) 3.24 0.51 0.61 assign (residue 7 and name hn ) (residue 8 and name hn ) 2.72 0.34 0.28 assign (residue 7 and name hb1 ) (residue 8 and name hn ) 2.78 0.36 0.29 assign (residue 7 and name he3 ) (residue 8 and name hn ) 2.99 0.43 0.54 assign (residue 7 and name ha ) (residue 8 and name hn ) 3.80 0.69 0.62 assign (residue 7 and name he3 ) (residue 8 and name hg ) 2.88 0.40 0.52 assign (residue 7 and name hz3 ) (residue 8 and name hd2# ) 3.05 0.35 0.54 assign (residue 7 and name he3 ) (residue 8 and name ha ) 3.22 0.50 0.61 assign (residue 7 and name he3 ) (residue 8 and name hd2# ) 3.40 0.46 0.61 assign (residue 8 and name hb2 ) (residue 9 and name hn ) 3.06 0.45 0.36 assign (residue 8 and name hb1 ) (residue 9 and name hn ) 3.33 0.54 0.44 assign (residue 8 and name ha ) (residue 9 and name hn ) 3.60 0.62 0.53 assign (residue 9 and name ha ) (residue 10 and name hn ) 3.35 0.54 0.44 assign (residue 8 and name hn ) (residue 9 and name hn ) 2.64 0.32 0.27 !i,i+2 assign (residue 10 and name hb1 ) (residue 12 and name hn ) 4.00 0.40 1.50 assign (residue 10 and name hn ) (residue 12 and name hn ) 3.62 0.63 0.54 assign (residue 12 and name ha1 ) (residue 14 and name hn ) 4.00 0.60 1.50 assign (residue 14 and name ha ) (residue 16 and name hn ) 4.15 0.80 0.80 assign (residue 15 and name hb2 ) (residue 17 and name hn ) 3.52 0.60 0.51 assign (residue 15 and name hb1 ) (residue 17 and name hn ) 4.10 0.50 1.50 assign (residue 9 and name ha ) (residue 11 and name hn ) 3.92 0.72 0.68 !i,i+3 assign (residue 2 and name ha ) (residue 5 and name hn ) 3.29 0.53 0.43 assign (residue 2 and name ha ) (residue 5 and name hb# ) 3.68 0.54 0.43 assign (residue 3 and name ha ) (residue 6 and name hn ) 3.59 0.62 0.53 assign (residue 3 and name ha ) (residue 6 and name hb# ) 3.63 0.63 0.75 assign (residue 4 and name ha ) (residue 7 and name hb1 ) 2.49 0.27 0.24 assign (residue 4 and name ha ) (residue 7 and name he3 ) 3.53 0.60 0.71 assign (residue 5 and name ha ) (residue 8 and name hb2 ) 3.34 0.54 0.44 assign (residue 5 and name ha ) (residue 8 and name hd1# ) 3.67 0.54 0.43 assign (residue 6 and name ha ) (residue 9 and name hb# ) 2.48 0.25 1.25 assign (residue 6 and name ha ) (residue 9 and name hn ) 3.22 0.50 0.40 assign (residue 7 and name ha ) (residue 10 and name hn ) 3.39 0.55 0.46 assign (residue 7 and name ha ) (residue 10 and name hb2 ) 3.13 0.48 0.38 assign (residue 7 and name ha ) (residue 10 and name hb1 ) 3.39 0.56 0.46 assign (residue 8 and name ha ) (residue 11 and name hn ) 3.71 0.66 0.58 !i,i+4 assign (residue 8 and name ha ) (residue 12 and name ha1 ) 2.91 0.41 0.32 assign (residue 4 and name ha ) (residue 8 and name hn ) 3.54 0.60 0.51 assign (residue 8 and name ha ) (residue 12 and name hn ) 2.75 0.36 0.29 assign (residue 4 and name he# ) (residue 8 and name hd1# ) 3.16 0.36 0.81 assign (residue 4 and name hd# ) (residue 8 and name hd1# ) 3.50 0.46 0.87 assign (residue 4 and name he# ) (residue 8 and name hd2# ) 3.62 0.50 0.90 assign (residue 4 and name he# ) (residue 8 and name hg ) 4.03 0.74 1.10 !i,i+n assign (residue 7 and name hz2 ) (residue 13 and name ha ) 2.69 0.34 0.47 assign (residue 7 and name hh2 ) (residue 13 and name hd1 ) 2.92 0.41 0.52 assign (residue 7 and name hz2 ) (residue 13 and name hg1 ) 3.01 0.44 0.55 assign (residue 7 and name hh2 ) (residue 13 and name hg1 ) 3.12 0.47 0.58 assign (residue 7 and name hh2 ) (residue 13 and name ha ) 3.58 0.62 0.73 assign (residue 7 and name hd1 ) (residue 17 and name hg# ) 2.77 0.36 0.69 assign (residue 7 and name hd1 ) (residue 17 and name hb# ) 2.91 0.41 0.72 assign (residue 7 and name he1 ) (residue 17 and name hb# ) 3.34 0.54 0.84 assign (residue 7 and name he1 ) (residue 17 and name hg# ) 3.40 0.56 0.86 assign (residue 7 and name he1 ) (residue 17 and name hn ) 3.47 0.58 0.68 assign (residue 4 and name he# ) (residue 19 and name hb2 ) 2.96 0.40 0.74 assign (residue 4 and name hd# ) (residue 19 and name hb2 ) 3.05 0.43 0.76 assign (residue 4 and name hd# ) (residue 19 and name hb1 ) 3.35 0.52 0.84 assign (residue 4 and name he# ) (residue 19 and name hb1 ) 3.38 0.53 0.85 assign (residue 7 and name hz2 ) (residue 19 and name hd# ) 3.08 0.44 0.56 assign (residue 7 and name hd1 ) (residue 19 and name ha ) 3.31 0.53 0.63 assign (residue 7 and name he1 ) (residue 19 and name ha ) 3.39 0.56 0.66 assign (residue 4 and name hd# ) (residue 20 and name hd2 ) 2.86 0.37 0.71 assign (residue 7 and name hd1 ) (residue 20 and name hd1 ) 2.88 0.40 0.52 assign (residue 7 and name hd1 ) (residue 20 and name hd2 ) 3.90 0.72 0.87 assign (residue 4 and name ha ) (residue 20 and name hd2 ) 3.03 0.44 0.35 assign (residue 4 and name ha ) (residue 20 and name hg# ) 3.28 0.50 0.40 assign (residue 4 and name ha ) (residue 20 and name hb2 ) 3.48 0.58 0.49 assign (residue 7 and name hd1 ) (residue 17 and name he ) 3.49 0.59 0.69 assign (residue 7 and name hb2 ) (residue 20 and name hd2 ) 3.28 0.52 0.42 assign (residue 7 and name hb1 ) (residue 20 and name hd2 ) 3.65 0.64 0.55 assign (residue 7 and name he1 ) (residue 13 and name ha ) 4.00 0.40 1.50 assign (residue 7 and name hz2 ) (residue 13 and name hb1 ) 4.00 0.70 1.50 assign (residue 7 and name hb1 ) (residue 20 and name hg2 ) 4.00 0.70 1.50 assign (residue 7 and name hb2 ) (residue 20 and name hg1 ) 4.00 0.70 1.50
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