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
277254 2kf5 16171 cing 1-original 1 XPLOR/CNS chemical shift


!shift restraints for bound barnase, low pressure (exptl shifts)
!degenerate methyls
OBSE (resid 10 and (name HG1#)) (resid 10 and (name HG2#))  0.700  0.740 
OBSE (resid 14 and (name HD1#)) (resid 14 and (name HD2#))  0.280  0.180 
OBSE (resid 20 and (name HD1#)) (resid 20 and (name HD2#))  1.090  0.420 
OBSE (resid 33 and (name HD2#)) (resid 33 and (name HD1#))  0.590  0.890 
OBSE (resid 42 and (name HD2#)) (resid 42 and (name HD1#))  0.450  0.350 
OBSE (resid 45 and (name HG1#)) (resid 45 and (name HG2#))  0.930  0.730 
OBSE (resid 63 and (name HD2#)) (resid 63 and (name HD1#)) -0.460 -0.190 
OBSE (resid 89 and (name HD1#)) (resid 89 and (name HD2#))  0.700  0.860 
OBSE (resid 95 and (name HD1#)) (resid 95 and (name HD2#))  1.030  1.080 
!degenerate other
OBSE (resid 15 and (name HB1)) (resid 15 and (name HB2))  1.920  2.270 
OBSE (resid 21 and (name HB1)) (resid 21 and (name HB2))  1.780  2.300 
OBSE (resid 38 and (name HB1)) (resid 38 and (name HB2))  3.890  3.970 
OBSE (resid 44 and (name HB1)) (resid 44 and (name HB2))  2.950  2.900 
OBSE (resid 59 and (name HB1)) (resid 59 and (name HB2))  1.680  1.810 
OBSE (resid 64 and (name HB1)) (resid 64 and (name HB2))  2.370  2.560 
OBSE (resid 66 and (name HB1)) (resid 66 and (name HB2))  1.910  1.950 
OBSE (resid 72 and (name HB1)) (resid 72 and (name HB2))  1.880  0.400 
OBSE (resid 80 and (name HB1)) (resid 80 and (name HB2))  3.460  3.920 
OBSE (resid 85 and (name HB1)) (resid 85 and (name HB2))  3.610  3.530 
OBSE (resid 98 and (name HB1)) (resid 98 and (name HB2))  1.360  1.040 
OBSE (resid 19 and (name HD1)) (resid 19 and (name HD2))  1.720  1.780 
OBSE (resid 27 and (name HD1)) (resid 27 and (name HD2))  1.650  1.660 
OBSE (resid 47 and (name HD1)) (resid 47 and (name HD2))  3.450  3.620 
OBSE (resid 64 and (name HD1)) (resid 64 and (name HD2))  3.150  2.920 
OBSE (resid 19 and (name HE1)) (resid 19 and (name HE2))  3.050  2.960 
OBSE (resid 27 and (name HE1)) (resid 27 and (name HE2))  3.160  2.860 
OBSE (resid 49 and (name HE1)) (resid 49 and (name HE2))  2.700  2.460 
OBSE (resid 98 and (name HE1)) (resid 98 and (name HE2))  2.220  1.330 
OBSE (resid 108 and (name HE1)) (resid 108 and (name HE2))  2.810  3.060 
OBSE (resid 15 and (name HG1)) (resid 15 and (name HG2))  2.340  2.670 
OBSE (resid 29 and (name HG1)) (resid 29 and (name HG2))  2.490  2.480 
OBSE (resid 31 and (name HG1)) (resid 31 and (name HG2))  2.910  2.630 
OBSE (resid 47 and (name HG1)) (resid 47 and (name HG2))  2.510  2.100 
OBSE (resid 64 and (name HG1)) (resid 64 and (name HG2))  1.830  1.830 
OBSE (resid 55 and (name HG11)) (resid 55 and (name HG12))  1.170  0.920 
!Ha
OBSE (resid 3 and (name HA))  3.460
OBSE (resid 4 and (name HA))  4.150
OBSE (resid 5 and (name HA))  4.800
OBSE (resid 7 and (name HA))  4.780
OBSE (resid 10 and (name HA))  3.910
OBSE (resid 11 and (name HA))  4.050
OBSE (resid 13 and (name HA))  4.960
OBSE (resid 14 and (name HA))  3.750
OBSE (resid 15 and (name HA))  3.800
OBSE (resid 16 and (name HA))  3.940
OBSE (resid 17 and (name HA))  5.020
OBSE (resid 19 and (name HA))  4.430
OBSE (resid 26 and (name HA))  3.900
OBSE (resid 27 and (name HA))  4.080
OBSE (resid 28 and (name HA))  4.040
OBSE (resid 29 and (name HA))  3.910
OBSE (resid 30 and (name HA))  3.880
OBSE (resid 32 and (name HA))  4.080
OBSE (resid 33 and (name HA))  4.130
OBSE (resid 36 and (name HA))  4.170
OBSE (resid 42 and (name HA))  4.050
OBSE (resid 43 and (name HA))  4.180
OBSE (resid 49 and (name HA))  4.590
OBSE (resid 57 and (name HA))  4.880
OBSE (resid 58 and (name HA))  4.930
OBSE (resid 62 and (name HA))  3.940
OBSE (resid 63 and (name HA))  3.550
OBSE (resid 73 and (name HA))  5.340
OBSE (resid 74 and (name HA))  4.790
OBSE (resid 77 and (name HA))  4.550
OBSE (resid 78 and (name HA))  5.390
OBSE (resid 79 and (name HA))  3.900
OBSE (resid 84 and (name HA))  4.760
OBSE (resid 86 and (name HA))  5.220
OBSE (resid 88 and (name HA))  5.290
OBSE (resid 89 and (name HA))  5.460
OBSE (resid 90 and (name HA))  6.350
OBSE (resid 92 and (name HA))  3.500
OBSE (resid 96 and (name HA))  5.870
OBSE (resid 97 and (name HA))  5.630
OBSE (resid 98 and (name HA))  5.240
OBSE (resid 100 and (name HA))  4.530
OBSE (resid 104 and (name HA))  4.290
OBSE (resid 105 and (name HA))  4.650
OBSE (resid 106 and (name HA))  5.090
OBSE (resid 107 and (name HA))  4.480
OBSE (resid 108 and (name HA))  3.820
OBSE (resid 110 and (name HA))  4.320
!HN
OBSE (resid 4 and (name HN))  6.400
OBSE (resid 5 and (name HN))  8.740
OBSE (resid 6 and (name HN))  8.050
OBSE (resid 7 and (name HN))  7.880
OBSE (resid 8 and (name HN))  8.680
OBSE (resid 9 and (name HN))  7.870
OBSE (resid 10 and (name HN))  8.810
OBSE (resid 11 and (name HN))  8.480
OBSE (resid 12 and (name HN))  9.150
OBSE (resid 13 and (name HN))  8.180
OBSE (resid 14 and (name HN))  8.270
OBSE (resid 15 and (name HN))  9.240
OBSE (resid 16 and (name HN))  7.460
OBSE (resid 17 and (name HN))  8.320
OBSE (resid 18 and (name HN))  7.510
OBSE (resid 19 and (name HN))  7.120
OBSE (resid 20 and (name HN))  8.310
OBSE (resid 22 and (name HN))  7.770
OBSE (resid 23 and (name HN))  9.650
OBSE (resid 24 and (name HN))  8.810
OBSE (resid 25 and (name HN))  8.690
OBSE (resid 26 and (name HN))  8.910
OBSE (resid 27 and (name HN))  9.120
OBSE (resid 28 and (name HN))  8.280
OBSE (resid 29 and (name HN))  7.940
OBSE (resid 30 and (name HN))  8.330
OBSE (resid 31 and (name HN))  9.260
OBSE (resid 32 and (name HN))  9.240
OBSE (resid 33 and (name HN))  8.490
OBSE (resid 34 and (name HN))  7.500
OBSE (resid 35 and (name HN))  8.630
OBSE (resid 36 and (name HN))  8.780
OBSE (resid 37 and (name HN))  8.070
OBSE (resid 39 and (name HN))  7.680
OBSE (resid 40 and (name HN))  9.570
OBSE (resid 41 and (name HN))  8.490
OBSE (resid 43 and (name HN))  8.700
OBSE (resid 44 and (name HN))  7.580
OBSE (resid 45 and (name HN))  7.860
OBSE (resid 46 and (name HN))  8.130
OBSE (resid 48 and (name HN))  8.840
OBSE (resid 49 and (name HN))  8.820
OBSE (resid 50 and (name HN))  8.550
OBSE (resid 51 and (name HN))  7.840
OBSE (resid 52 and (name HN))  9.530
OBSE (resid 53 and (name HN))  9.290
OBSE (resid 54 and (name HN))  8.230
OBSE (resid 55 and (name HN))  8.560
OBSE (resid 56 and (name HN))  8.890
OBSE (resid 61 and (name HN))  6.930
OBSE (resid 62 and (name HN))  8.040
OBSE (resid 63 and (name HN))  7.180
OBSE (resid 69 and (name HN))  8.390
OBSE (resid 70 and (name HN))  8.170
OBSE (resid 71 and (name HN))  8.880
OBSE (resid 72 and (name HN))  8.650
OBSE (resid 73 and (name HN))  8.640
OBSE (resid 74 and (name HN))  8.920
OBSE (resid 75 and (name HN))  9.540
OBSE (resid 76 and (name HN))  8.430
OBSE (resid 79 and (name HN))  6.560
OBSE (resid 80 and (name HN))  7.990
OBSE (resid 81 and (name HN))  8.870
OBSE (resid 82 and (name HN))  8.720
OBSE (resid 84 and (name HN))  8.830
OBSE (resid 86 and (name HN))  7.700
OBSE (resid 87 and (name HN))  9.700
OBSE (resid 88 and (name HN))  8.890
OBSE (resid 89 and (name HN))  9.550
OBSE (resid 90 and (name HN))  9.470
OBSE (resid 91 and (name HN))  8.080
OBSE (resid 92 and (name HN))  8.270
OBSE (resid 93 and (name HN))  7.330
OBSE (resid 94 and (name HN))  5.990
OBSE (resid 95 and (name HN))  7.390
OBSE (resid 96 and (name HN))  8.730
OBSE (resid 97 and (name HN))  9.690
OBSE (resid 98 and (name HN))  9.610
OBSE (resid 99 and (name HN))  9.280
OBSE (resid 100 and (name HN))  8.290
OBSE (resid 101 and (name HN))  7.550
OBSE (resid 102 and (name HN))  7.720
OBSE (resid 103 and (name HN))  7.520
OBSE (resid 104 and (name HN))  7.590
OBSE (resid 105 and (name HN))  7.840
OBSE (resid 106 and (name HN))  8.670
OBSE (resid 107 and (name HN))  8.840
OBSE (resid 108 and (name HN))  8.630
OBSE (resid 110 and (name HN))  8.720
!single methyl
OBSE (resid 4 and (name HD1#))  0.410
OBSE (resid 4 and (name HG2#))  0.830
OBSE (resid 6 and (name HG2#))  1.150
OBSE (resid 11 and (name HB#))  1.540
OBSE (resid 16 and (name HG2#))  0.490
OBSE (resid 25 and (name HD1#))  0.420
OBSE (resid 25 and (name HG2#))  0.850
OBSE (resid 26 and (name HG2#))  1.150
OBSE (resid 30 and (name HB#))  1.280
OBSE (resid 32 and (name HB#))  1.470
OBSE (resid 37 and (name HB#))  1.410
OBSE (resid 43 and (name HB#))  1.520
OBSE (resid 46 and (name HB#))  1.080
OBSE (resid 51 and (name HD1#))  0.000
OBSE (resid 51 and (name HG2#))  0.510
OBSE (resid 55 and (name HD1#))  0.880
OBSE (resid 55 and (name HG2#))  0.860
OBSE (resid 70 and (name HG2#))  0.900
OBSE (resid 74 and (name HB#))  0.760
OBSE (resid 76 and (name HD1#))  0.030
OBSE (resid 76 and (name HG2#)) -0.750
OBSE (resid 79 and (name HG2#))  0.660
OBSE (resid 88 and (name HD1#))  0.810
OBSE (resid 88 and (name HG2#))  0.970
OBSE (resid 96 and (name HD1#))  1.170
OBSE (resid 96 and (name HG2#))  0.940
OBSE (resid 99 and (name HG2#))  0.710
OBSE (resid 100 and (name HG2#))  1.160
OBSE (resid 105 and (name HG2#))  1.080
OBSE (resid 107 and (name HG2#))  1.120
OBSE (resid 109 and (name HD1#))  0.580
OBSE (resid 109 and (name HG2#))  0.510
!other
OBSE (resid 3 and (name HB))  2.110
OBSE (resid 4 and (name HB))  1.620
OBSE (resid 10 and (name HB))  2.460
OBSE (resid 14 and (name HG))  1.550
OBSE (resid 16 and (name HB))  3.420
OBSE (resid 25 and (name HB))  1.730
OBSE (resid 33 and (name HG))  1.540
OBSE (resid 36 and (name HB))  2.190
OBSE (resid 45 and (name HB))  2.130
OBSE (resid 51 and (name HB))  1.570
OBSE (resid 55 and (name HB))  2.020
OBSE (resid 63 and (name HG)) -0.160
OBSE (resid 88 and (name HB))  1.920
OBSE (resid 89 and (name HG))  1.510
OBSE (resid 95 and (name HG))  1.590
OBSE (resid 96 and (name HB))  2.100
OBSE (resid 107 and (name HB))  4.410


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