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
277259 2kf6 16172 cing 1-original 1 XPLOR/CNS chemical shift


!shift restraints for bound barnase, high pressure (explt plus change with P)
!degenerate methyls
OBSE (resid 10 and (name HG1#)) (resid 10 and (name HG2#))  0.700  0.760 
OBSE (resid 14 and (name HD1#)) (resid 14 and (name HD2#))  0.300  0.110 
OBSE (resid 20 and (name HD1#)) (resid 20 and (name HD2#))  1.090  0.370 
OBSE (resid 33 and (name HD2#)) (resid 33 and (name HD1#))  0.600  0.900 
OBSE (resid 42 and (name HD2#)) (resid 42 and (name HD1#))  0.440  0.330 
OBSE (resid 45 and (name HG1#)) (resid 45 and (name HG2#))  0.930  0.720 
OBSE (resid 63 and (name HD2#)) (resid 63 and (name HD1#)) -0.420 -0.160 
OBSE (resid 89 and (name HD1#)) (resid 89 and (name HD2#))  0.690  0.960 
OBSE (resid 95 and (name HD1#)) (resid 95 and (name HD2#))  1.050  1.070 
!degenerate other
OBSE (resid 15 and (name HB1)) (resid 15 and (name HB2))  1.930  2.280 
OBSE (resid 21 and (name HB1)) (resid 21 and (name HB2))  1.770  2.230 
OBSE (resid 38 and (name HB1)) (resid 38 and (name HB2))  3.870  3.950 
OBSE (resid 44 and (name HB1)) (resid 44 and (name HB2))  2.960  2.890 
OBSE (resid 59 and (name HB1)) (resid 59 and (name HB2))  1.740  1.860 
OBSE (resid 64 and (name HB1)) (resid 64 and (name HB2))  2.360  2.570 
OBSE (resid 66 and (name HB1)) (resid 66 and (name HB2))  1.890  1.940 
OBSE (resid 72 and (name HB1)) (resid 72 and (name HB2))  1.930  0.350 
OBSE (resid 80 and (name HB1)) (resid 80 and (name HB2))  3.470  3.940 
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))  1.280  1.020 
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))  1.660  1.670 
OBSE (resid 47 and (name HD1)) (resid 47 and (name HD2))  3.450  3.610 
OBSE (resid 64 and (name HD1)) (resid 64 and (name HD2))  3.040  2.860 
OBSE (resid 19 and (name HE1)) (resid 19 and (name HE2))  3.030  2.950 
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))  2.710  2.470 
OBSE (resid 98 and (name HE1)) (resid 98 and (name HE2))  2.150  1.310 
OBSE (resid 108 and (name HE1)) (resid 108 and (name HE2))  2.800  3.050 
OBSE (resid 15 and (name HG1)) (resid 15 and (name HG2))  2.390  2.730 
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  2.600 
OBSE (resid 47 and (name HG1)) (resid 47 and (name HG2))  2.500  2.090 
OBSE (resid 64 and (name HG1)) (resid 64 and (name HG2))  1.810  1.810 
OBSE (resid 55 and (name HG11)) (resid 55 and (name HG12))  1.140  0.940 
!Ha
OBSE (resid 3 and (name HA))  3.450
OBSE (resid 4 and (name HA))  4.170
OBSE (resid 5 and (name HA))  4.820
OBSE (resid 7 and (name HA))  4.750
OBSE (resid 10 and (name HA))  3.900
OBSE (resid 11 and (name HA))  4.060
OBSE (resid 13 and (name HA))  4.980
OBSE (resid 14 and (name HA))  3.760
OBSE (resid 15 and (name HA))  3.860
OBSE (resid 16 and (name HA))  3.910
OBSE (resid 17 and (name HA))  5.010
OBSE (resid 19 and (name HA))  4.430
OBSE (resid 26 and (name HA))  3.920
OBSE (resid 27 and (name HA))  4.060
OBSE (resid 28 and (name HA))  4.040
OBSE (resid 29 and (name HA))  3.920
OBSE (resid 30 and (name HA))  3.860
OBSE (resid 32 and (name HA))  4.110
OBSE (resid 33 and (name HA))  4.180
OBSE (resid 36 and (name HA))  4.120
OBSE (resid 42 and (name HA))  4.030
OBSE (resid 43 and (name HA))  4.170
OBSE (resid 49 and (name HA))  4.590
OBSE (resid 57 and (name HA))  4.890
OBSE (resid 58 and (name HA))  4.940
OBSE (resid 62 and (name HA))  3.940
OBSE (resid 63 and (name HA))  3.470
OBSE (resid 73 and (name HA))  5.370
OBSE (resid 74 and (name HA))  4.780
OBSE (resid 77 and (name HA))  4.560
OBSE (resid 78 and (name HA))  5.380
OBSE (resid 79 and (name HA))  3.950
OBSE (resid 84 and (name HA))  4.770
OBSE (resid 86 and (name HA))  5.240
OBSE (resid 88 and (name HA))  5.270
OBSE (resid 89 and (name HA))  5.440
OBSE (resid 90 and (name HA))  6.350
OBSE (resid 92 and (name HA))  3.510
OBSE (resid 96 and (name HA))  5.900
OBSE (resid 97 and (name HA))  5.620
OBSE (resid 98 and (name HA))  5.220
OBSE (resid 100 and (name HA))  4.530
OBSE (resid 104 and (name HA))  4.290
OBSE (resid 105 and (name HA))  4.660
OBSE (resid 106 and (name HA))  5.110
OBSE (resid 107 and (name HA))  4.570
OBSE (resid 108 and (name HA))  3.650
OBSE (resid 110 and (name HA))  4.330
!HN
OBSE (resid 4 and (name HN))  6.420
OBSE (resid 5 and (name HN))  8.810
OBSE (resid 6 and (name HN))  8.060
OBSE (resid 7 and (name HN))  7.950
OBSE (resid 8 and (name HN))  8.820
OBSE (resid 9 and (name HN))  7.880
OBSE (resid 10 and (name HN))  8.920
OBSE (resid 11 and (name HN))  8.500
OBSE (resid 12 and (name HN))  9.090
OBSE (resid 13 and (name HN))  8.150
OBSE (resid 14 and (name HN))  8.310
OBSE (resid 15 and (name HN))  9.270
OBSE (resid 16 and (name HN))  7.600
OBSE (resid 17 and (name HN))  8.390
OBSE (resid 18 and (name HN))  7.480
OBSE (resid 19 and (name HN))  7.060
OBSE (resid 20 and (name HN))  8.440
OBSE (resid 22 and (name HN))  7.900
OBSE (resid 23 and (name HN))  9.440
OBSE (resid 24 and (name HN))  8.770
OBSE (resid 25 and (name HN))  8.660
OBSE (resid 26 and (name HN))  8.920
OBSE (resid 27 and (name HN))  8.940
OBSE (resid 28 and (name HN))  8.310
OBSE (resid 29 and (name HN))  8.040
OBSE (resid 30 and (name HN))  8.400
OBSE (resid 31 and (name HN))  9.320
OBSE (resid 32 and (name HN))  9.310
OBSE (resid 33 and (name HN))  8.460
OBSE (resid 34 and (name HN))  7.520
OBSE (resid 35 and (name HN))  8.750
OBSE (resid 36 and (name HN))  8.860
OBSE (resid 37 and (name HN))  8.130
OBSE (resid 39 and (name HN))  7.620
OBSE (resid 40 and (name HN))  9.530
OBSE (resid 41 and (name HN))  8.490
OBSE (resid 43 and (name HN))  8.720
OBSE (resid 44 and (name HN))  7.500
OBSE (resid 45 and (name HN))  7.810
OBSE (resid 46 and (name HN))  8.180
OBSE (resid 48 and (name HN))  8.940
OBSE (resid 49 and (name HN))  8.840
OBSE (resid 50 and (name HN))  8.490
OBSE (resid 51 and (name HN))  7.770
OBSE (resid 52 and (name HN))  9.540
OBSE (resid 53 and (name HN))  9.280
OBSE (resid 54 and (name HN))  8.400
OBSE (resid 55 and (name HN))  8.640
OBSE (resid 56 and (name HN))  8.900
OBSE (resid 61 and (name HN))  6.990
OBSE (resid 62 and (name HN))  7.930
OBSE (resid 63 and (name HN))  7.210
OBSE (resid 69 and (name HN))  8.350
OBSE (resid 70 and (name HN))  8.180
OBSE (resid 71 and (name HN))  8.900
OBSE (resid 72 and (name HN))  8.660
OBSE (resid 73 and (name HN))  8.580
OBSE (resid 74 and (name HN))  8.960
OBSE (resid 75 and (name HN))  9.680
OBSE (resid 76 and (name HN))  8.570
OBSE (resid 79 and (name HN))  6.750
OBSE (resid 80 and (name HN))  7.930
OBSE (resid 81 and (name HN))  8.920
OBSE (resid 82 and (name HN))  8.700
OBSE (resid 84 and (name HN))  8.930
OBSE (resid 86 and (name HN))  7.730
OBSE (resid 87 and (name HN))  9.770
OBSE (resid 88 and (name HN))  9.020
OBSE (resid 89 and (name HN))  9.550
OBSE (resid 90 and (name HN))  9.460
OBSE (resid 91 and (name HN))  8.090
OBSE (resid 92 and (name HN))  8.330
OBSE (resid 93 and (name HN))  7.290
OBSE (resid 94 and (name HN))  5.940
OBSE (resid 95 and (name HN))  7.370
OBSE (resid 96 and (name HN))  8.800
OBSE (resid 97 and (name HN))  9.850
OBSE (resid 98 and (name HN))  9.600
OBSE (resid 99 and (name HN))  9.340
OBSE (resid 100 and (name HN))  8.420
OBSE (resid 101 and (name HN))  7.560
OBSE (resid 102 and (name HN))  7.770
OBSE (resid 103 and (name HN))  7.650
OBSE (resid 104 and (name HN))  7.550
OBSE (resid 105 and (name HN))  7.790
OBSE (resid 106 and (name HN))  8.790
OBSE (resid 107 and (name HN))  8.820
OBSE (resid 108 and (name HN))  8.660
OBSE (resid 110 and (name HN))  8.780
!single methyl
OBSE (resid 4 and (name HD1#))  0.430
OBSE (resid 4 and (name HG2#))  0.820
OBSE (resid 6 and (name HG2#))  1.160
OBSE (resid 11 and (name HB#))  1.570
OBSE (resid 16 and (name HG2#))  0.460
OBSE (resid 25 and (name HD1#))  0.420
OBSE (resid 25 and (name HG2#))  0.820
OBSE (resid 26 and (name HG2#))  1.140
OBSE (resid 30 and (name HB#))  1.260
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#)) -0.090
OBSE (resid 51 and (name HG2#))  0.490
OBSE (resid 55 and (name HD1#))  0.860
OBSE (resid 55 and (name HG2#))  0.820
OBSE (resid 70 and (name HG2#))  0.910
OBSE (resid 74 and (name HB#))  0.740
OBSE (resid 76 and (name HD1#))  0.000
OBSE (resid 76 and (name HG2#)) -0.790
OBSE (resid 79 and (name HG2#))  0.670
OBSE (resid 88 and (name HD1#))  0.820
OBSE (resid 88 and (name HG2#))  0.970
OBSE (resid 96 and (name HD1#))  1.200
OBSE (resid 96 and (name HG2#))  0.970
OBSE (resid 99 and (name HG2#))  0.720
OBSE (resid 100 and (name HG2#))  1.180
OBSE (resid 105 and (name HG2#))  1.080
OBSE (resid 107 and (name HG2#))  1.120
OBSE (resid 109 and (name HD1#))  0.620
OBSE (resid 109 and (name HG2#))  0.510
!other
OBSE (resid 3 and (name HB))  2.100
OBSE (resid 4 and (name HB))  1.610
OBSE (resid 10 and (name HB))  2.450
OBSE (resid 14 and (name HG))  1.550
OBSE (resid 16 and (name HB))  3.470
OBSE (resid 25 and (name HB))  1.680
OBSE (resid 33 and (name HG))  1.580
OBSE (resid 36 and (name HB))  2.160
OBSE (resid 45 and (name HB))  2.120
OBSE (resid 51 and (name HB))  1.550
OBSE (resid 55 and (name HB))  2.010
OBSE (resid 63 and (name HG)) -0.220
OBSE (resid 88 and (name HB))  1.890
OBSE (resid 89 and (name HG))  1.520
OBSE (resid 95 and (name HG))  1.640
OBSE (resid 96 and (name HB))  2.130
OBSE (resid 107 and (name HB))  4.450


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