NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
574092 2mjb cing 1-original 8 XPLOR/CNS dipolar coupling


assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     1 and name   CA)
       ( resid     1 and name   HA) -16.4200  0.0000  0.0000
! M1-ch1 val=-16.4200 values=-16.420000

! M1-ch3 val=-21.6620 values=21.662001

! M1-ch2 val=-10.5075 values=-10.184000 -10.831000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     2 and name   CA)
       ( resid     2 and name   HA)  7.6090  0.0000  0.0000
! Q2-ch1 val=7.6090 values=7.609000

! Q2-ch2 val=-14.9200 values=-14.920000

! Q2-ch2 val=-7.9600 values=-7.960000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     3 and name   CA)
       ( resid     3 and name   HA) 12.1850  0.0000  0.0000
! I3-ch1 val=12.1850 values=12.185000

! I3-ch3 val=-1.8480 values=1.848000

! I3-ch3 val=-14.2890 values=14.289000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     4 and name   CA)
       ( resid     4 and name   HA) 26.2980  0.0000  0.0000
! F4-ch1 val=26.2980 values=26.298000

! F4-ch2 val=8.2700 values=7.212000 9.328000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     5 and name   CA)
       ( resid     5 and name   HA) 23.6130  0.0000  0.0000
! V5-ch1 val=23.6130 values=23.613001

! V5-ch3 val=-29.1260 values=29.125999

! V5-ch3 val=-4.4770 values=4.477000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     6 and name   CA)
       ( resid     6 and name   HA) 17.9660  0.0000  0.0000
! K6-ch1 val=17.9660 values=17.966000

! K6-ch2 val=-12.5715 values=-12.539000 -12.604000

! K6-ch2 val=-13.2940 values=-13.294000

! K6-ch2 val=-13.4215 values=-13.433000 -13.410000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     7 and name   CA)
       ( resid     7 and name   HA) 16.8620  0.0000  0.0000
! T7-ch1 val=16.8620 values=16.862000

! T7-ch1 val=-27.8780 values=-27.878000

! T7-ch3 val=-1.1490 values=1.149000

! L8-ch2 val=10.5070 values=10.315000 10.699000

! L8-ch3 val=-7.1750 values=7.175000

! L8-ch3 val=4.7540 values=-4.754000

! L8-ch1 val=-5.1250 values=-5.125000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid     9 and name   CA)
       ( resid     9 and name   HA) -11.4530  0.0000  0.0000
! T9-ch1 val=-11.4530 values=-11.453000

! T9-ch1 val=14.0740 values=14.074000

! T9-ch3 val=-17.8540 values=17.854000
{
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    10 and name   CA)
       ( resid    10 and name  HA#) 25.4175  0.0000  0.0000
! G10-ch2 val=25.4175 values=25.452999 25.382000
}
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    11 and name   CA)
       ( resid    11 and name   HA)  9.0170  0.0000  0.0000
! K11-ch1 val=9.0170 values=9.017000

! K11-ch2 val=-13.5035 values=-13.270000 -13.737000

! K11-ch2 val=-9.0460 values=-9.046000

! K11-ch2 val=-8.0310 values=-8.407000 -7.655000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    12 and name   CA)
       ( resid    12 and name   HA) 11.3000  0.0000  0.0000
! T12-ch1 val=11.3000 values=11.300000

! T12-ch1 val=10.7700 values=10.770000

! T12-ch3 val=-14.2100 values=14.210000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    13 and name   CA)
       ( resid    13 and name   HA) 18.3460  0.0000  0.0000
! I13-ch1 val=18.3460 values=18.346001

! I13-ch1 val=15.2810 values=15.281000

! I13-ch3 val=-0.8110 values=0.811000

! I13-ch3 val=4.2910 values=-4.291000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    14 and name   CA)
       ( resid    14 and name   HA) 24.7330  0.0000  0.0000
! T14-ch1 val=24.7330 values=24.733000

! T14-ch1 val=14.8510 values=14.851000

! T14-ch3 val=-20.9350 values=20.934999

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    15 and name   CA)
       ( resid    15 and name   HA) 22.8980  0.0000  0.0000
! L15-ch1 val=22.8980 values=22.898001

! L15-ch2 val=31.8975 values=31.964001 31.830999

! L15-ch3 val=11.5980 values=-11.598000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    16 and name   CA)
       ( resid    16 and name   HA)  8.3010  0.0000  0.0000
! E16-ch1 val=8.3010 values=8.301000

! E16-ch2 val=6.3575 values=6.499000 6.216000

! E16-ch2 val=18.2715 values=18.537001 18.006001

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    17 and name   CA)
       ( resid    17 and name   HA) 17.9190  0.0000  0.0000
! V17-ch1 val=17.9190 values=17.919001

! V17-ch3 val=-28.5110 values=28.511000

! V17-ch3 val=17.2740 values=-17.274000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    18 and name   CA)
       ( resid    18 and name   HA) -14.9170  0.0000  0.0000
! E18-ch1 val=-14.9170 values=-14.917000

! E18-ch2 val=-25.0837 values=-24.329000 -24.112000 -25.327999 -26.566000

! E18-ch2 val=6.7505 values=6.908000 6.593000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    19 and name   CA)
       ( resid    19 and name   HA) -6.8720  0.0000  0.0000
! P19-ch1 val=-6.8720 values=-6.872000

! P19-ch2 val=21.5830 values=21.684999 21.481001

! P19-ch2 val=-18.8950 values=-18.895000

! S20-ch2 val=-7.3207 values=-7.429000 -7.258000 -7.275000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    21 and name   CA)
       ( resid    21 and name   HA) 24.8860  0.0000  0.0000
! D21-ch1 val=24.8860 values=24.886000

! D21-ch2 val=-21.1605 values=-21.020000 -21.301001

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    22 and name   CA)
       ( resid    22 and name   HA) 20.3720  0.0000  0.0000
! T22-ch1 val=20.3720 values=20.372000

! T22-ch1 val=-17.7980 values=-17.798000

! T22-ch3 val=-2.9040 values=2.904000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    23 and name   CA)
       ( resid    23 and name   HA)  6.7800  0.0000  0.0000
! I23-ch1 val=6.7800 values=6.780000

! I23-ch1 val=10.3140 values=10.314000

! I23-ch3 val=4.7740 values=-4.774000

! I23-ch2 val=-0.8130 values=-1.081000 -0.545000

! I23-ch3 val=-22.0290 values=22.028999

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    24 and name   CA)
       ( resid    24 and name   HA) -28.1920  0.0000  0.0000
! E24-ch1 val=-28.1920 values=-28.191999

! E24-ch2 val=-12.1300 values=-12.130000

! E24-ch2 val=-5.0340 values=-5.310000 -4.758000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    25 and name   CA)
       ( resid    25 and name   HA) 15.1620  0.0000  0.0000
! N25-ch1 val=15.1620 values=15.162000

! N25-ch2 val=22.4175 values=22.490000 22.344999

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    26 and name   CA)
       ( resid    26 and name   HA) -5.2050  0.0000  0.0000
! V26-ch1 val=-5.2050 values=-5.205000

! V26-ch1 val=-2.7790 values=-2.779000

! V26-ch3 val=13.3600 values=-13.360000

! V26-ch3 val=-34.5910 values=34.591000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    27 and name   CA)
       ( resid    27 and name   HA) 15.6350  0.0000  0.0000
! K27-ch1 val=15.6350 values=15.635000

! K27-ch2 val=-12.9125 values=-12.153000 -13.672000

! K27-ch2 val=-10.5870 values=-10.587000

! K27-ch2 val=28.4600 values=28.212000 28.708000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    28 and name   CA)
       ( resid    28 and name   HA) -36.4040  0.0000  0.0000
! A28-ch1 val=-36.4040 values=-36.403999

! A28-ch3 val=3.0000 values=-3.000000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    29 and name   CA)
       ( resid    29 and name   HA) 23.0280  0.0000  0.0000
! K29-ch1 val=23.0280 values=23.028000

! K29-ch2 val=26.3010 values=26.301001

! K29-ch2 val=14.6780 values=14.678000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    30 and name   CA)
       ( resid    30 and name   HA)  5.2260  0.0000  0.0000
! I30-ch1 val=5.2260 values=5.226000

! I30-ch1 val=11.7760 values=11.776000

! I30-ch3 val=18.2170 values=-18.216999

! I30-ch2 val=-5.8790 values=-5.879000

! I30-ch3 val=-18.7680 values=18.768000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    31 and name   CA)
       ( resid    31 and name   HA) -22.9430  0.0000  0.0000
! Q31-ch1 val=-22.9430 values=-22.943001

! Q31-ch2 val=-9.8110 values=-9.811000

! Q31-ch2 val=-7.6600 values=-7.701000 -7.619000

! D32-ch2 val=18.8520 values=18.851999

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    33 and name   CA)
       ( resid    33 and name   HA) 14.5000  0.0000  0.0000
! K33-ch1 val=14.5000 values=14.500000

! K33-ch2 val=20.8190 values=20.757000 20.881001

! K33-ch2 val=17.0990 values=17.099001

! K33-ch2 val=13.6080 values=13.608000

! K33-ch2 val=22.1710 values=22.171000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    34 and name   CA)
       ( resid    34 and name   HA) 16.4780  0.0000  0.0000
! E34-ch1 val=16.4780 values=16.478001

! E34-ch2 val=-17.1470 values=-17.964001 -16.330000

! E34-ch2 val=8.7730 values=8.773000
{
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    35 and name   CA)
       ( resid    35 and name  HA#) 16.1235  0.0000  0.0000
! G35-ch2 val=16.1235 values=16.230000 16.017000
}
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    36 and name   CA)
       ( resid    36 and name   HA) -37.9860  0.0000  0.0000
! I36-ch1 val=-37.9860 values=-37.986000

! I36-ch1 val=-33.2470 values=-33.247002

! I36-ch3 val=-4.6110 values=4.611000

! I36-ch3 val=-0.7670 values=0.767000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    37 and name   CA)
       ( resid    37 and name   HA) -3.4290  0.0000  0.0000
! P37-ch1 val=-3.4290 values=-3.429000

! P37-ch2 val=31.2950 values=31.368999 31.221001

! P37-ch2 val=-13.3880 values=-13.388000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    38 and name   CA)
       ( resid    38 and name   HA)  3.8040  0.0000  0.0000
! P38-ch1 val=3.8040 values=3.804000

! P38-ch2 val=8.2410 values=8.241000

! P38-ch2 val=-3.8770 values=-3.877000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    39 and name   CA)
       ( resid    39 and name   HA)  5.4760  0.0000  0.0000
! D39-ch1 val=5.4760 values=5.476000

! D39-ch2 val=4.5755 values=4.530000 4.621000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    40 and name   CA)
       ( resid    40 and name   HA) -11.6040  0.0000  0.0000
! Q40-ch1 val=-11.6040 values=-11.604000

! Q40-ch2 val=5.9250 values=5.925000

! Q40-ch2 val=12.3350 values=12.335000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    41 and name   CA)
       ( resid    41 and name   HA) 11.7480  0.0000  0.0000
! Q41-ch1 val=11.7480 values=11.748000

! Q41-ch2 val=5.8290 values=5.829000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    42 and name   CA)
       ( resid    42 and name   HA) 12.5700  0.0000  0.0000
! R42-ch1 val=12.5700 values=12.570000

! R42-ch2 val=11.0390 values=11.007000 11.071000

! R42-ch2 val=5.5520 values=5.552000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    43 and name   CA)
       ( resid    43 and name   HA) 14.8130  0.0000  0.0000
! L43-ch1 val=14.8130 values=14.813000

! L43-ch2 val=-4.1140 values=-4.114000

! L43-ch3 val=-9.8150 values=9.815000

! L43-ch3 val=9.5000 values=-9.500000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    44 and name   CA)
       ( resid    44 and name   HA) 16.8520  0.0000  0.0000
! I44-ch1 val=16.8520 values=16.851999

! I44-ch1 val=15.4970 values=15.497000

! I44-ch3 val=-5.4430 values=5.443000

! I44-ch2 val=30.8570 values=30.857000

! I44-ch3 val=20.0240 values=-20.024000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    45 and name   CA)
       ( resid    45 and name   HA) 17.0260  0.0000  0.0000
! F45-ch1 val=17.0260 values=17.025999

! F45-ch2 val=40.9320 values=41.067001 41.382000 40.347000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    46 and name   CA)
       ( resid    46 and name   HA) 16.8020  0.0000  0.0000
! A46-ch1 val=16.8020 values=16.802000

! A46-ch3 val=-28.5610 values=28.561001
{
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    47 and name   CA)
       ( resid    47 and name  HA#)  7.6990  0.0000  0.0000
! G47-ch2 val=7.6990 values=7.826000 7.572000
}
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    48 and name   CA)
       ( resid    48 and name   HA) -14.5340  0.0000  0.0000
! K48-ch1 val=-14.5340 values=-14.534000

! K48-ch2 val=8.5390 values=8.539000

! K48-ch2 val=3.5910 values=3.591000

! K48-ch2 val=0.8070 values=0.807000

! K48-ch2 val=0.4770 values=0.477000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    49 and name   CA)
       ( resid    49 and name   HA) 17.0350  0.0000  0.0000
! Q49-ch1 val=17.0350 values=17.035000

! Q49-ch2 val=25.0790 values=25.079000

! Q49-ch2 val=12.7450 values=12.745000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    50 and name   CA)
       ( resid    50 and name   HA)  2.1020  0.0000  0.0000
! L50-ch1 val=2.1020 values=2.102000

! L50-ch2 val=-5.7340 values=-5.706000 -5.762000

! L50-ch3 val=0.5800 values=-0.580000

! L50-ch3 val=3.3880 values=-3.388000

! L50-ch1 val=-14.1220 values=-14.122000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    51 and name   CA)
       ( resid    51 and name   HA) -36.6040  0.0000  0.0000
! E51-ch1 val=-36.6040 values=-36.604000

! E51-ch2 val=-19.3470 values=-19.429001 -19.264999

! E51-ch2 val=-0.2000 values=-0.200000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    52 and name   CA)
       ( resid    52 and name   HA)  4.6550  0.0000  0.0000
! D52-ch1 val=4.6550 values=4.655000

! D52-ch2 val=17.7295 values=17.011999 18.447001
{
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    53 and name   CA)
       ( resid    53 and name  HA#) 29.1760  0.0000  0.0000
! G53-ch2 val=29.1760 values=28.709999 29.642000
}
assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    54 and name   CA)
       ( resid    54 and name   HA) -3.0650  0.0000  0.0000
! R54-ch1 val=-3.0650 values=-3.065000

! R54-ch2 val=-6.1905 values=-6.238000 -6.143000

! R54-ch2 val=-13.1280 values=-12.735000 -13.521000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    55 and name   CA)
       ( resid    55 and name   HA) 12.8990  0.0000  0.0000
! T55-ch1 val=12.8990 values=12.899000

! T55-ch1 val=2.5940 values=2.594000

! T55-ch3 val=19.1080 values=-19.108000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    56 and name   CA)
       ( resid    56 and name   HA) -20.8260  0.0000  0.0000
! L56-ch1 val=-20.8260 values=-20.826000

! L56-ch2 val=-4.7250 values=-4.617000 -4.833000

! L56-ch3 val=-14.2760 values=14.276000

! L56-ch1 val=15.1140 values=15.114000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    57 and name   CA)
       ( resid    57 and name   HA)  8.9290  0.0000  0.0000
! S57-ch1 val=8.9290 values=8.929000

! S57-ch2 val=12.4205 values=12.436000 12.405000

! D58-ch2 val=1.1525 values=1.382000 0.923000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    59 and name   CA)
       ( resid    59 and name   HA) 17.2540  0.0000  0.0000
! Y59-ch1 val=17.2540 values=17.254000

! Y59-ch2 val=37.2218 values=37.435001 39.445000 36.182999 35.824001

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    60 and name   CA)
       ( resid    60 and name   HA) -20.7590  0.0000  0.0000
! N60-ch1 val=-20.7590 values=-20.759001

! N60-ch2 val=-10.5545 values=-10.654000 -10.675000 -10.593000 -10.296000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    61 and name   CA)
       ( resid    61 and name   HA) 18.9480  0.0000  0.0000
! I61-ch1 val=18.9480 values=18.948000

! I61-ch1 val=17.5490 values=17.549000

! I61-ch3 val=-12.4080 values=12.408000

! I61-ch2 val=34.2115 values=34.332001 34.091000

! I61-ch3 val=15.8410 values=-15.841000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    62 and name   CA)
       ( resid    62 and name   HA)  5.4260  0.0000  0.0000
! Q62-ch1 val=5.4260 values=5.426000

! Q62-ch2 val=-20.8790 values=-20.681000 -21.077000

! Q62-ch2 val=-13.2400 values=-13.240000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    63 and name   CA)
       ( resid    63 and name   HA)  6.7040  0.0000  0.0000
! K63-ch1 val=6.7040 values=6.704000

! K63-ch2 val=26.4620 values=27.448999 25.475000

! K63-ch2 val=22.7930 values=22.792999

! K63-ch2 val=8.5250 values=8.525000

! K63-ch2 val=25.6110 values=25.611000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    64 and name   CA)
       ( resid    64 and name   HA)  6.7840  0.0000  0.0000
! E64-ch1 val=6.7840 values=6.784000

! E64-ch2 val=4.9580 values=5.114000 4.802000

! E64-ch2 val=-6.4820 values=-6.630000 -6.334000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    65 and name   CA)
       ( resid    65 and name   HA) 25.4700  0.0000  0.0000
! S65-ch1 val=25.4700 values=25.469999

! S65-ch2 val=-4.5680 values=-4.303000 -4.833000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    66 and name   CA)
       ( resid    66 and name   HA) 26.9410  0.0000  0.0000
! T66-ch1 val=26.9410 values=26.941000

! T66-ch1 val=24.3240 values=24.323999

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    67 and name   CA)
       ( resid    67 and name   HA) 23.7840  0.0000  0.0000
! L67-ch1 val=23.7840 values=23.784000

! L67-ch3 val=-6.8890 values=6.889000

! L67-ch3 val=16.0200 values=-16.020000

! L67-ch1 val=4.1930 values=4.193000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    68 and name   CA)
       ( resid    68 and name   HA) 17.0500  0.0000  0.0000
! H68-ch1 val=17.0500 values=17.049999

! H68-ch2 val=-19.4268 values=-19.275999 -20.186001 -18.929001 -19.316000

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    69 and name   CA)
       ( resid    69 and name   HA) 15.7550  0.0000  0.0000
! L69-ch1 val=15.7550 values=15.755000

! L69-ch3 val=2.6550 values=-2.655000

! L69-ch3 val=18.2170 values=-18.216999

assign ( resid   500 and name   OO)
       ( resid   500 and name    Z)
       ( resid   500 and name    X)
       ( resid   500 and name    Y)
       ( resid    70 and name   CA)
       ( resid    70 and name   HA) 13.8650  0.0000  0.0000
! V70-ch1 val=13.8650 values=13.865000

! V70-ch1 val=-10.1820 values=-10.182000

! V70-ch3 val=8.2060 values=-8.206000




Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Saturday, June 8, 2024 9:09:29 AM GMT (wattos1)