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
623089 5oe1 34159 cing 1-original 8 unknown unknown


%FLAG BOND_FORCE_CONSTANT                                                       
%FORMAT(5E16.8)                                                                 
  2.30000000E+02  3.40000000E+02  3.40000000E+02  3.10000000E+02  3.20000000E+02
  5.70000000E+02  4.57000000E+02  4.34000000E+02  4.81000000E+02  4.83000000E+02
  3.67000000E+02  4.27000000E+02  3.67000000E+02  5.49000000E+02  4.48000000E+02
  4.24000000E+02  3.40000000E+02  3.37000000E+02  3.10000000E+02  3.20000000E+02
  3.40000000E+02  3.40000000E+02  3.10000000E+02  3.20000000E+02  5.53000000E+02
  4.61000000E+02  4.34000000E+02  4.27000000E+02  4.18000000E+02  4.47000000E+02
  5.20000000E+02  4.14000000E+02  3.67000000E+02  5.29000000E+02  4.40000000E+02
  4.36000000E+02  3.20000000E+02  5.25000000E+02  3.67000000E+02  5.02000000E+02
  4.69000000E+02  3.67000000E+02  5.29000000E+02  4.40000000E+02  3.17000000E+02
  4.10000000E+02  3.67000000E+02  5.49000000E+02  4.48000000E+02  3.20000000E+02
  3.52000000E+02  4.41100000E+02  5.25400000E+02  3.30600000E+02  3.27700000E+02
  4.25800000E+02  3.52000000E+02  5.00900000E+02  6.37700000E+02  3.13000000E+02
  3.30600000E+02  3.49100000E+02  3.00900000E+02  3.71000000E+02  4.19800000E+02
  3.71000000E+02  4.25100000E+02  4.27600000E+02  4.03200000E+02  4.25800000E+02
  3.28700000E+02  5.25400000E+02  4.41100000E+02  3.38700000E+02  2.83300000E+02
  3.73200000E+02  5.53000000E+02  5.53000000E+02
%FLAG BOND_EQUIL_VALUE                                                          
%FORMAT(5E16.8)                                                                 
  1.61000000E+00  1.09000000E+00  1.09000000E+00  1.52600000E+00  1.41000000E+00
  1.22900000E+00  1.35800000E+00  1.01000000E+00  1.34000000E+00  1.33900000E+00
  1.08000000E+00  1.43300000E+00  1.08000000E+00  1.35000000E+00  1.36500000E+00
  1.38300000E+00  1.09000000E+00  1.47500000E+00  1.52600000E+00  1.41000000E+00
  1.09000000E+00  1.09000000E+00  1.52600000E+00  1.41000000E+00  9.60000000E-01
  1.35400000E+00  1.01000000E+00  1.38100000E+00  1.38800000E+00  1.41900000E+00
  1.37000000E+00  1.39100000E+00  1.08000000E+00  1.30400000E+00  1.37100000E+00
  1.37400000E+00  1.41000000E+00  1.48000000E+00  1.08000000E+00  1.32400000E+00
  1.40400000E+00  1.08000000E+00  1.30400000E+00  1.37100000E+00  1.51000000E+00
  1.44400000E+00  1.08000000E+00  1.35000000E+00  1.36500000E+00  1.41000000E+00
  1.08170000E+00  1.36940000E+00  1.31720000E+00  1.09690000E+00  1.46290000E+00
  1.38020000E+00  1.08170000E+00  1.37290000E+00  1.21830000E+00  1.52410000E+00
  1.09690000E+00  1.08370000E+00  1.53750000E+00  1.46760000E+00  1.42780000E+00
  1.46760000E+00  1.38070000E+00  1.37890000E+00  1.01290000E+00  1.38020000E+00
  1.46190000E+00  1.31720000E+00  1.36940000E+00  1.09100000E+00  1.51100000E+00
  1.03040000E+00  9.57200000E-01  1.51360000E+00
%FLAG ANGLE_FORCE_CONSTANT                                                      
%FORMAT(5E16.8)                                                                 
  1.00000000E+02  4.50000000E+01  3.50000000E+01  5.00000000E+01  5.00000000E+01
  5.00000000E+01  5.00000000E+01  1.00000000E+02  8.00000000E+01  3.50000000E+01
  7.00000000E+01  5.00000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01
  7.00000000E+01  5.00000000E+01  7.00000000E+01  5.00000000E+01  6.30000000E+01
  5.00000000E+01  5.00000000E+01  7.00000000E+01  7.00000000E+01  8.00000000E+01
  5.00000000E+01  5.00000000E+01  7.00000000E+01  7.00000000E+01  4.00000000E+01
  5.00000000E+01  5.00000000E+01  5.00000000E+01  5.00000000E+01  5.00000000E+01
  5.00000000E+01  5.00000000E+01  6.00000000E+01  4.00000000E+01  5.00000000E+01
  3.50000000E+01  5.00000000E+01  5.00000000E+01  4.00000000E+01  5.00000000E+01
  5.00000000E+01  5.50000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01
  7.00000000E+01  8.00000000E+01  6.30000000E+01  5.00000000E+01  7.00000000E+01
  8.00000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01
  5.00000000E+01  7.00000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01
  7.00000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01  5.00000000E+01
  5.00000000E+01  1.40000000E+02  1.00000000E+02  5.00000000E+01  7.00000000E+01
  7.00000000E+01  6.30000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01
  7.00000000E+01  5.00000000E+01  7.00000000E+01  7.00000000E+01  5.00000000E+01
  7.00000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01  5.00000000E+01
  8.00000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01  7.00000000E+01
  6.30000000E+01  5.00000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01
  5.00000000E+01  5.00000000E+01  5.50000000E+01  3.92400000E+01  4.99700000E+01
  7.17600000E+01  6.18800000E+01  7.34300000E+01  4.98300000E+01  7.49000000E+01
  4.97900000E+01  4.72700000E+01  6.84800000E+01  7.21700000E+01  4.72700000E+01
  3.92200000E+01  3.94000000E+01  4.83300000E+01  4.69300000E+01  4.63900000E+01
  6.74000000E+01  4.58000000E+01  4.63400000E+01  6.28600000E+01  6.86950000E+01
  6.76200000E+01  4.85400000E+01  6.18800000E+01  6.84800000E+01  6.81500000E+01
  6.46800000E+01  4.79200000E+01  4.71500000E+01  6.50900000E+01  6.33900000E+01
  6.32700000E+01  6.89400000E+01  6.79600000E+01  6.90700000E+01  7.17600000E+01
  7.34300000E+01  4.97900000E+01  6.86950000E+01  6.90700000E+01  6.59100000E+01
  4.98400000E+01  6.67900000E+01  6.76200000E+01  6.93400000E+01  7.21700000E+01
  7.42200000E+01  6.91400000E+01  7.49000000E+01  6.91400000E+01  4.58500000E+01
  6.26200000E+01  4.86500000E+01  6.41800000E+01  4.62000000E+01
%FLAG ANGLE_EQUIL_VALUE                                                         
%FORMAT(5E16.8)                                                                 
  1.88897066E+00  1.79070858E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  2.10312265E+00  2.13802925E+00  2.09439600E+00
  2.08217869E+00  2.09439600E+00  2.10312265E+00  2.15199189E+00  2.09614133E+00
  2.12057595E+00  2.08916001E+00  2.12232128E+00  2.08916001E+00  2.04203610E+00
  1.91113635E+00  2.07868803E+00  2.11533996E+00  2.06996138E+00  2.11010397E+00
  1.91113635E+00  1.91113635E+00  2.11533996E+00  2.05250808E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.89368305E+00  1.95826026E+00  2.05948940E+00  2.02458280E+00
  2.15199189E+00  2.10486798E+00  2.08043336E+00  2.03854544E+00  2.18515316E+00
  2.24798504E+00  1.94255229E+00  2.22878641E+00  2.26892900E+00  1.92684432E+00
  2.14762857E+00  1.83957782E+00  1.81165254E+00  2.14762857E+00  1.98793087E+00
  1.85354046E+00  2.20260646E+00  2.24798504E+00  2.19562514E+00  1.91113635E+00
  1.91113635E+00  2.09265067E+00  2.10312265E+00  2.01498349E+00  1.93731630E+00
  2.25322103E+00  2.04727209E+00  2.06996138E+00  2.15548255E+00  2.04727209E+00
  2.31081692E+00  2.14762857E+00  1.83957782E+00  1.81165254E+00  2.14762857E+00
  1.98793087E+00  2.24798504E+00  2.20609712E+00  2.08916001E+00  1.91113635E+00
  2.18689849E+00  1.99142153E+00  2.08916001E+00  2.12232128E+00  2.08916001E+00
  2.10661331E+00  2.07868803E+00  2.11533996E+00  2.01411082E+00  2.11533996E+00
  1.91113635E+00  1.91113635E+00  1.89368305E+00  1.89298492E+00  2.11429276E+00
  1.84114862E+00  2.20714432E+00  1.86732857E+00  1.89856997E+00  1.95860933E+00
  2.10364625E+00  2.24239998E+00  1.91811767E+00  1.94866095E+00  2.24239998E+00
  1.91549968E+00  1.87762601E+00  2.05163542E+00  1.89839544E+00  1.91218355E+00
  2.15024656E+00  2.05390434E+00  1.91637234E+00  1.94621748E+00  1.98679641E+00
  2.12720820E+00  2.12511381E+00  2.20714432E+00  1.91811767E+00  1.99299233E+00
  2.15146829E+00  2.08148056E+00  2.11307103E+00  2.11795796E+00  2.10643878E+00
  1.93801443E+00  2.11760889E+00  2.09247614E+00  1.96698691E+00  1.84114862E+00
  1.86732857E+00  2.10364625E+00  1.98679641E+00  1.96698691E+00  1.94796281E+00
  1.90031530E+00  2.01027109E+00  2.12720820E+00  2.20313006E+00  1.94866095E+00
  2.14762857E+00  2.16298747E+00  1.95860933E+00  2.16298747E+00  1.92178286E+00
  1.91392888E+00  1.88513093E+00  1.99334139E+00  1.92963685E+00
%FLAG DIHEDRAL_FORCE_CONSTANT                                                   
%FORMAT(5E16.8)                                                                 
  1.85181000E-01  1.25653100E+00  3.54858000E-01  1.55555556E-01  1.07993300E+00
  3.19017000E-01  5.48360000E-02  3.83333333E-01  2.50000000E-01  3.21859000E-01
  5.44600000E-01  7.97144000E-01  0.00000000E+00  2.40000000E+00  4.80000000E+00
  4.00000000E+00  2.55000000E+00  1.85000000E+00  6.65000000E+00  1.45000000E+00
  1.00000000E-01  3.83300000E-01  1.20000000E+00  1.17500000E+00  1.44000000E-01
  1.03000000E+00  1.52000000E+00  2.60000000E-01  2.50000000E-01  0.00000000E+00
  6.50000000E-01  3.83000000E-01  1.20000000E+00  9.00000000E-01  1.60000000E-01
  1.17804000E+00  9.21020000E-02  9.62830000E-01  1.66666667E-01  1.50000000E+00
  3.00000000E+00  1.35000000E+00  5.45000000E+00  4.15000000E+00  1.70000000E+00
  1.00000000E+01  1.65000000E+00  8.10000000E-01  1.73000000E+00  4.40000000E-01
  6.80000000E+00  3.50000000E+00  9.10000000E-01  1.91000000E+00  4.10000000E-01
  2.17500000E+00  1.15000000E+00  3.80000000E-01  3.00000000E-01  9.90000000E-01
  1.67000000E+00  1.70000000E-01  4.75000000E+00  1.50000000E-01  2.50000000E+00
  2.00000000E+00  8.00000000E-01  8.00000000E-02  5.30000000E-01  1.50000000E-01
  5.00000000E-01  0.00000000E+00  2.87500000E+00  7.00000000E-02  1.00000000E-01
  1.50000000E+00  1.05000000E+01  1.00000000E+00  1.10000000E+00
%FLAG DIHEDRAL_PERIODICITY                                                      
%FORMAT(5E16.8)                                                                 
  1.00000000E+00  2.00000000E+00  3.00000000E+00  3.00000000E+00  1.00000000E+00
  2.00000000E+00  3.00000000E+00  3.00000000E+00  3.00000000E+00  1.00000000E+00
  2.00000000E+00  3.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  3.00000000E+00  1.00000000E+00  2.00000000E+00  3.00000000E+00
  1.00000000E+00  2.00000000E+00  3.00000000E+00  1.00000000E+00  3.00000000E+00
  2.00000000E+00  3.00000000E+00  1.00000000E+00  3.00000000E+00  3.00000000E+00
  1.00000000E+00  2.00000000E+00  3.00000000E+00  3.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  1.00000000E+00  2.00000000E+00  3.00000000E+00
  2.00000000E+00  2.00000000E+00  1.00000000E+00  2.00000000E+00  3.00000000E+00
  2.00000000E+00  1.00000000E+00  3.00000000E+00  3.00000000E+00  1.00000000E+00
  2.00000000E+00  3.00000000E+00  2.00000000E+00  3.00000000E+00  2.00000000E+00
  1.00000000E+00  1.00000000E+00  3.00000000E+00  1.00000000E+00  3.00000000E+00
  4.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  4.00000000E+00
  1.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
%FLAG DIHEDRAL_PHASE                                                            
%FORMAT(5E16.8)                                                                 
  5.54929070E-01  6.14285649E+00  6.23514744E+00  0.00000000E+00  5.19698240E+00
  3.50131437E+00  2.64638419E+00  0.00000000E+00  0.00000000E+00  1.15045137E+00
  9.53800156E-02  5.15662653E+00  0.00000000E+00  3.14159400E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00
  3.14159400E+00  0.00000000E+00  5.62711845E+00  0.00000000E+00  0.00000000E+00
  3.22536984E+00  1.36135740E-01  3.65821168E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  6.71079385E-01 -3.89208590E-02  0.00000000E+00
  3.33317067E+00  5.15976777E+00  6.07541257E+00  0.00000000E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00  1.52716375E+00  6.98132000E-02  3.83623534E+00
  3.14159400E+00  3.14159400E+00  2.09614133E+00  1.22173100E-02  3.93397382E+00
  3.14159400E+00  0.00000000E+00  3.14159400E+00  0.00000000E+00  3.28122040E+00
  8.20305100E-02  3.68090097E+00  3.14159400E+00  0.00000000E+00  3.14159400E+00
  0.00000000E+00  0.00000000E+00  3.14159400E+00  0.00000000E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00  3.14159400E+00  0.00000000E+00  0.00000000E+00
  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00
%FLAG SCEE_SCALE_FACTOR                                                         
%FORMAT(5E16.8)                                                                 
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
%FLAG SCNB_SCALE_FACTOR                                                         
%FORMAT(5E16.8)                                                                 
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
%FLAG SOLTY                                                                     
%FORMAT(5E16.8)                                                                 
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
%FLAG LENNARD_JONES_ACOEF                                                       
%FORMAT(5E16.8)                                                                 
  0.00000000E+00  0.00000000E+00  5.81803229E+05  0.00000000E+00  7.91544157E+05
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%FLAG LENNARD_JONES_BCOEF                                                       
%FORMAT(5E16.8)                                                                 
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  1.31591746E+01  1.26451907E+02  1.04660679E+02  1.66953734E+01  1.85196588E+01
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  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00


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