NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id cing stage position type
10786 1qby cing 1-original 1 comment 

REMARKS Name: Zhijun Li
REMARKS E-mail Address: liz@ctrvax.vanderbilt.edu
REMARKS AutoDep ID number: 
REMARKS FILENAME="topallhdg5.dna"
remark   geometric energy function topology for distance geometry and
remark   simulated annealing.
remark 
remark   history:
remark
remark   The first version of this file is the fault of MP and LN remark   (1984).
remark   CHARGES DERIVED FROM toprna10/ 
remark   H charges set to 0.035 and slack taken on C
remark   SOME HINTS TAKEN FROM GELIN AND ROSSKY KARPLUS RAHMAN PAPER.
remark   GROUPING REMOVED. (ONE GROUP/RESIDUE PUT BACK).
remark   H-BOND CHARGES FOR R_DIEL & EPS=1.0
remark   REDUCED PHOSPHATE CHARGES. CH-stretches and bends from
remark   uracil normal mode fit. 
remark   Sugar dihedrals adapted from W.Olson JACS (1982)
remark   planarity of hydrogens on bases is now maintained by impropers
remark    instead of dihedrals, and all impropers governing the planes
remark    have their force constants increased to 80 (G.M. CLORE
remark    16/5/85)
set echo=false end

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