protgeo_eh99.dat (V1.16) 20131014 STANDARD AMINO ACID DICTIONARY. BONDS AND ANGLES FROM ENGH AND HUBER EH99. OTHER VALUES BASED ON PREVIOUS TNT OR TAKEN FROM CCP4. INCLUDES HYDROGEN ATOMS.
exoticaa.dat (V1.14) 20120418 COLLECTION OF NON-STANDARD AMINO ACIDS, MAINLY EH91 WITHOUT IDEAL DISTANCE INFO
nuclgeo.dat (V1.27) 20120611
bcorrel.dat (V1.15) 20080423
contact.dat (V1.23) 20121002
idealdist_contact.dat (V1.11) 20121011 IDEAL-DISTANCE CONTACT TERM DATA AS USED IN PROLSQ. VALUES USED HERE ARE BASED ON THE REFMAC 5.5 IMPLEMENTATION.
restraints for 468 (_3S_-N-_3-CHLORO-2-METHYLPHENYL_-1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-CARBOXAMIDE) from cif dictionary 468.grade_PDB_ligand.cif; generated by GRADE_PDB_LIGAND 1.2.9pre (June 16 2014) using MOGUL 1.6.1(DEV7), CSD as535be, with quantum mechanics RM1 ((DatabaseID PDB-468))
restraints for NAD (NICOTINAMIDE-ADENINE-DINUCLEOTIDE) from cif dictionary NAD.cif; buster common-compounds v 3.0, Generated by GRADE_PDB_LIGAND 1.2.9pre (June 16 2014) using MOGUL 1.6.1(DEV7), CSD as535be, with quantum mechanics RM1 ((DatabaseID PDB-NAD))