NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
7510 | 1kmr | 5277 | cing | 1-original | 1 | DISCOVER | distance | NOE | simple |
!BIOSYM restraint 1 ! b11_x1.rstrnt : ! Fulll set of NMR-derived restraints (unedited from b11_r results) for second annealing from extended structures ! second annealing from extended structures ! ! All distance spring consts = 10 kcal/(mol-angstrom^2) ! "Thus," a 1 kT rise corresponds to a 0.24 angstrom deviation ! three-level set of upper "bounds," plus 0.5 angstroms for pseudoatoms ! includes all possible chiral restraints ! ! All torsion spring consts = 50 "kcal/(mol-rad^2)," which is 0.0152 kcal/(mol-degree^2) ! "Thus," a 1 kT rise corresponds to a 6.22 degree deviation ! #distance ! ! HNi-HN1+1 1:ALA_A13:HN 1:LEU_A14:HN 1.7 5 10 10 1000 1:LEU_A14:HN 1:ILE_A15:HN 1.7 4 10 10 1000 1:ILE_A15:HN 1:LYS+_A16:HN 1.7 4 10 10 1000 1:LYS+_A16:HN 1:ARG+_A17:HN 1.7 4 10 10 1000 1:ILE_A18:HN 1:GLN_A19:HN 1.7 4 10 10 1000 1:GLN_A19:HN 1:ALA_A20:HN 1.7 4 10 10 1000 1:ALA_A20:HN 1:MET_A21:HN 1.7 4 10 10 1000 1:MET_A21:HN 1:ILE_A22:HN 1.7 4 10 10 1000 1:LYS+_A24:HN 1:GLYC_A25:HN 1.7 5 10 10 1000 ! ! HAi-HNi 1:ARG+_A12:HA 1:ARG+_A12:HN 1.7 5 10 10 1000 1:ALA_A13:HA 1:ALA_A13:HN 1.7 4 10 10 1000 1:LEU_A14:HA 1:LEU_A14:HN 1.7 4 10 10 1000 1:ILE_A15:HA 1:ILE_A15:HN 1.7 4 10 10 1000 1:LYS+_A16:HA 1:LYS+_A16:HN 1.7 4 10 10 1000 1:ARG+_A17:HA 1:ARG+_A17:HN 1.7 4 10 10 1000 1:ILE_A18:HA 1:ILE_A18:HN 1.7 4 10 10 1000 1:GLN_A19:HA 1:GLN_A19:HN 1.7 4 10 10 1000 1:ALA_A20:HA 1:ALA_A20:HN 1.7 4 10 10 1000 1:MET_A21:HA 1:MET_A21:HN 1.7 4 10 10 1000 1:ILE_A22:HA 1:ILE_A22:HN 1.7 4 10 10 1000 1:LYS+_A24:HA 1:LYS+_A24:HN 1.7 4 10 10 1000 1:GLYC_A25:X 1:GLYC_A25:HN 1.7 4 10 10 1000 ! ! HAi-HNi+1 1:CYHN_A11:HA 1:ARG+_A12:HN 1.7 5 10 10 1000 1:ARG+_A12:HA 1:ALA_A13:HN 1.7 4 10 10 1000 1:LEU_A14:HA 1:ILE_A15:HN 1.7 4 10 10 1000 1:ILE_A15:HA 1:LYS+_A16:HN 1.7 4 10 10 1000 1:LYS+_A16:HA 1:ARG+_A17:HN 1.7 4 10 10 1000 1:ARG+_A17:HA 1:ILE_A18:HN 1.7 4 10 10 1000 1:ILE_A18:HA 1:GLN_A19:HN 1.7 4 10 10 1000 1:GLN_A19:HA 1:ALA_A20:HN 1.7 4 10 10 1000 1:ALA_A20:HA 1:MET_A21:HN 1.7 4 10 10 1000 1:MET_A21:HA 1:ILE_A22:HN 1.7 4 10 10 1000 1:PRO_A23:HA 1:LYS+_A24:HN 1.7 3.2 10 10 1000 1:LYS+_A24:HA 1:GLYC_A25:HN 1.7 4 10 10 1000 ! ! HAi-HNi+3 1:ARG+_A12:HA 1:ILE_A15:HN 1.7 5 10 10 1000 1:ALA_A13:HA 1:LYS+_A16:HN 1.7 4 10 10 1000 1:LEU_A14:HA 1:ARG+_A17:HN 1.7 4 10 10 1000 1:ILE_A15:HA 1:ILE_A18:HN 1.7 4 10 10 1000 1:LYS+_A16:HA 1:GLN_A19:HN 1.7 4 10 10 1000 1:ARG+_A17:HA 1:ALA_A20:HN 1.7 5 10 10 1000 1:ILE_A18:HA 1:MET_A21:HN 1.7 5 10 10 1000 1:GLN_A19:HA 1:ILE_A22:HN 1.7 5 10 10 1000 ! ! HAi-HNi+2 1:ARG+_A12:HA 1:LEU_A14:HN 1.7 5 10 10 1000 1:ARG+_A17:HA 1:GLN_A19:HN 1.7 5 10 10 1000 1:ILE_A18:HA 1:ALA_A20:HN 1.7 5 10 10 1000 1:GLN_A19:HA 1:MET_A21:HN 1.7 5 10 10 1000 1:ALA_A20:HA 1:ILE_A22:HN 1.7 5 10 10 1000 1:PRO_A23:HA 1:GLYC_A25:HN 1.7 5 10 10 1000 ! ! HAi-HNi+4 1:ILE_A15:HA 1:GLN_A19:HN 1.7 5 10 10 1000 1:LYS+_A16:HA 1:ALA_A20:HN 1.7 4 10 10 1000 1:ILE_A18:HA 1:ILE_A22:HN 1.7 5 10 10 1000 ! ! HNi-Xi 1:ARG+_A12:HN 1:ARG+_A12:HB1 1.7 5 10 10 1000 1:ALA_A13:HN 1:ALA_A13:X 1.7 4.5 10 10 1000 1:LEU_A14:HN 1:LEU_A14:HB1 1.7 3.2 10 10 1000 1:LEU_A14:HN 1:LEU_A14:HB2 1.7 4 10 10 1000 1:LEU_A14:HN 1:LEU_A14:X1 1.7 5.5 10 10 1000 1:LEU_A14:HN 1:LEU_A14:X2 1.7 5.5 10 10 1000 1:ILE_A15:HN 1:ILE_A15:HB 1.7 3.2 10 10 1000 1:ILE_A15:HN 1:ILE_A15:HG11 1.7 4 10 10 1000 1:ILE_A15:HN 1:ILE_A15:HG12 1.7 4 10 10 1000 1:ILE_A15:HN 1:ILE_A15:X1 1.7 5.5 10 10 1000 1:ILE_A15:HN 1:ILE_A15:X2 1.7 4.5 10 10 1000 1:LYS+_A16:HN 1:LYS+_A16:HB1 1.7 4 10 10 1000 1:LYS+_A16:HN 1:LYS+_A16:HB2 1.7 4 10 10 1000 1:LYS+_A16:HN 1:LYS+_A16:X1 1.7 4.5 10 10 1000 1:ARG+_A17:HN 1:ARG+_A17:X1 1.7 4.5 10 10 1000 1:ARG+_A17:HN 1:ARG+_A17:X2 1.7 5.5 10 10 1000 1:ILE_A18:HN 1:ILE_A18:HB 1.7 4 10 10 1000 1:ILE_A18:HN 1:ILE_A18:HG11 1.7 4 10 10 1000 1:ILE_A18:HN 1:ILE_A18:HG12 1.7 3.2 10 10 1000 1:ILE_A18:HN 1:ILE_A18:X1 1.7 5.5 10 10 1000 1:ILE_A18:HN 1:ILE_A18:X2 1.7 4.5 10 10 1000 1:GLN_A19:HN 1:GLN_A19:HG1 1.7 4 10 10 1000 1:MET_A21:HN 1:MET_A21:HG1 1.7 5 10 10 1000 1:MET_A21:HN 1:MET_A21:HG2 1.7 4 10 10 1000 1:ILE_A22:HN 1:ILE_A22:HB 1.7 4 10 10 1000 1:ILE_A22:HN 1:ILE_A22:HG12 1.7 4 10 10 1000 1:ILE_A22:HN 1:ILE_A22:X1 1.7 5.5 10 10 1000 1:ILE_A22:HN 1:ILE_A22:X2 1.7 5.5 10 10 1000 1:LYS+_A24:HN 1:LYS+_A24:X 1.7 5.5 10 10 1000 1:LYS+_A24:HN 1:LYS+_A24:X2 1.7 5.5 10 10 1000 ! ! ! HN-Xother 1:ALA_A13:HN 1:ARG+_A12:HB1 1.7 4 10 10 1000 1:ALA_A13:HN 1:ARG+_A12:HB2 1.7 5 10 10 1000 1:ALA_A13:HN 1:ARG+_A12:X1 1.7 5.5 10 10 1000 1:LEU_A14:HN 1:ALA_A13:X 1.7 4.5 10 10 1000 1:ILE_A15:HN 1:ALA_A13:X 1.7 5.5 10 10 1000 1:ILE_A15:HN 1:LEU_A14:HB2 1.7 5.5 10 10 1000 1:ILE_A15:HN 1:LEU_A14:X1 1.7 5.5 10 10 1000 1:LYS+_A16:HN 1:ALA_A13:X 1.7 5.5 10 10 1000 1:LYS+_A16:HN 1:ILE_A15:HB 1.7 4 10 10 1000 1:LYS+_A16:HN 1:ILE_A15:X2 1.7 5.5 10 10 1000 1:ARG+_A17:HN 1:LYS+_A16:HB1 1.7 4 10 10 1000 1:ARG+_A17:HN 1:LYS+_A16:HB2 1.7 4 10 10 1000 1:ARG+_A17:HN 1:ALA_A20:X 1.7 5.5 10 10 1000 1:ILE_A18:HN 1:LEU_A14:X1 1.7 5.5 10 10 1000 1:GLN_A19:HN 1:ILE_A18:X1 1.7 5.5 10 10 1000 1:GLN_A19:HN 1:ILE_A18:X2 1.7 5.5 10 10 1000 1:ALA_A20:HN 1:LYS+_A16:HB2 1.7 5 10 10 1000 1:ALA_A20:HN 1:GLN_A19:HB2 1.7 4 10 10 1000 1:ALA_A20:HN 1:GLN_A19:HG1 1.7 5 10 10 1000 1:ALA_A20:HN 1:GLN_A19:HG2 1.7 4 10 10 1000 1:MET_A21:HN 1:ALA_A20:X 1.7 4.5 10 10 1000 1:MET_A21:HN 1:ILE_A22:X1 1.7 5.5 10 10 1000 1:ILE_A22:HN 1:MET_A21:HB1 1.7 5 10 10 1000 1:ILE_A22:HN 1:PRO_A23:HD2 1.7 5 10 10 1000 1:LYS+_A24:HN 1:GLN_A19:HB2 1.7 4 10 10 1000 1:LYS+_A24:HN 1:PRO_A23:HB2 1.7 5 10 10 1000 1:LYS+_A24:HN 1:PRO_A23:HG2 1.7 5 10 10 1000 1:GLYC_A25:HN 1:LYS+_A24:X1 1.7 5.5 10 10 1000 1:GLYC_A25:HN 1:LYS+_A24:X 1.7 5.5 10 10 1000 ! ! ! HN-X vague ! ! ! HAi-Xi 1:CYHN_A11:HA 1:CYHN_A11:X 1.7 5.5 10 10 1000 1:ARG+_A12:HA 1:ARG+_A12:HB1 1.7 4 10 10 1000 1:ARG+_A12:HA 1:ARG+_A12:HB2 1.7 4 10 10 1000 1:ARG+_A12:HA 1:ARG+_A12:X1 1.7 4.5 10 10 1000 1:ARG+_A12:HA 1:ARG+_A12:X2 1.7 4.5 10 10 1000 1:ALA_A13:HA 1:ALA_A13:X 1.7 3.2 10 10 1000 1:LEU_A14:HA 1:LEU_A14:HB2 1.7 4 10 10 1000 1:LEU_A14:HA 1:LEU_A14:X1 1.7 4.5 10 10 1000 1:LEU_A14:HA 1:LEU_A14:X2 1.7 4.5 10 10 1000 1:ILE_A15:HA 1:ILE_A15:HB 1.7 3.2 10 10 1000 1:ILE_A15:HA 1:ILE_A15:HG11 1.7 4 10 10 1000 1:ILE_A15:HA 1:ILE_A15:HG12 1.7 4 10 10 1000 1:ILE_A15:HA 1:ILE_A15:X1 1.7 4.5 10 10 1000 1:ILE_A15:HA 1:ILE_A15:X2 1.7 4.5 10 10 1000 1:LYS+_A16:HA 1:LYS+_A16:HB1 1.7 4 10 10 1000 1:LYS+_A16:HA 1:LYS+_A16:HB2 1.7 4 10 10 1000 1:LYS+_A16:HA 1:LYS+_A16:X1 1.7 5.5 10 10 1000 1:ARG+_A17:HA 1:ARG+_A17:X1 1.7 4.5 10 10 1000 1:ARG+_A17:HA 1:ARG+_A17:X2 1.7 4.5 10 10 1000 1:ILE_A18:HA 1:ILE_A18:HB 1.7 4 10 10 1000 1:ILE_A18:HA 1:ILE_A18:HG12 1.7 4 10 10 1000 1:ILE_A18:HA 1:ILE_A18:HG11 1.7 4 10 10 1000 1:ILE_A18:HA 1:ILE_A18:X1 1.7 5.5 10 10 1000 1:ILE_A18:HA 1:ILE_A18:X2 1.7 4.5 10 10 1000 1:GLN_A19:HA 1:GLN_A19:HB2 1.7 4 10 10 1000 1:GLN_A19:HA 1:GLN_A19:HG1 1.7 4 10 10 1000 1:ALA_A20:HA 1:ALA_A20:X 1.7 3.2 10 10 1000 1:MET_A21:HA 1:MET_A21:HG1 1.7 4 10 10 1000 1:MET_A21:HA 1:MET_A21:HG2 1.7 4 10 10 1000 1:MET_A21:HA 1:MET_A21:X2 1.7 5.5 10 10 1000 1:ILE_A22:HA 1:ILE_A22:HB 1.7 4 10 10 1000 1:ILE_A22:HA 1:ILE_A22:HG12 1.7 5.5 10 10 1000 1:ILE_A22:HA 1:ILE_A22:X1 1.7 4.5 10 10 1000 1:ILE_A22:HA 1:ILE_A22:X2 1.7 4.5 10 10 1000 1:PRO_A23:HA 1:PRO_A23:HB2 1.7 3.2 10 10 1000 1:PRO_A23:HA 1:PRO_A23:HG2 1.7 5 10 10 1000 1:PRO_A23:HA 1:PRO_A23:HD1 1.7 5 10 10 1000 1:LYS+_A24:HA 1:LYS+_A24:X 1.7 5.5 10 10 1000 1:LYS+_A24:HA 1:LYS+_A24:X1 1.7 4.5 10 10 1000 1:LYS+_A24:HA 1:LYS+_A24:X2 1.7 5.5 10 10 1000 ! ! HA-Xother 1:ARG+_A12:HA 1:ALA_A13:X 1.7 5.5 10 10 1000 1:ARG+_A12:HA 1:ILE_A15:HB 1.7 4 10 10 1000 1:ARG+_A12:HA 1:ILE_A15:X1 1.7 5.5 10 10 1000 1:ARG+_A12:HA 1:ILE_A15:X2 1.7 5.5 10 10 1000 1:ALA_A13:HA 1:ARG+_A12:HB1 1.7 4 10 10 1000 1:ALA_A13:HA 1:ARG+_A12:X2 1.7 5.5 10 10 1000 1:ALA_A13:HA 1:LYS+_A16:HB2 1.7 5 10 10 1000 1:ALA_A13:HA 1:LYS+_A16:X1 1.7 5.5 10 10 1000 1:LEU_A14:HA 1:ARG+_A17:HB2 1.7 4 10 10 1000 1:LEU_A14:HA 1:ARG+_A17:X2 1.7 4.5 10 10 1000 1:ILE_A15:HA 1:ILE_A18:HG11 1.7 5 10 10 1000 1:ILE_A15:HA 1:ILE_A18:X1 1.7 4.5 10 10 1000 1:LYS+_A16:HA 1:ILE_A15:X2 1.7 5.5 10 10 1000 1:LYS+_A16:HA 1:GLN_A19:HB1 1.7 4 10 10 1000 1:LYS+_A16:HA 1:GLN_A19:HB2 1.7 5 10 10 1000 1:LYS+_A16:HA 1:GLN_A19:HG1 1.7 5 10 10 1000 1:LYS+_A16:HA 1:ALA_A20:X 1.7 5.5 10 10 1000 1:ARG+_A17:HA 1:ALA_A20:X 1.7 4.5 10 10 1000 1:ILE_A18:HA 1:MET_A21:HB1 1.7 4 10 10 1000 1:ILE_A18:HA 1:MET_A21:HG1 1.7 5 10 10 1000 1:ILE_A18:HA 1:MET_A21:HG2 1.7 5 10 10 1000 1:GLN_A19:HA 1:ILE_A22:HB 1.7 4 10 10 1000 1:GLN_A19:HA 1:ILE_A22:HG12 1.7 5.5 10 10 1000 1:GLN_A19:HA 1:ILE_A22:X1 1.7 4.5 10 10 1000 1:GLN_A19:HA 1:ILE_A22:X2 1.7 5.5 10 10 1000 1:ALA_A20:HA 1:LYS+_A24:X4 1.7 4.5 10 10 1000 1:MET_A21:HA 1:ALA_A20:X 1.7 5.5 10 10 1000 1:ILE_A22:HA 1:MET_A21:HB1 1.7 5.5 10 10 1000 1:ILE_A22:HA 1:PRO_A23:HB2 1.7 5 10 10 1000 1:ILE_A22:HA 1:PRO_A23:HG2 1.7 5 10 10 1000 1:ILE_A22:HA 1:PRO_A23:HD1 1.7 4 10 10 1000 1:ILE_A22:HA 1:PRO_A23:HD2 1.7 3.2 10 10 1000 1:PRO_A23:HA 1:ILE_A22:X2 1.7 5.5 10 10 1000 1:PRO_A23:HA 1:LYS+_A24:X 1.7 5.5 10 10 1000 ! ! HA-X vague ! ! ! ! ! Xi-Xi 1:CYHN_A11:HB1 1:CYHN_A11:HB2 1.7 3.2 10 10 1000 1:ARG+_A12:HB1 1:ARG+_A12:HB2 1.7 3.2 10 10 1000 1:ARG+_A12:HB1 1:ARG+_A12:X1 1.7 3.2 10 10 1000 1:ARG+_A12:HB1 1:ARG+_A12:X2 1.7 3.2 10 10 1000 1:ARG+_A12:HB1 1:ARG+_A12:HE 1.7 5 10 10 1000 1:ARG+_A12:HB2 1:ARG+_A12:X2 1.7 4.5 10 10 1000 1:ARG+_A12:HB2 1:ARG+_A12:HE 1.7 5 10 10 1000 1:ARG+_A12:X1 1:ARG+_A12:X2 1.7 4 10 10 1000 1:ARG+_A12:X2 1:ARG+_A12:HE 1.7 4.5 10 10 1000 1:ARG+_A12:X2 1:ARG+_A12:X3 1.7 4.5 10 10 1000 1:ARG+_A12:X2 1:ARG+_A12:X4 1.7 4.5 10 10 1000 1:LEU_A14:HB2 1:LEU_A14:X1 1.7 5.5 10 10 1000 1:LEU_A14:HB2 1:LEU_A14:X2 1.7 5.5 10 10 1000 1:LEU_A14:X1 1:LEU_A14:X2 1.7 4 10 10 1000 1:ILE_A15:HB 1:ILE_A15:HG11 1.7 4 10 10 1000 1:ILE_A15:HB 1:ILE_A15:X2 1.7 3.2 10 10 1000 1:ILE_A15:HG11 1:ILE_A15:HG12 1.7 3.2 10 10 1000 1:ILE_A15:HG11 1:ILE_A15:X1 1.7 4.5 10 10 1000 1:ILE_A15:HG11 1:ILE_A15:X2 1.7 4.5 10 10 1000 1:ILE_A15:HG12 1:ILE_A15:X1 1.7 3.2 10 10 1000 1:ILE_A15:HG12 1:ILE_A15:X2 1.7 4.5 10 10 1000 1:LYS+_A16:HB1 1:LYS+_A16:X1 1.7 4.5 10 10 1000 1:LYS+_A16:HB2 1:LYS+_A16:X1 1.7 4.5 10 10 1000 1:LYS+_A16:X2 1:LYS+_A16:HE1 1.7 4.5 10 10 1000 1:LYS+_A16:X2 1:LYS+_A16:HE2 1.7 4.5 10 10 1000 1:ARG+_A17:HB2 1:ARG+_A17:X2 1.7 3.2 10 10 1000 1:ARG+_A17:HB2 1:ARG+_A17:HE 1.7 5 10 10 1000 1:ARG+_A17:HB1 1:ARG+_A17:X2 1.7 4 10 10 1000 1:ARG+_A17:HB1 1:ARG+_A17:HE 1.7 5 10 10 1000 1:ARG+_A17:X1 1:ARG+_A17:X2 1.7 4.5 10 10 1000 1:ARG+_A17:X1 1:ARG+_A17:HE 1.7 4.5 10 10 1000 1:ARG+_A17:X2 1:ARG+_A17:X3 1.7 4.5 10 10 1000 1:ARG+_A17:X2 1:ARG+_A17:X4 1.7 5.5 10 10 1000 1:ARG+_A17:X2 1:ARG+_A17:HE 1.7 4.5 10 10 1000 1:ILE_A18:HG11 1:ILE_A18:HG12 1.7 3.2 10 10 1000 1:ILE_A18:HG12 1:ILE_A18:X1 1.7 3.2 10 10 1000 1:ILE_A18:HG11 1:ILE_A18:X1 1.7 3.2 10 10 1000 1:ILE_A18:HG11 1:ILE_A18:X2 1.7 4 10 10 1000 1:GLN_A19:HB1 1:GLN_A19:HB2 1.7 3.2 10 10 1000 1:GLN_A19:HB2 1:GLN_A19:HG1 1.7 4 10 10 1000 1:GLN_A19:HB2 1:GLN_A19:HE22 1.7 5 10 10 1000 1:GLN_A19:HG1 1:GLN_A19:HG2 1.7 3.2 10 10 1000 1:GLN_A19:HG1 1:GLN_A19:HE21 1.7 5 10 10 1000 1:GLN_A19:HG1 1:GLN_A19:HE22 1.7 4 10 10 1000 1:GLN_A19:HG2 1:GLN_A19:HE22 1.7 4 10 10 1000 1:MET_A21:HG1 1:MET_A21:X2 1.7 5.5 10 10 1000 1:MET_A21:HG2 1:MET_A21:HG1 1.7 3.2 10 10 1000 1:MET_A21:HG2 1:MET_A21:X2 1.7 5.5 10 10 1000 1:ILE_A22:HB 1:ILE_A22:X1 1.7 3.2 10 10 1000 1:ILE_A22:HB 1:ILE_A22:X2 1.7 3.2 10 10 1000 1:ILE_A22:HG12 1:ILE_A22:X2 1.7 4.5 10 10 1000 1:ILE_A22:X1 1:ILE_A22:X2 1.7 4.5 10 10 1000 1:PRO_A23:HB2 1:PRO_A23:HG2 1.7 4 10 10 1000 1:PRO_A23:HB2 1:PRO_A23:HD1 1.7 4 10 10 1000 1:PRO_A23:HB2 1:PRO_A23:HD2 1.7 4 10 10 1000 1:PRO_A23:HG2 1:PRO_A23:HD1 1.7 4 10 10 1000 1:PRO_A23:HG2 1:PRO_A23:HD2 1.7 4 10 10 1000 1:PRO_A23:HD1 1:PRO_A23:HD2 1.7 3.2 10 10 1000 1:LYS+_A24:X1 1:LYS+_A24:X3 1.7 4.5 10 10 1000 1:LYS+_A24:X1 1:LYS+_A24:X4 1.7 4.5 10 10 1000 1:LYS+_A24:X3 1:LYS+_A24:X4 1.7 4.5 10 10 1000 ! ! X-X vague ! ! ! X-X other 1:ARG+_A12:HB1 1:ALA_A13:X 1.7 4.5 10 10 1000 1:ARG+_A12:HB2 1:ALA_A13:X 1.7 5.5 10 10 1000 1:ARG+_A12:X1 1:ALA_A13:X 1.7 5.5 10 10 1000 1:ARG+_A12:X2 1:ALA_A13:X 1.7 5.5 10 10 1000 1:ARG+_A12:X2 1:ILE_A15:HG12 1.7 5.5 10 10 1000 1:ALA_A13:X 1:LEU_A14:X2 1.7 5.5 10 10 1000 1:ALA_A13:X 1:ILE_A15:HB 1.7 5.5 10 10 1000 1:ALA_A13:X 1:ILE_A15:X1 1.7 5.5 10 10 1000 1:LEU_A14:X1 1:ARG+_A17:HB2 1.7 5.5 10 10 1000 1:LEU_A14:X1 1:ILE_A18:HG11 1.7 5.5 10 10 1000 1:LEU_A14:X2 1:ILE_A18:HG11 1.7 5.5 10 10 1000 1:ILE_A15:HG11 1:ILE_A18:X1 1.7 5.5 10 10 1000 1:ILE_A15:X2 1:GLN_A19:HG1 1.7 4.5 10 10 1000 1:ILE_A15:X2 1:GLN_A19:HE21 1.7 5.5 10 10 1000 1:ILE_A15:X2 1:GLN_A19:HE22 1.7 5.5 10 10 1000 1:LYS+_A16:X2 1:ILE_A18:X1 1.7 5.5 10 10 1000 1:ARG+_A17:HB2 1:ALA_A20:X 1.7 5.5 10 10 1000 1:ARG+_A17:X2 1:ALA_A20:X 1.7 5.5 10 10 1000 1:ILE_A18:X1 1:GLN_A19:HE22 1.7 5.5 10 10 1000 1:ILE_A18:X1 1:ILE_A22:X2 1.7 4.5 10 10 1000 1:GLN_A19:HG1 1:ILE_A22:X2 1.7 4.5 10 10 1000 1:ALA_A20:X 1:MET_A21:HG1 1.7 4.5 10 10 1000 1:MET_A21:HB1 1:ILE_A22:X1 1.7 4.5 10 10 1000 1:MET_A21:HG2 1:ILE_A22:X1 1.7 5.5 10 10 1000 1:ILE_A22:HB 1:LYS+_A24:X4 1.7 5.5 10 10 1000 1:PRO_A23:HB2 1:LYS+_A24:X3 1.7 5.5 10 10 1000 1:PRO_A23:HD1 1:ILE_A22:HB 1.7 4 10 10 1000 1:PRO_A23:HD2 1:ILE_A22:HB 1.7 4 10 10 1000 1:PRO_A23:HD2 1:ILE_A22:X1 1.7 5.5 10 10 1000 1:PRO_A23:HD2 1:ILE_A22:X2 1.7 5.5 10 10 1000 ! ! !
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