NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
650148 | 6noa | 30560 | cing | 1-original | 4 | XPLOR/CNS | dihedral angle |
# Restraints file 4: SL1_Dihedral_Restraints.tbl ! ! Torsion angle restraints for sugar pucker in the ! - c-JUN 5? UTR TL1 ! ! ! Pucker is defined with ribose torsion angles nu1 and nu2. ! nu1 = O4'-C1'-C2'-C3' ! nu2 = C1'-C2'-C3'-C4' ! "N" C3' endo: ! nu1 = -20 +/- 10 ! nu2 = +35 +/- 5 ! "S" C2' endo: ! nu1 = +35 +/- 10 ! nu2 = -35 +/- 5 ! See Saenger page 20. ! ! C2' endo nucleotides (Judging from TOCSY): only if both H1'-H2'' and ! H1'-H3' couplings both are strong (intensity of H1'-H3' even larger) ! Xhi is defined as follows... ! Purines = O4'-C1'-N9-C4 ! pyrimidine = O4'-C1'-N1-C2 ! Anti: ! Xhi = 180.0 +/- 90.0 ! including high-anti and excluding high-syn : ! Xhi = =-150 +/- 90.0 ! Syn: Xhi = 0.0 +/- 90.0 ! See Saenger page 22. !2' endo ! ! G93 assign (resid 93 and name O4') (resid 93 and name C1') (resid 93 and name C2') (resid 93 and name C3') 1.0 35 10.0 2 assign (resid 93 and name C1') (resid 93 and name C2') (resid 93 and name C3') (resid 93 and name C4') 1.0 -35.0 5.0 2 assign (resid 93 and name c5') (resid 93 and name c4') (resid 93 and name c3') (resid 93 and name o3') 1.0 145.0 20.0 2 assign (resid 93 and name O4') (resid 93 and name C1') (resid 93 and name N9 ) (resid 93 and name C4 ) 1.0 -150.0 90.0 2 !3' endo! ! G94 assign (resid 94 and name O4') (resid 94 and name C1') (resid 94 and name C2') (resid 94 and name C3') 1.0 -20.0 10.0 2 assign (resid 94 and name C1') (resid 94 and name C2') (resid 94 and name C3') (resid 94 and name C4') 1.0 35.0 5.0 2 assign (resid 94 and name c5') (resid 94 and name c4') (resid 94 and name c3') (resid 94 and name o3') 1.0 80.0 25.0 2 assign (resid 94 and name O4') (resid 94 and name C1') (resid 94 and name N9 ) (resid 94 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 93 and name O3') (resid 94 and name P ) (resid 94 and name O5') (resid 94 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 94 and name P ) (resid 94 and name O5') (resid 94 and name C5') (resid 94 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 94 and name O5') (resid 94 and name C5') (resid 94 and name C4') (resid 94 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 94 and name C4') (resid 94 and name C3') (resid 94 and name O3') (resid 95 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 94 and name C3') (resid 94 and name O3') (resid 95 and name P ) (resid 95 and name O5') 1.0 -70.0 50.0 2 ! C95 assign (resid 95 and name O4') (resid 95 and name C1') (resid 95 and name C2') (resid 95 and name C3') 1.0 -20.0 10.0 2 assign (resid 95 and name C1') (resid 95 and name C2') (resid 95 and name C3') (resid 95 and name C4') 1.0 35.0 5.0 2 assign (resid 95 and name c5') (resid 95 and name c4') (resid 95 and name c3') (resid 95 and name o3') 1.0 80.0 25.0 2 assign (resid 95 and name O4') (resid 95 and name C1') (resid 95 and name N1 ) (resid 95 and name C2 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 94 and name O3') (resid 95 and name P ) (resid 95 and name O5') (resid 95 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 95 and name P ) (resid 95 and name O5') (resid 95 and name C5') (resid 95 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 95 and name O5') (resid 95 and name C5') (resid 95 and name C4') (resid 95 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 95 and name C4') (resid 95 and name C3') (resid 95 and name O3') (resid 96 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 95 and name C3') (resid 95 and name O3') (resid 96 and name P ) (resid 96 and name O5') 1.0 -70.0 50.0 2 ! A96 assign (resid 96 and name O4') (resid 96 and name C1') (resid 96 and name C2') (resid 96 and name C3') 1.0 -20.0 10.0 2 assign (resid 96 and name C1') (resid 96 and name C2') (resid 96 and name C3') (resid 96 and name C4') 1.0 35.0 5.0 2 assign (resid 96 and name c5') (resid 96 and name c4') (resid 96 and name c3') (resid 96 and name o3') 1.0 80.0 25.0 2 assign (resid 96 and name O4') (resid 96 and name C1') (resid 96 and name N9 ) (resid 96 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 95 and name O3') (resid 96 and name P ) (resid 96 and name O5') (resid 96 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 96 and name P ) (resid 96 and name O5') (resid 96 and name C5') (resid 96 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 96 and name O5') (resid 96 and name C5') (resid 96 and name C4') (resid 96 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 96 and name C4') (resid 96 and name C3') (resid 96 and name O3') (resid 97 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 96 and name C3') (resid 96 and name O3') (resid 97 and name P ) (resid 97 and name O5') 1.0 -70.0 50.0 2 ! G97 assign (resid 97 and name O4') (resid 97 and name C1') (resid 97 and name C2') (resid 97 and name C3') 1.0 -20.0 10.0 2 assign (resid 97 and name C1') (resid 97 and name C2') (resid 97 and name C3') (resid 97 and name C4') 1.0 35.0 5.0 2 assign (resid 97 and name c5') (resid 97 and name c4') (resid 97 and name c3') (resid 97 and name o3') 1.0 80.0 25.0 2 assign (resid 97 and name O4') (resid 97 and name C1') (resid 97 and name N9 ) (resid 97 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 96 and name O3') (resid 97 and name P ) (resid 97 and name O5') (resid 97 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 97 and name P ) (resid 97 and name O5') (resid 97 and name C5') (resid 97 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 97 and name O5') (resid 97 and name C5') (resid 97 and name C4') (resid 97 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 97 and name C4') (resid 97 and name C3') (resid 97 and name O3') (resid 98 and name P ) 1.0 -160.0 50.0 2 ! 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G102 assign (resid 102 and name O4') (resid 102 and name C1') (resid 102 and name C2') (resid 102 and name C3') 1.0 -20.0 10.0 2 assign (resid 102 and name C1') (resid 102 and name C2') (resid 102 and name C3') (resid 102 and name C4') 1.0 35.0 5.0 2 assign (resid 102 and name c5') (resid 102 and name c4') (resid 102 and name c3') (resid 102 and name o3') 1.0 80.0 25.0 2 assign (resid 102 and name O4') (resid 102 and name C1') (resid 102 and name N9 ) (resid 102 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 101 and name O3') (resid 102 and name P ) (resid 102 and name O5') (resid 102 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 102 and name P ) (resid 102 and name O5') (resid 102 and name C5') (resid 102 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 102 and name O5') (resid 102 and name C5') (resid 102 and name C4') (resid 102 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 102 and name C4') (resid 102 and name C3') (resid 102 and name O3') (resid 103 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 102 and name C3') (resid 102 and name O3') (resid 103 and name P ) (resid 103 and name O5') 1.0 -70.0 50.0 2 ! U103 assign (resid 103 and name O4') (resid 103 and name C1') (resid 103 and name C2') (resid 103 and name C3') 1.0 -20.0 10.0 2 assign (resid 103 and name C1') (resid 103 and name C2') (resid 103 and name C3') (resid 103 and name C4') 1.0 35.0 5.0 2 assign (resid 103 and name c5') (resid 103 and name c4') (resid 103 and name c3') (resid 103 and name o3') 1.0 80.0 25.0 2 assign (resid 103 and name O4') (resid 103 and name C1') (resid 103 and name N1 ) (resid 103 and name C2 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 102 and name O3') (resid 103 and name P ) (resid 103 and name O5') (resid 103 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 103 and name P ) (resid 103 and name O5') (resid 103 and name C5') (resid 103 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 103 and name O5') (resid 103 and name C5') (resid 103 and name C4') (resid 103 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 103 and name C4') (resid 103 and name C3') (resid 103 and name O3') (resid 12 and name P ) 1.0 -160.0 50.0 2 ! G106 assign (resid 106 and name O4') (resid 106 and name C1') (resid 106 and name C2') (resid 106 and name C3') 1.0 -20.0 10.0 2 assign (resid 106 and name C1') (resid 106 and name C2') (resid 106 and name C3') (resid 106 and name C4') 1.0 35.0 5.0 2 assign (resid 106 and name c5') (resid 106 and name c4') (resid 106 and name c3') (resid 106 and name o3') 1.0 80.0 25.0 2 assign (resid 106 and name O4') (resid 106 and name C1') (resid 106 and name N9 ) (resid 106 and name C4 ) 1.0 -150.0 90.0 2 !backbone beta assign (resid 106 and name P ) (resid 106 and name O5') (resid 106 and name C5') (resid 106 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 106 and name O5') (resid 106 and name C5') (resid 106 and name C4') (resid 106 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 106 and name C4') (resid 106 and name C3') (resid 106 and name O3') (resid 107 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 106 and name C3') (resid 106 and name O3') (resid 107 and name P ) (resid 107 and name O5') 1.0 -70.0 50.0 2 ! A107 assign (resid 107 and name O4') (resid 107 and name C1') (resid 107 and name C2') (resid 107 and name C3') 1.0 -20.0 10.0 2 assign (resid 107 and name C1') (resid 107 and name C2') (resid 107 and name C3') (resid 107 and name C4') 1.0 35.0 5.0 2 assign (resid 107 and name c5') (resid 107 and name c4') (resid 107 and name c3') (resid 107 and name o3') 1.0 80.0 25.0 2 assign (resid 107 and name O4') (resid 107 and name C1') (resid 107 and name N9 ) (resid 107 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 106 and name O3') (resid 107 and name P ) (resid 107 and name O5') (resid 107 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 107 and name P ) (resid 107 and name O5') (resid 107 and name C5') (resid 107 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 107 and name O5') (resid 107 and name C5') (resid 107 and name C4') (resid 107 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 107 and name C4') (resid 107 and name C3') (resid 107 and name O3') (resid 108 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 107 and name C3') (resid 107 and name O3') (resid 108 and name P ) (resid 108 and name O5') 1.0 -70.0 50.0 2 ! A108 assign (resid 108 and name O4') (resid 108 and name C1') (resid 108 and name C2') (resid 108 and name C3') 1.0 -20.0 10.0 2 assign (resid 108 and name C1') (resid 108 and name C2') (resid 108 and name C3') (resid 108 and name C4') 1.0 35.0 5.0 2 assign (resid 108 and name c5') (resid 108 and name c4') (resid 108 and name c3') (resid 108 and name o3') 1.0 80.0 25.0 2 assign (resid 108 and name O4') (resid 108 and name C1') (resid 108 and name N9 ) (resid 108 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 107 and name O3') (resid 108 and name P ) (resid 108 and name O5') (resid 108 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 108 and name P ) (resid 108 and name O5') (resid 108 and name C5') (resid 108 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 108 and name O5') (resid 108 and name C5') (resid 108 and name C4') (resid 108 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 108 and name C4') (resid 108 and name C3') (resid 108 and name O3') (resid 17 and name P ) 1.0 -160.0 50.0 2 ! U110 assign (resid 110 and name O4') (resid 110 and name C1') (resid 110 and name C2') (resid 110 and name C3') 1.0 -20.0 10.0 2 assign (resid 110 and name C1') (resid 110 and name C2') (resid 110 and name C3') (resid 110 and name C4') 1.0 35.0 5.0 2 assign (resid 110 and name c5') (resid 110 and name c4') (resid 110 and name c3') (resid 110 and name o3') 1.0 80.0 25.0 2 assign (resid 110 and name O4') (resid 110 and name C1') (resid 110 and name N1) (resid 110 and name C2 ) 1.0 -150.0 90.0 2 !backbone beta assign (resid 110 and name P ) (resid 110 and name O5') (resid 110 and name C5') (resid 110 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 110 and name O5') (resid 110 and name C5') (resid 110 and name C4') (resid 110 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 110 and name C4') (resid 110 and name C3') (resid 110 and name O3') (resid 111 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 110 and name C3') (resid 110 and name O3') (resid 111 and name P ) (resid 111 and name O5') 1.0 -70.0 50.0 2 ! G111 assign (resid 111 and name O4') (resid 111 and name C1') (resid 111 and name C2') (resid 111 and name C3') 1.0 -20.0 10.0 2 assign (resid 111 and name C1') (resid 111 and name C2') (resid 111 and name C3') (resid 111 and name C4') 1.0 35.0 5.0 2 assign (resid 111 and name c5') (resid 111 and name c4') (resid 111 and name c3') (resid 111 and name o3') 1.0 80.0 25.0 2 assign (resid 111 and name O4') (resid 111 and name C1') (resid 111 and name N9 ) (resid 111 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 110 and name O3') (resid 111 and name P ) (resid 111 and name O5') (resid 111 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 111 and name P ) (resid 111 and name O5') (resid 111 and name C5') (resid 111 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 111 and name O5') (resid 111 and name C5') (resid 111 and name C4') (resid 111 and name C3') 1.0 60.0 40.0 2 ! A113 assign (resid 113 and name O4') (resid 113 and name C1') (resid 113 and name C2') (resid 113 and name C3') 1.0 -20.0 10.0 2 assign (resid 113 and name C1') (resid 113 and name C2') (resid 113 and name C3') (resid 113 and name C4') 1.0 35.0 5.0 2 assign (resid 113 and name c5') (resid 113 and name c4') (resid 113 and name c3') (resid 113 and name o3') 1.0 80.0 25.0 2 assign (resid 113 and name O4') (resid 113 and name C1') (resid 113 and name N9 ) (resid 113 and name C4 ) 1.0 -150.0 90.0 2 !backbone beta assign (resid 113 and name P ) (resid 113 and name O5') (resid 113 and name C5') (resid 113 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 113 and name O5') (resid 113 and name C5') (resid 113 and name C4') (resid 113 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 113 and name C4') (resid 113 and name C3') (resid 113 and name O3') (resid 114 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 113 and name C3') (resid 113 and name O3') (resid 114 and name P ) (resid 114 and name O5') 1.0 -70.0 50.0 2 ! A114 assign (resid 114 and name O4') (resid 114 and name C1') (resid 114 and name C2') (resid 114 and name C3') 1.0 -20.0 10.0 2 assign (resid 114 and name C1') (resid 114 and name C2') (resid 114 and name C3') (resid 114 and name C4') 1.0 35.0 5.0 2 assign (resid 114 and name c5') (resid 114 and name c4') (resid 114 and name c3') (resid 114 and name o3') 1.0 80.0 25.0 2 assign (resid 114 and name O4') (resid 114 and name C1') (resid 114 and name N9 ) (resid 114 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 113 and name O3') (resid 114 and name P ) (resid 114 and name O5') (resid 114 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 114 and name P ) (resid 114 and name O5') (resid 114 and name C5') (resid 114 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 114 and name O5') (resid 114 and name C5') (resid 114 and name C4') (resid 114 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 114 and name C4') (resid 114 and name C3') (resid 114 and name O3') (resid 1 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 114 and name C3') (resid 114 and name O3') (resid 1 and name P ) (resid 1 and name O5') 1.0 -70.0 50.0 2 ! A115 assign (resid 115 and name O4') (resid 115 and name C1') (resid 115 and name C2') (resid 115 and name C3') 1.0 -20.0 10.0 2 assign (resid 115 and name C1') (resid 115 and name C2') (resid 115 and name C3') (resid 115 and name C4') 1.0 35.0 5.0 2 assign (resid 115 and name c5') (resid 115 and name c4') (resid 115 and name c3') (resid 115 and name o3') 1.0 80.0 25.0 2 assign (resid 115 and name O4') (resid 115 and name C1') (resid 115 and name N9 ) (resid 115 and name C4 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 114 and name O3') (resid 115 and name P ) (resid 115 and name O5') (resid 115 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 115 and name P ) (resid 115 and name O5') (resid 115 and name C5') (resid 115 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 115 and name O5') (resid 115 and name C5') (resid 115 and name C4') (resid 115 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 115 and name C4') (resid 115 and name C3') (resid 115 and name O3') (resid 116 and name P ) 1.0 -160.0 50.0 2 ! U127 assign (resid 127 and name O4') (resid 127 and name C1') (resid 127 and name C2') (resid 127 and name C3') 1.0 -20.0 10.0 2 assign (resid 127 and name C1') (resid 127 and name C2') (resid 127 and name C3') (resid 127 and name C4') 1.0 35.0 5.0 2 assign (resid 127 and name c5') (resid 127 and name c4') (resid 127 and name c3') (resid 127 and name o3') 1.0 80.0 25.0 2 assign (resid 127 and name O4') (resid 127 and name C1') (resid 127 and name N1 ) (resid 127 and name C2 ) 1.0 -150.0 90.0 2 !backbone beta assign (resid 127 and name P ) (resid 127 and name O5') (resid 127 and name C5') (resid 127 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 127 and name O5') (resid 127 and name C5') (resid 127 and name C4') (resid 127 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 127 and name C4') (resid 127 and name C3') (resid 127 and name O3') (resid 128 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 127 and name C3') (resid 127 and name O3') (resid 128 and name P ) (resid 128 and name O5') 1.0 -70.0 50.0 2 ! U128 assign (resid 128 and name O4') (resid 128 and name C1') (resid 128 and name C2') (resid 128 and name C3') 1.0 -20.0 10.0 2 assign (resid 128 and name C1') (resid 128 and name C2') (resid 128 and name C3') (resid 128 and name C4') 1.0 35.0 5.0 2 assign (resid 128 and name c5') (resid 128 and name c4') (resid 128 and name c3') (resid 128 and name o3') 1.0 80.0 25.0 2 assign (resid 128 and name O4') (resid 128 and name C1') (resid 128 and name N1 ) (resid 128 and name C2 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 127 and name O3') (resid 128 and name P ) (resid 128 and name O5') (resid 128 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 128 and name P ) (resid 128 and name O5') (resid 128 and name C5') (resid 128 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 128 and name O5') (resid 128 and name C5') (resid 128 and name C4') (resid 128 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 128 and name C4') (resid 128 and name C3') (resid 128 and name O3') (resid 129 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 128 and name C3') (resid 128 and name O3') (resid 129 and name P ) (resid 129 and name O5') 1.0 -70.0 50.0 2 ! U129 assign (resid 129 and name O4') (resid 129 and name C1') (resid 129 and name C2') (resid 129 and name C3') 1.0 -20.0 10.0 2 assign (resid 129 and name C1') (resid 129 and name C2') (resid 129 and name C3') (resid 129 and name C4') 1.0 35.0 5.0 2 assign (resid 129 and name c5') (resid 129 and name c4') (resid 129 and name c3') (resid 129 and name o3') 1.0 80.0 25.0 2 assign (resid 129 and name O4') (resid 129 and name C1') (resid 129 and name N1 ) (resid 129 and name C2 ) 1.0 -150.0 90.0 2 !backbone alpha assign (resid 128 and name O3') (resid 129 and name P ) (resid 129 and name O5') (resid 129 and name C5') 1.0 -60.0 40.0 2 !backbone beta assign (resid 129 and name P ) (resid 129 and name O5') (resid 129 and name C5') (resid 129 and name C4') 1.0 180.0 50.0 2 !backbone gama assign (resid 129 and name O5') (resid 129 and name C5') (resid 129 and name C4') (resid 129 and name C3') 1.0 60.0 40.0 2 !backbone epsilon assign (resid 129 and name C4') (resid 129 and name C3') (resid 129 and name O3') (resid 130 and name P ) 1.0 -160.0 50.0 2 !backbone zeta assign (resid 129 and name C3') (resid 129 and name O3') (resid 130 and name P ) (resid 130 and name O5') 1.0 -70.0 50.0 2 ! 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