NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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623681 |
6beo   |
30358 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
# Restraints file 1: oliver_noe.tbl !-------------------------------------------------------------------------! !NOE Table for Oliver peptide ! !Updated 102516 mds !Oliver, 9mer pro PRO TYR his PRO LYS ASP LEU gln !Upper case L-Amino Acid !Lower case D-Amino Acid ! !! NOE binning !! !strong 2.5 0.7 0.7 !medium 3.5 1.2 1.2 !weak 4.5 1.6 1.6 !very weak 5.0 2.0 2.0 !TOTAL NOES = 91 !long range (j-i >6) = 5 !short range (2 > j-i < 5) = 18 !sequential (i to j) = 24 !intraresidue (i to i) = 44 !------------------------------------------------------------------------! !*** Bacbone NOE***! !HN-HA assign ( resid 1 and name HA ) ( resid 3 and name HN ) 4.5 1.6 1.6 assign ( resid 3 and name HA ) ( resid 4 and name HN ) 3.5 1.2 1.2 assign ( resid 3 and name HA ) ( resid 3 and name HN ) 4.5 1.6 1.6 assign ( resid 4 and name HA ) ( resid 4 and name HN ) 4.5 1.6 1.6 assign ( resid 6 and name HA ) ( resid 6 and name HN ) 3.5 1.2 1.2 assign ( resid 6 and name HA ) ( resid 7 and name HN ) 3.5 1.2 1.2 assign ( resid 6 and name HA ) ( resid 9 and name HN ) 4.5 1.6 1.6 assign ( resid 6 and name HA ) ( resid 8 and name HN ) 4.5 1.6 1.6 assign ( resid 7 and name HA ) ( resid 7 and name HN ) 2.5 0.7 0.7 assign ( resid 8 and name HA ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 8 and name HA ) ( resid 8 and name HN ) 3.5 1.2 1.2 assign ( resid 8 and name HA ) ( resid 9 and name HN ) 4.5 1.6 1.6 assign ( resid 9 and name HA ) ( resid 9 and name HN ) 3.5 1.2 1.2 assign ( resid 9 and name HA ) ( resid 3 and name HN ) 4.5 1.6 1.6 assign ( resid 9 and name HA ) ( resid 8 and name HN ) 4.5 1.6 1.6 !HN-HN ! assign ( resid 3 and name HN ) ( resid 4 and name HN ) 4.5 1.6 1.6 assign ( resid 7 and name HN ) ( resid 6 and name HN ) 3.5 1.2 1.2 assign ( resid 8 and name HN ) ( resid 7 and name HN ) 3.5 1.2 1.2 ! assign ( resid 8 and name HN ) ( resid 3 and name HN ) 4.5 1.6 1.6 ! assign ( resid 8 and name HN ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 9 and name HN ) ( resid 8 and name HN ) 3.5 1.2 1.2 ! assign ( resid 9 and name HN ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 9 and name HN ) ( resid 7 and name HN ) 4.5 1.6 1.6 !HA-HA assign ( resid 9 and name HA ) ( resid 3 and name HA ) 4.5 1.6 1.6 ! pro 1 assign ( resid 1 and name HD2 ) ( resid 9 and name HA ) 3.5 1.2 1.2 assign ( resid 1 and name HD1 ) ( resid 1 and name HB2 ) 3.5 1.2 1.2 assign ( resid 1 and name HD1 ) ( resid 1 and name HB1 ) 3.5 1.2 1.2 assign ( resid 1 and name HD1 ) ( resid 1 and name HG2 ) 3.5 1.2 1.2 assign ( resid 1 and name HD1 ) ( resid 9 and name HA ) 3.5 1.2 1.2 assign ( resid 1 and name HD2 ) ( resid 1 and name HA ) 4.5 1.6 1.6 assign ( resid 1 and name HD2 ) ( resid 9 and name HN ) 4.5 1.6 1.6 assign ( resid 1 and name HD1 ) ( resid 1 and name HG1 ) 3.2 1.2 1.2 ! assign ( resid 1 and name HG2 ) ( resid 6 and name HA ) 4.5 1.6 1.6 ! PRO 2 assign ( resid 2 and name HD2 ) ( resid 2 and name HA ) 4.5 1.6 1.6 assign ( resid 2 and name HD1 ) ( resid 2 and name HA ) 4.5 1.6 1.6 ! TYR 3 assign ( resid 3 and name HA ) ( resid 3 and name HD# ) 3.5 1.2 1.2 assign ( resid 3 and name HB# ) ( resid 3 and name HN ) 3.5 1.2 1.2 assign ( resid 3 and name HD# ) ( resid 3 and name HN ) 3.5 1.2 1.2 assign ( resid 3 and name HA ) ( resid 3 and name HE# ) 4.5 1.6 1.6 assign ( resid 3 and name HD# ) ( resid 4 and name HN ) 4.5 1.6 1.6 assign ( resid 3 and name HE# ) ( resid 3 and name HN ) 4.5 1.6 1.6 ! his 4 assign ( resid 4 and name HB2 ) ( resid 4 and name HN ) 4.5 1.6 1.6 ! assign ( resid 4 and name HB2 ) ( resid 9 and name HE21 ) 4.5 1.6 1.6 assign ( resid 4 and name HB1 ) ( resid 4 and name HN ) 4.5 1.6 1.6 assign ( resid 4 and name HB1 ) ( resid 8 and name HB# ) 3.5 1.2 1.2 assign ( resid 4 and name HB1 ) ( resid 8 and name HG# ) 4.5 1.6 1.6 assign ( resid 4 and name HD2 ) ( resid 4 and name HE1 ) 4.5 1.6 1.6 ! PRO 5 assign ( resid 5 and name HD1 ) ( resid 5 and name HB2 ) 3.5 1.2 1.2 assign ( resid 5 and name HD1 ) ( resid 5 and name HB1 ) 3.5 1.2 1.2 assign ( resid 5 and name HB2 ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HB2 ) ( resid 7 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HB1 ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HB1 ) ( resid 7 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HD2 ) ( resid 4 and name HA ) 4.5 1.6 1.6 assign ( resid 5 and name HD2 ) ( resid 4 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HD1 ) ( resid 4 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HD1 ) ( resid 5 and name HA ) 4.5 1.6 1.6 assign ( resid 5 and name HD1 ) ( resid 5 and name HG2 ) 3.5 1.2 1.2 assign ( resid 5 and name HD1 ) ( resid 5 and name HG1 ) 3.5 1.2 1.2 assign ( resid 5 and name HG2 ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HG2 ) ( resid 7 and name HB2 ) 4.5 1.6 1.6 assign ( resid 5 and name HG2 ) ( resid 7 and name HB1 ) 4.5 1.6 1.6 assign ( resid 5 and name HG2 ) ( resid 7 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HG2 ) ( resid 8 and name HN ) 4.5 1.6 1.6 assign ( resid 5 and name HG# ) ( resid 8 and name HG# ) 4.5 1.6 1.6 ! LYS 6 assign ( resid 6 and name HA ) ( resid 9 and name HE21 ) 3.5 1.2 1.2 assign ( resid 6 and name HG# ) ( resid 6 and name HN ) 3.5 1.2 1.2 assign ( resid 6 and name HG# ) ( resid 7 and name HN ) 3.5 1.2 1.2 assign ( resid 6 and name HB# ) ( resid 6 and name HE# ) 4.5 1.6 1.6 assign ( resid 6 and name HB# ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 6 and name HB# ) ( resid 7 and name HN ) 4.5 1.6 1.6 assign ( resid 6 and name HB# ) ( resid 9 and name HE21 ) 4.5 1.6 1.6 ! assign ( resid 6 and name HD# ) ( resid 6 and name HE# ) 3.5 1.2 1.2 assign ( resid 6 and name HD# ) ( resid 6 and name HN ) 4.5 1.6 1.6 ! assign ( resid 6 and name HG# ) ( resid 6 and name HE# ) 4.5 1.6 1.6 assign ( resid 6 and name HG# ) ( resid 9 and name HE21 ) 4.5 1.6 1.6 ! ASP 7 assign ( resid 7 and name HB2 ) ( resid 7 and name HN ) 3.5 1.2 1.2 assign ( resid 7 and name HB1 ) ( resid 7 and name HN ) 3.5 1.2 1.2 assign ( resid 7 and name HB2 ) ( resid 8 and name HN ) 4.5 1.6 1.6 assign ( resid 7 and name HB1 ) ( resid 8 and name HN ) 4.5 1.6 1.6 ! LEU 8 ! assign ( resid 8 and name HB2 ) ( resid 3 and name HD# ) 3.5 1.2 1.2 assign ( resid 8 and name HB2 ) ( resid 8 and name HN ) 3.5 1.2 1.2 ! assign ( resid 8 and name HB1 ) ( resid 3 and name HD# ) 3.5 1.2 1.2 ! assign ( resid 8 and name HD# ) ( resid 3 and name HD# ) 3.5 1.2 1.2 assign ( resid 8 and name HG# ) ( resid 8 and name HN ) 3.5 1.2 1.2 assign ( resid 8 and name HA ) ( resid 9 and name HE21 ) 4.5 1.6 1.6 ! assign ( resid 8 and name HB1 ) ( resid 3 and name HE# ) 4.5 1.6 1.6 assign ( resid 8 and name HB1 ) ( resid 8 and name HN ) 4.5 1.6 1.6 ! assign ( resid 8 and name HD# ) ( resid 3 and name HE# ) 4.5 1.6 1.6 ! assign ( resid 8 and name HD# ) ( resid 3 and name HN ) 4.5 1.6 1.6 assign ( resid 8 and name HD# ) ( resid 6 and name HN ) 4.5 1.6 1.6 assign ( resid 8 and name HD# ) ( resid 7 and name HN ) 4.5 1.6 1.6 assign ( resid 8 and name HD# ) ( resid 8 and name HN ) 4.5 1.6 1.6 assign ( resid 8 and name HD# ) ( resid 9 and name HE21 ) 4.5 1.6 1.6 assign ( resid 8 and name HG# ) ( resid 7 and name HN ) 4.5 1.6 1.6 ! gln 9 assign ( resid 9 and name HE21 ) ( resid 9 and name HE22 ) 2.5 0.7 0.7 assign ( resid 9 and name HB2 ) ( resid 9 and name HE21 ) 3.5 1.2 1.2 assign ( resid 9 and name HB2 ) ( resid 9 and name HN ) 3.5 1.2 1.2 assign ( resid 9 and name HB1 ) ( resid 9 and name HN ) 3.5 1.2 1.2 assign ( resid 9 and name HG# ) ( resid 9 and name HN ) 3.5 1.2 1.2 assign ( resid 9 and name HA ) ( resid 9 and name HE21 ) 4.5 1.6 1.6 ! assign ( resid 9 and name HB2 ) ( resid 3 and name HN ) 4.5 1.6 1.6 ! assign ( resid 9 and name HB2 ) ( resid 6 and name HA ) 4.5 1.6 1.6 assign ( resid 9 and name HB2 ) ( resid 8 and name HN ) 4.5 1.6 1.6 assign ( resid 9 and name HB1 ) ( resid 9 and name HE21 ) 4.5 1.6 1.6 assign ( resid 9 and name HG# ) ( resid 8 and name HN ) 4.5 1.6 1.6 assign ( resid 9 and name HG# ) ( resid 9 and name HE21 ) 3.5 1.2 1.2
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