NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
23692 | 2jxm | cing | 1-original | 1 | unknown | chemical shift difference |
! file: CSP_values.xpl ! storing residues with chemical shift perturbations (CSP) in store5-property, part of pcf.inp ! M.UBBINK 22.11.2007 ! Prochlorothrix hollandica Pc wt data, Rinske Hulsker !-------ENTER ALL ATOMS WITH CSP----------- vector do (store5=100) (atom "plas" 10 HN) vector do (store5=100) (atom "plas" 11 HN) vector do (store5=100) (atom "plas" 12 HN) vector do (store5=100) (atom "plas" 33 HN) vector do (store5=100) (atom "plas" 59 HN) vector do (store5=100) (atom "plas" 63 HN) vector do (store5=100) (atom "plas" 85 HN) vector do (store5=100) (atom "plas" 86 HN) vector do (store5=100) (atom "plas" 87 HN) vector do (store5=100) (atom "plas" 88 HN) vector do (store5=100) (atom "plas" 10 N) vector do (store5=100) (atom "plas" 11 N) vector do (store5=100) (atom "plas" 12 N) vector do (store5=100) (atom "plas" 37 N) vector do (store5=100) (atom "plas" 44 N) vector do (store5=100) (atom "plas" 54 N) vector do (store5=100) (atom "plas" 62 N) vector do (store5=100) (atom "plas" 63 N) vector do (store5=100) (atom "plas" 85 N) vector do (store5=100) (atom "plas" 87 N) vector do (store5=100) (atom "plas" 88 N) vector do (store5=100) (atom "plas" 89 N) ! file: CS_values.xpl ! storing paramagnetic shifts in store2-property, part of pcf.inp ! M.UBBINK 22.11.2007 ! Prochlorothrix hollandica wt Pc data, Rinske Hulsker !-------ENTER ALL ATOMS WITH POSITIVE PCS----------- vector do (store2=0.141) (atom "plas" 8 HN) vector do (store2=0.202) (atom "plas" 9 HN) vector do (store2=0.126) (atom "plas" 10 HN) vector do (store2=0.173) (atom "plas" 11 HN) vector do (store2=0.251) (atom "plas" 12 HN) vector do (store2=0.289) (atom "plas" 13 HN) vector do (store2=0.192) (atom "plas" 15 HN) vector do (store2=0.112) (atom "plas" 16 HN) vector do (store2=0.081) (atom "plas" 17 HN) vector do (store2=0.085) (atom "plas" 34 HN) vector do (store2=0.170) (atom "plas" 37 HN) vector do (store2=0.132) (atom "plas" 39 HN) vector do (store2=0.068) (atom "plas" 57 HN) vector do (store2=0.055) (atom "plas" 61 HN) vector do (store2=0.086) (atom "plas" 62 HN) vector do (store2=0.088) (atom "plas" 88 HN) vector do (store2=0.064) (atom "plas" 89 HN) vector do (store2=0.097) (atom "plas" 90 HN) vector do (store2=0.159) (atom "plas" 8 N) vector do (store2=0.157) (atom "plas" 9 N) vector do (store2=0.152) (atom "plas" 10 N) vector do (store2=0.183) (atom "plas" 11 N) vector do (store2=0.466) (atom "plas" 12 N) vector do (store2=0.500) (atom "plas" 13 N) vector do (store2=0.236) (atom "plas" 15 N) vector do (store2=0.102) (atom "plas" 16 N) vector do (store2=0.114) (atom "plas" 17 N) vector do (store2=0.090) (atom "plas" 32 N) vector do (store2=0.122) (atom "plas" 34 N) vector do (store2=0.177) (atom "plas" 37 N) vector do (store2=0.188) (atom "plas" 39 N) vector do (store2=0.110) (atom "plas" 57 N) vector do (store2=0.124) (atom "plas" 61 N) vector do (store2=0.126) (atom "plas" 62 N) vector do (store2=0.120) (atom "plas" 89 N) vector do (store2=0.136) (atom "plas" 90 N) !-------ENTER ALL ATOMS WITH NEGATIVE PCS----------- !-------ENTER ALL OBSERVED ATOMS WITH NO PCS----------- vector do (store4=100.0) (atom "plas" 2 N) vector do (store4=100.0) (atom "plas" 2 HN) vector do (store4=100.0) (atom "plas" 3 N) vector do (store4=100.0) (atom "plas" 3 HN) vector do (store4=100.0) (atom "plas" 20 N) vector do (store4=100.0) (atom "plas" 20 HN) vector do (store4=100.0) (atom "plas" 21 N) vector do (store4=100.0) (atom "plas" 21 HN) vector do (store4=100.0) (atom "plas" 22 N) vector do (store4=100.0) (atom "plas" 22 HN) vector do (store4=100.0) (atom "plas" 23 N) vector do (store4=100.0) (atom "plas" 23 HN) vector do (store4=100.0) (atom "plas" 24 N) vector do (store4=100.0) (atom "plas" 24 HN) vector do (store4=100.0) (atom "plas" 25 N) vector do (store4=100.0) (atom "plas" 25 HN) vector do (store4=100.0) (atom "plas" 26 N) vector do (store4=100.0) (atom "plas" 26 HN) vector do (store4=100.0) (atom "plas" 27 N) vector do (store4=100.0) (atom "plas" 27 HN) vector do (store4=100.0) (atom "plas" 28 N) vector do (store4=100.0) (atom "plas" 28 HN) vector do (store4=100.0) (atom "plas" 29 N) vector do (store4=100.0) (atom "plas" 29 HN) vector do (store4=100.0) (atom "plas" 30 N) vector do (store4=100.0) (atom "plas" 30 HN) vector do (store4=100.0) (atom "plas" 31 N) vector do (store4=100.0) (atom "plas" 31 HN) vector do (store4=100.0) (atom "plas" 33 N) vector do (store4=100.0) (atom "plas" 33 HN) vector do (store4=100.0) (atom "plas" 40 N) vector do (store4=100.0) (atom "plas" 40 HN) vector do (store4=100.0) (atom "plas" 42 N) vector do (store4=100.0) (atom "plas" 43 N) vector do (store4=100.0) (atom "plas" 43 HN) vector do (store4=100.0) (atom "plas" 44 N) vector do (store4=100.0) (atom "plas" 44 HN) vector do (store4=100.0) (atom "plas" 45 N) vector do (store4=100.0) (atom "plas" 45 HN) vector do (store4=100.0) (atom "plas" 48 N) vector do (store4=100.0) (atom "plas" 48 HN) vector do (store4=100.0) (atom "plas" 49 N) vector do (store4=100.0) (atom "plas" 49 HN) vector do (store4=100.0) (atom "plas" 50 N) vector do (store4=100.0) (atom "plas" 50 HN) vector do (store4=100.0) (atom "plas" 51 N) vector do (store4=100.0) (atom "plas" 51 HN) vector do (store4=100.0) (atom "plas" 52 N) vector do (store4=100.0) (atom "plas" 52 HN) vector do (store4=100.0) (atom "plas" 54 N) vector do (store4=100.0) (atom "plas" 54 HN) vector do (store4=100.0) (atom "plas" 55 N) vector do (store4=100.0) (atom "plas" 55 HN) vector do (store4=100.0) (atom "plas" 56 N) vector do (store4=100.0) (atom "plas" 56 HN) vector do (store4=100.0) (atom "plas" 58 N) vector do (store4=100.0) (atom "plas" 58 HN) vector do (store4=100.0) (atom "plas" 59 N) vector do (store4=100.0) (atom "plas" 59 HN) vector do (store4=100.0) (atom "plas" 68 N) vector do (store4=100.0) (atom "plas" 68 HN) vector do (store4=100.0) (atom "plas" 69 N) vector do (store4=100.0) (atom "plas" 69 HN) vector do (store4=100.0) (atom "plas" 70 N) vector do (store4=100.0) (atom "plas" 70 HN) vector do (store4=100.0) (atom "plas" 71 N) vector do (store4=100.0) (atom "plas" 71 HN) vector do (store4=100.0) (atom "plas" 72 N) vector do (store4=100.0) (atom "plas" 72 HN) vector do (store4=100.0) (atom "plas" 73 N) vector do (store4=100.0) (atom "plas" 73 HN) vector do (store4=100.0) (atom "plas" 74 N) vector do (store4=100.0) (atom "plas" 74 HN) vector do (store4=100.0) (atom "plas" 76 N) vector do (store4=100.0) (atom "plas" 76 HN) vector do (store4=100.0) (atom "plas" 77 N) vector do (store4=100.0) (atom "plas" 77 HN) vector do (store4=100.0) (atom "plas" 78 N) vector do (store4=100.0) (atom "plas" 78 HN) vector do (store4=100.0) (atom "plas" 79 N) vector do (store4=100.0) (atom "plas" 79 HN) vector do (store4=100.0) (atom "plas" 80 N) vector do (store4=100.0) (atom "plas" 82 N) vector do (store4=100.0) (atom "plas" 82 HN) vector do (store4=100.0) (atom "plas" 93 N) vector do (store4=100.0) (atom "plas" 93 HN) vector do (store4=100.0) (atom "plas" 94 N) vector do (store4=100.0) (atom "plas" 94 HN) vector do (store4=100.0) (atom "plas" 95 N) vector do (store4=100.0) (atom "plas" 95 HN) vector do (store4=100.0) (atom "plas" 96 N) vector do (store4=100.0) (atom "plas" 96 HN) vector do (store4=100.0) (atom "plas" 97 N) vector do (store4=100.0) (atom "plas" 97 HN)
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