NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
20697 | 2gbh | cing | 1-original | 5 | XPLOR/CNS | dipolar coupling |
! C5'-(H5'+H5'') sum RDC restraints ! Emeric's sum values scaled by 1.2 DLB Aug 18 2004 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name C5' ) ( resid 2 and (name H5' or name H5'') ) -20.11 2.0 2.0 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name C5' ) ( resid 3 and (name H5' or name H5'') ) -12.85 2.0 2.0 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name C5' ) ( resid 4 and (name H5' or name H5'') ) -17.92 2.0 2.0 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name C5' ) ( resid 7 and (name H5' or name H5'') ) -42.82 2.0 2.0 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name C5' ) ( resid 8 and (name H5' or name H5'') ) -44.86 2.0 2.0 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name C5' ) ( resid 17 and (name H5' or name H5'') ) -16.42 2.0 2.0 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name C5' ) ( resid 21 and (name H5' or name H5'') ) -36.17 2.0 2.0 ! RDC restraints are below ! one-bond C-H ribose RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name C1' ) -29.800 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H1' ) ( resid 3 and name C1' ) -37.000 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name C1' ) -34.200 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H1' ) ( resid 5 and name C1' ) -21.800 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H1' ) ( resid 6 and name C1' ) -12.400 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H1' ) ( resid 7 and name C1' ) -4.500 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name C1' ) 1.000 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H1' ) ( resid 17 and name C1' ) -23.500 1.300 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H1' ) ( resid 18 and name C1' ) -17.800 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H1' ) ( resid 19 and name C1' ) -6.700 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H1' ) ( resid 20 and name C1' ) -0.300 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H1' ) ( resid 21 and name C1' ) -0.500 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H1' ) ( resid 22 and name C1' ) -3.200 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H1' ) ( resid 23 and name C1' ) -8.500 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H2'' ) ( resid 2 and name C2' ) 12.100 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H2'' ) ( resid 3 and name C2' ) 11.300 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H2'' ) ( resid 4 and name C2' ) 8.300 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H2'' ) ( resid 5 and name C2' ) 0.800 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H2'' ) ( resid 6 and name C2' ) -1.100 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H2'' ) ( resid 7 and name C2' ) -5.400 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H2'' ) ( resid 8 and name C2' ) -1.200 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H2'' ) ( resid 18 and name C2' ) -9.700 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H2'' ) ( resid 19 and name C2' ) -3.400 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H2'' ) ( resid 20 and name C2' ) 6.200 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H2'' ) ( resid 21 and name C2' ) 13.600 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H2'' ) ( resid 22 and name C2' ) 13.500 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H2'' ) ( resid 23 and name C2' ) 13.600 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H3' ) ( resid 2 and name C3' ) 13.270 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H3' ) ( resid 3 and name C3' ) 8.560 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H3' ) ( resid 4 and name C3' ) -3.400 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H3' ) ( resid 5 and name C3' ) -2.970 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H3' ) ( resid 6 and name C3' ) 2.530 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H3' ) ( resid 7 and name C3' ) 13.700 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H3' ) ( resid 8 and name C3' ) 22.520 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H3' ) ( resid 18 and name C3' ) 4.860 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H3' ) ( resid 19 and name C3' ) 11.480 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H3' ) ( resid 20 and name C3' ) 12.240 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H3' ) ( resid 21 and name C3' ) 16.100 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H3' ) ( resid 22 and name C3' ) 21.590 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H3' ) ( resid 23 and name C3' ) 26.550 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H4' ) ( resid 2 and name C4' ) 19.83 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H4' ) ( resid 3 and name C4' ) 19.24 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H4' ) ( resid 4 and name C4' ) 9.61 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H4' ) ( resid 5 and name C4' ) 4.92 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H4' ) ( resid 6 and name C4' ) 6.28 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H4' ) ( resid 7 and name C4' ) 14.25 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H4' ) ( resid 8 and name C4' ) 25.12 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H4' ) ( resid 18 and name C4' ) 15.01 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H4' ) ( resid 19 and name C4' ) 17.14 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H4' ) ( resid 20 and name C4' ) 14.80 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H4' ) ( resid 21 and name C4' ) 14.43 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H4' ) ( resid 22 and name C4' ) 18.63 0.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H4' ) ( resid 23 and name C4' ) 25.06 0.00 ! one-bond base C-H RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H2 ) ( resid 6 and name C2 ) 27.263 0.444 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H2 ) ( resid 7 and name C2 ) 28.340 0.430 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H2 ) ( resid 17 and name C2 ) 16.799 0.453 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H2 ) ( resid 20 and name C2 ) 22.442 0.447 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name C5 ) ( resid 4 and name H5 ) 3.296 0.099 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name C5 ) ( resid 5 and name H5 ) 11.777 0.079 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name C5 ) ( resid 8 and name H5 ) 26.712 0.103 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name C5 ) ( resid 18 and name H5 ) 15.588 0.098 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name C5 ) ( resid 19 and name H5 ) 14.818 0.118 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name C5 ) ( resid 22 and name H5 ) 28.616 0.079 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name C5 ) ( resid 23 and name H5 ) 24.496 0.090 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name C6 ) ( resid 4 and name H6 ) 22.338 0.289 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name C6 ) ( resid 5 and name H6 ) 29.321 0.364 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name C6 ) ( resid 8 and name H6 ) 15.315 0.577 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name C6 ) ( resid 18 and name H6 ) 19.613 0.498 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name C6 ) ( resid 19 and name H6 ) 27.063 0.444 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name C6 ) ( resid 22 and name H6 ) 9.912 0.250 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name C6 ) ( resid 23 and name H6 ) 1.135 0.296 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H8 ) ( resid 2 and name C8 ) 3.474 0.683 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H8 ) ( resid 3 and name C8 ) 6.332 0.543 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H8 ) ( resid 6 and name C8 ) 28.000 0.600 1 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H8 ) ( resid 7 and name C8 ) 23.382 0.563 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H8 ) ( resid 17 and name C8 ) 11.439 0.727 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H8 ) ( resid 20 and name C8 ) 28.000 0.600 1 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H8 ) ( resid 21 and name C8 ) 27.583 0.563 ! base C4-C5 RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name C5 ) ( resid 5 and name C4 ) 2.875 0.141 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name C5 ) ( resid 8 and name C4 ) 1.281 0.198 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name C5 ) ( resid 18 and name C4 ) 2.280 0.197 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name C5 ) ( resid 19 and name C4 ) 2.872 0.156 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name C5 ) ( resid 4 and name C4 ) 2.109 0.197 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name C5 ) ( resid 22 and name C4 ) 1.086 0.139 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name C5 ) ( resid 23 and name C4 ) 0.375 0.156 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name C4 ) ( resid 6 and name C5 ) 1.78 0.078 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name C4 ) ( resid 7 and name C5 ) 2.82 0.078 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name C4 ) ( resid 17 and name C5 ) 2.88 0.136 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name C4 ) ( resid 20 and name C5 ) 1.79 0.078 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name C4 ) ( resid 2 and name C5 ) 3.06 0.408 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name C4 ) ( resid 3 and name C5 ) 3.005 0.193 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name C4 ) ( resid 21 and name C5 ) 1.78 0.078 ! base C5-C6 RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name C5 ) ( resid 5 and name C6 ) 2.188 0.128 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name C5 ) ( resid 8 and name C6 ) 2.807 0.204 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name C5 ) ( resid 18 and name C6 ) 3.260 0.181 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name C5 ) ( resid 19 and name C6 ) 3.453 0.142 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name C5 ) ( resid 4 and name C6 ) 3.139 0.179 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name C5 ) ( resid 22 and name C6 ) 1.419 0.129 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name C5 ) ( resid 23 and name C6 ) 2.246 0.143 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name C5 ) ( resid 6 and name C6 ) 1.97 0.130 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name C5 ) ( resid 7 and name C6 ) 1.66 0.131 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name C5 ) ( resid 17 and name C6 ) 1.31 0.078 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name C5 ) ( resid 20 and name C6 ) 2.67 0.071 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name C5 ) ( resid 2 and name C6 ) 0.62 0.599 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name C5 ) ( resid 3 and name C6 ) 1.98 0.301 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name C5 ) ( resid 21 and name C6 ) 1.87 0.127 ! base C4-H5 RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H5 ) ( resid 4 and name C4 ) 1.220 0.218 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H5 ) ( resid 22 and name C4 ) 3.147 0.196 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H5 ) ( resid 23 and name C4 ) 1.365 0.184 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H5 ) ( resid 5 and name C4 ) 2.499 0.175 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H5 ) ( resid 8 and name C4 ) 1.892 0.235 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H5 ) ( resid 18 and name C4 ) 1.77 0.232 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H5 ) ( resid 19 and name C4 ) 2.625 0.191 ! base C5-H6 and C6-H5 RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H5 ) ( resid 4 and name C6 ) 1.841 0.214 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H5 ) ( resid 5 and name C6 ) 1.700 0.154 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H5 ) ( resid 8 and name C6 ) 3.700 0.240 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H5 ) ( resid 18 and name C6 ) 2.91 0.222 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H5 ) ( resid 19 and name C6 ) 2.711 0.174 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H5 ) ( resid 22 and name C6 ) 3.009 0.174 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H5 ) ( resid 23 and name C6 ) 3.732 0.169 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 24 and name H5 ) ( resid 24 and name C6 ) 2.916 0.156 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H6 ) ( resid 4 and name C5 ) 3.68 0.207 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H6 ) ( resid 5 and name C5 ) 4.019 0.227 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H6 ) ( resid 8 and name C5 ) 1.75 0.373 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H6 ) ( resid 18 and name C5 ) 3.505 0.298 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H6 ) ( resid 19 and name C5 ) 3.959 0.290 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H6 ) ( resid 22 and name C5 ) 0.139 0.199 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H6 ) ( resid 23 and name C5 ) 0.802 0.226 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 24 and name H6 ) ( resid 24 and name C5 ) 1.282 0.178 ! ribose H1'-H2'' RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name H2'' ) -4.500 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H1' ) ( resid 3 and name H2'' ) -5.800 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name H2'' ) -8.200 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H1' ) ( resid 5 and name H2'' ) -9.400 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H1' ) ( resid 6 and name H2'' ) -9.700 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H1' ) ( resid 7 and name H2'' )-10.900 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name H2'' ) -9.300 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H1' ) ( resid 17 and name H2'' ) -8.600 2.000 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H1' ) ( resid 18 and name H2'' )-10.300 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H1' ) ( resid 19 and name H2'' )-10.400 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H1' ) ( resid 20 and name H2'' ) -9.200 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H1' ) ( resid 21 and name H2'' ) -8.100 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H1' ) ( resid 22 and name H2'' ) -6.000 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H1' ) ( resid 23 and name H2'' ) -5.900 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 24 and name H1' ) ( resid 24 and name H2'' ) -4.100 0.100 ! ribose C2'-H1' and C1'-H2'' RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H2'' ) ( resid 2 and name C1' ) 1.100 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H2'' ) ( resid 3 and name C1' ) -0.900 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H2'' ) ( resid 4 and name C1' ) -2.200 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H2'' ) ( resid 5 and name C1' ) -2.600 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H2'' ) ( resid 6 and name C1' ) -3.100 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H2'' ) ( resid 7 and name C1' ) -4.000 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H2'' ) ( resid 8 and name C1' ) -4.100 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H2'' ) ( resid 17 and name C1' ) -2.400 1.500 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H2'' ) ( resid 18 and name C1' ) -4.500 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H2'' ) ( resid 19 and name C1' ) -4.700 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H2'' ) ( resid 20 and name C1' ) -3.700 0.300 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H2'' ) ( resid 21 and name C1' ) -3.100 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H2'' ) ( resid 22 and name C1' ) -0.900 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H2'' ) ( resid 23 and name C1' ) -0.600 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 24 and name H2'' ) ( resid 24 and name C1' ) -1.500 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H1' ) ( resid 2 and name C2' ) -4.900 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H1' ) ( resid 3 and name C2' ) -3.900 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H1' ) ( resid 4 and name C2' ) -4.000 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name H1' ) ( resid 5 and name C2' ) -3.700 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name H1' ) ( resid 6 and name C2' ) -4.200 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H1' ) ( resid 7 and name C2' ) -5.000 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H1' ) ( resid 8 and name C2' ) -4.800 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H1' ) ( resid 17 and name C2' ) -3.400 1.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name H1' ) ( resid 18 and name C2' ) -4.200 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name H1' ) ( resid 19 and name C2' ) -3.500 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name H1' ) ( resid 20 and name C2' ) -5.400 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H1' ) ( resid 21 and name C2' ) -5.000 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name H1' ) ( resid 22 and name C2' ) -4.900 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name H1' ) ( resid 23 and name C2' ) -4.400 0.100 ! ribose C1'-C2' RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name C1' ) ( resid 2 and name C2' ) -0.951 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name C1' ) ( resid 3 and name C2' ) -0.150 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name C1' ) ( resid 5 and name C2' ) -1.383 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name C1' ) ( resid 6 and name C2' ) -2.537 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name C1' ) ( resid 7 and name C2' ) -2.300 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name C1' ) ( resid 8 and name C2' ) -3.584 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name C1' ) ( resid 18 and name C2' ) -1.293 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name C1' ) ( resid 19 and name C2' ) -2.327 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name C1' ) ( resid 20 and name C2' ) -3.927 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name C1' ) ( resid 21 and name C2' ) -3.417 0.200 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name C1' ) ( resid 22 and name C2' ) -3.221 0.200 ! H5'-H5'' RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H5' ) ( resid 2 and name H5'' ) -16.38 4.61 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H5' ) ( resid 3 and name H5'' ) -9.88 4.10 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H5' ) ( resid 4 and name H5'' ) -22.61 10.00 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H5' ) ( resid 7 and name H5'' ) -31.74 7.20 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H5' ) ( resid 8 and name H5'' ) -39.34 5.78 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H5' ) ( resid 17 and name H5'' ) -12.44 7.44 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H5' ) ( resid 21 and name H5'' ) -32.87 4.14 ! H4'-H5' and H4'-H5'' RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H4' ) ( resid 2 and name H5' ) 5.08 1.05 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H4' ) ( resid 3 and name H5' ) 0.69 0.66 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H4' ) ( resid 8 and name H5' ) 3.09 1.14 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H4' ) ( resid 17 and name H5' ) 3.99 1.99 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H4' ) ( resid 21 and name H5' ) 4.43 1.09 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H4' ) ( resid 2 and name H5'' ) -0.79 1.08 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H4' ) ( resid 3 and name H5'' ) -4.28 0.78 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H4' ) ( resid 4 and name H5'' ) -4.19 0.92 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H4' ) ( resid 7 and name H5'' ) 7.46 0.86 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H4' ) ( resid 8 and name H5'' ) 7.65 0.85 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H4' ) ( resid 17 and name H5'' ) 1.20 2.97 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H4' ) ( resid 21 and name H5'' ) 3.46 0.68 ! H4'-C5' RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name H4' ) ( resid 2 and name C5' ) 1.65 0.87 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name H4' ) ( resid 3 and name C5' ) 1.16 2.24 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name H4' ) ( resid 4 and name C5' ) -2.13 2.53 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name H4' ) ( resid 7 and name C5' ) 0.79 1.42 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name H4' ) ( resid 8 and name C5' ) 4.41 2.40 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name H4' ) ( resid 17 and name C5' ) -0.91 2.21 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name H4' ) ( resid 21 and name C5' ) 2.47 2.19 base C-N RDCs assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name N1 ) ( resid 4 and name C1' ) 0.896 0.022 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name N1 ) ( resid 5 and name C1' ) 0.602 0.029 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name N1 ) ( resid 8 and name C1' ) 0.932 0.057 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name N1 ) ( resid 18 and name C1' ) 0.946 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name N1 ) ( resid 19 and name C1' ) 0.989 0.036 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name N1 ) ( resid 22 and name C1' ) 0.530 0.022 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name N1 ) ( resid 23 and name C1' ) 0.882 0.022 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 24 and name N1 ) ( resid 24 and name C1' ) 0.803 0.022 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name N9 ) ( resid 2 and name C1' ) 0.896 0.050 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name N9 ) ( resid 3 and name C1' ) 1.047 0.036 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name N9 ) ( resid 6 and name C1' ) 0.581 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name N9 ) ( resid 7 and name C1' ) 0.624 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name N9 ) ( resid 17 and name C1' ) 0.832 0.057 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name N9 ) ( resid 20 and name C1' ) 0.760 0.065 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name N9 ) ( resid 21 and name C1' ) 0.559 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name N9 ) ( resid 2 and name C8 ) 0.975 0.057 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name N9 ) ( resid 3 and name C8 ) 0.552 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name N1 ) ( resid 4 and name C6 ) 0.409 0.029 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name N1 ) ( resid 5 and name C6 ) 0.566 0.036 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name N9 ) ( resid 6 and name C8 ) 0.953 0.057 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name N9 ) ( resid 7 and name C8 ) 1.269 0.050 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name N1 ) ( resid 8 and name C6 ) 1.333 0.065 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name N9 ) ( resid 17 and name C8 ) 1.018 0.065 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name N1 ) ( resid 18 and name C6 ) 0.746 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name N1 ) ( resid 19 and name C6 ) 0.746 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name N9 ) ( resid 20 and name C8 ) 0.839 0.079 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name N9 ) ( resid 21 and name C8 ) 1.032 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name N1 ) ( resid 22 and name C6 ) 1.520 0.029 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name N1 ) ( resid 23 and name C6 ) 1.204 0.029 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 24 and name N1 ) ( resid 24 and name C6 ) 0.724 0.022 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 4 and name N1 ) ( resid 4 and name C2 ) 0.961 0.036 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 22 and name N1 ) ( resid 22 and name C2 ) 0.645 0.036 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 23 and name N1 ) ( resid 23 and name C2 ) 0.244 0.043 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 24 and name N1 ) ( resid 24 and name C2 ) 0.108 0.036 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 5 and name N1 ) ( resid 5 and name C2 ) 1.412 0.057 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 8 and name N1 ) ( resid 8 and name C2 ) 0.781 0.100 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 18 and name N1 ) ( resid 18 and name C2 ) 0.896 0.086 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 19 and name N1 ) ( resid 19 and name C2 ) 1.183 0.065 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 1 and name N9 ) ( resid 1 and name C4 ) 0.530 0.401 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 2 and name N9 ) ( resid 2 and name C4 ) 0.272 0.079 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 3 and name N9 ) ( resid 3 and name C4 ) 0.681 0.057 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 6 and name N9 ) ( resid 6 and name C4 ) 1.355 0.065 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 7 and name N9 ) ( resid 7 and name C4 ) 0.932 0.079 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 17 and name N9 ) ( resid 17 and name C4 ) 0.573 0.115 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 20 and name N9 ) ( resid 20 and name C4 ) 1.462 0.093 assign ( resid 500 and name OO ) ( resid 500 and name Z ) ( resid 500 and name X ) ( resid 500 and name Y ) ( resid 21 and name N9 ) ( resid 21 and name C4 ) 1.068 0.057
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