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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10727 |
1q6b   |
5824 | cing | 1-original | 7 | XPLOR/CNS | distance | NOE | ambi |
! pck2xplr.nawk Table; Input File: n15_ambig.PCK ! Date: Wed Aug 6 10:36:29 CDT 2003 ! Path: /home/vakon/NMR_data/KaiA/Th180C/Structure/analysis/noe ! !@ BEGIN_XPLR_PCK_SUM ! LBL File-Name All Intra Seq. Short Long ! A n15_ambig.PCK 55 12 18 19 6 ! Total 55 12 18 19 6 !@ END_XPLR_PCK_SUM !@ BEGIN_XPLR_NOE_FILE ! ! SEGID a ! K12 assign (resid 12 and name HA or resid 38 and name HB2) (resid 15 and name HN or resid 40 and name HN) 3.0 1.2 0.5 ! A.479 ! L13 ! L14 assign (resid 14 and name HN ) (resid 14 and name HB2 or resid 13 and name HB2 ) 2.5 0.7 0.4 ! A.426 at 2.18e+08 assign (resid 14 and name HA or resid 11 and name HA) (resid 15 and name HN ) 4.0 2.2 1.0 ! A.484 at 4.18e+07 ! D15 assign (resid 15 and name HN or resid 40 and name HN) (resid 17 and name HB2 or resid 38 and name HB2) 4.0 2.2 1.0 ! A.475 ! E16 ! L17 ! R18 assign (resid 18 and name HA or resid 17 and name HA ) (resid 21 and name HN ) 4.0 2.2 1.0 ! A.20 at 5.92e+07 ! S19 ! I20 assign (resid 20 and name HN ) (resid 20 and name HB or resid 20 and name HG11 ) 2.5 0.7 0.4 ! A.145 at 3.37e+08 ! Y21 assign (resid 21 and name HA or resid 22 and name HA ) (resid 25 and name HN ) 3.0 1.2 0.5 ! A.741 at 7.96e+07 ! R22 assign (resid 22 and name HG1 or resid 24 and name HB ) (resid 23 and name HN ) 3.0 1.2 0.5 ! A.217 at 6.96e+07 assign (resid 22 and name HN ) (resid 63 and name HD* ) 3.0 1.2 1.0 ! A.781 at 9.54e+07 ! T23 ! I24 assign (resid 24 and name HN or resid 26 and name HN) (resid 25 and name HN ) 2.5 0.7 0.4 ! A.748 at 2.28e+08 assign (resid 24 and name HA or resid 25 and name HA) (resid 27 and name HN ) 4.0 2.2 1.0 ! A.796 at 4.87e+07 assign (resid 24 and name HA or resid 25 and name HA) (resid 28 and name HN ) 4.0 2.2 1.0 ! A.512 at 5.87e+07 assign (resid 24 and name HG12 or resid 24 and name HD1# ) (resid 38 and name HN ) 4.0 2.2 1.5 ! A.313 at 3.66e+07 assign (resid 24 and name HD1# or resid 24 and name HG11 ) (resid 39 and name HN ) 3.0 1.2 1.0 ! A.413 at 1.16e+08 ! V25 assign (resid 25 and name HN or resid 27 and name HN) (resid 26 and name HN ) 2.5 0.7 0.4 ! A.703 at 1.95e+08 ! L26 assign (resid 26 and name HN ) (resid 26 and name HD* ) 3.0 1.2 1.0 ! A.709 at 1.77e+08 assign (resid 26 and name HD2# or resid 35 and name HG2# ) (resid 27 and name HN ) 4.0 2.2 1.5 ! A.791 at 4.58e+07 ! E27 ! Y28 ! F29 assign (resid 29 and name HN ) (resid 29 and name HB1 or resid 28 and name HB2 ) 3.0 1.2 0.5 ! A.176 at -1.55e+08 ! N30 ! T31 ! D32 ! A33 ! K34 ! V35 ! N36 ! E37 ! R38 assign (resid 38 and name HN ) (resid 39 and name HD1# or resid 39 and name HG12 ) 4.0 2.2 1.5 ! A.312 at 3.13e+07 assign (resid 38 and name HN ) (resid 40 and name HB1 or resid 36 and name HB1 ) 4.0 2.2 2.0 ! A.308 at 1.63e+07 ! I39 assign (resid 39 and name HN ) (resid 39 and name HG12 or resid 39 and name HD1# ) 3.0 1.2 0.5 ! A.414 at 1.52e+08 assign (resid 39 and name HN or resid 85 and name HN) (resid 41 and name HN or resid 83 and name HN) 4.0 2.2 1.0 ! A.411 ! D40 ! E41 ! F42 ! V43 ! S44 ! K45 ! A46 ! F47 ! F48 assign (resid 48 and name HN ) (resid 49 and name HB# or resid 51 and name HG11) 4.0 2.2 2.5 ! A.451 at 1.78e+07 ! A49 assign (resid 49 and name HA or resid 48 and name HA) (resid 50 and name HN ) 3.0 1.2 0.5 ! A.698 at 7.88e+07 ! D50 ! I51 ! S52 assign (resid 52 and name HB2 or resid 54 and name HA ) (resid 55 and name HN ) 3.0 1.2 0.5 ! A.588 at 9.97e+07 ! V53 assign (resid 53 and name HN ) (resid 53 and name HB or resid 297 and name HG2) 3.0 1.2 0.5 ! A.32 at 1.01e+08 ! S54 ! Q55 ! V56 assign (resid 56 and name HG1# or resid 59 and name HG2#) (resid 60 and name HN ) 3.0 1.2 1.0 ! A.674 at 9.07e+07 ! L57 ! E58 assign (resid 58 and name HN ) (resid 58 and name HB2 or resid 58 and name HG2 ) 2.5 0.7 0.4 ! A.726 at 3.21e+08 assign (resid 58 and name HB2 or resid 61 and name HB) (resid 60 and name HN ) 4.0 2.2 1.0 ! A.671 at 2.55e+07 ! I59 ! H60 assign (resid 60 and name HA or resid 63 and name HA) (resid 64 and name HN ) 3.0 1.2 0.5 ! A.81 at 7.53e+07 ! V61 assign (resid 61 and name HG1# or resid 81 and name HD1#) (resid 65 and name HN ) 4.0 2.2 2.5 ! A.357 at 2.14e+07 ! E62 assign (resid 62 and name HN ) (resid 62 and name HB1 or resid 61 and name HB) 2.5 0.7 0.4 ! A.434 at 4.75e+08 assign (resid 62 and name HB1 or resid 62 and name HG2) (resid 66 and name HN ) 4.0 2.2 2.0 ! A.812 at 2.15e+07 ! L63 assign (resid 63 and name HN ) (resid 63 and name HD2# or resid 59 and name HG2#) 3.0 1.2 1.0 ! A.526 at 1.25e+08 ! M64 ! D65 assign (resid 65 and name HN ) (resid 66 and name HN or resid 63 and name HN) 3.0 1.2 0.5 ! A.353 at 1.17e+08 ! T66 assign (resid 66 and name HA or resid 63 and name HA) (resid 67 and name HN ) 3.0 1.2 0.5 ! A.134 at 8.15e+07 ! F67 ! S68 ! K69 ! Q70 ! L71 ! K72 ! L73 assign (resid 73 and name HN ) (resid 73 and name HD* ) 4.0 2.2 1.5 ! A.546 at 4.97e+07 ! E74 ! G75 ! R76 ! S77 ! E78 assign (resid 78 and name HA or resid 81 and name HA) (resid 81 and name HN ) 4.0 2.2 1.0 ! A.652 at 4.39e+07 ! D79 ! I80 ! L81 assign (resid 81 and name HA or resid 78 and name HA) (resid 82 and name HN ) 3.0 1.2 0.5 ! A.613 at 7.19e+07 assign (resid 81 and name HN ) (resid 82 and name HN or resid 83 and name HN ) 4.0 2.2 1.0 ! A.653 at 4.56e+07 ! L82 ! D83 ! Y84 ! R85 assign (resid 85 and name HA or resid 88 and name HA) (resid 89 and name HN ) 4.0 2.2 1.0 ! A.724 at 4.98e+07 assign (resid 85 and name HD2# or resid 253 and name HG1#) (resid 94 and name HN ) 4.0 2.2 1.5 ! A.819 at 2.62e+07 ! L86 ! T87 assign (resid 87 and name HG2# or resid 88 and name HD2#) (resid 88 and name HN ) 3.0 1.2 1.0 ! A.285 at 8.03e+07 ! L88 assign (resid 88 and name HN ) (resid 89 and name HG11 or resid 89 and name HB) 4.0 2.2 1.0 ! A.280 at 2.88e+07 ! I89 assign (resid 89 and name HN) (resid 89 and name HG2# or resid 89 and name HD1# or resid 289 and name HD1#) 3.0 1.2 1.0 ! A.720 ! D90 ! V91 ! I92 ! A93 ! H94 ! L95 assign (resid 95 and name HA or resid 93 and name HA) (resid 96 and name HN ) 3.0 1.2 0.5 ! A.40 at 9.12e+07 ! C96 ! E97 ! M98 assign (resid 98 and name HN or resid 99 and name HD#) (resid 99 and name HN ) 2.5 0.7 0.4 ! A.756 at 1.81e+08 assign (resid 98 and name HN or resid 299 and name HB1) (resid 100 and name HN ) 4.0 2.2 1.0 ! A.380 at 5.87e+07 ! Y99 assign (resid 99 and name HB1 or resid 299 and name HB1) (resid 100 and name HN ) 4.0 2.2 1.0 ! A.374 at 5.25e+07 ! R100 assign (resid 100 and name HN ) (resid 103 and name HB or resid 101 and name HB2) 4.0 2.2 2.0 ! A.375 at 2.01e+07 ! R101 assign (resid 101 and name HG2 or resid 98 and name HB2) (resid 102 and name HN ) 4.0 2.2 1.0 ! A.204 at 3.50e+07 ! I103 assign (resid 103 and name HN) (resid 104 and name HD1 or resid 304 and name HD1) 4.0 2.2 1.0 ! A.848 at 5.49e+07 assign (resid 103 and name HN) (resid 104 and name HD2 or resid 304 and name HD2) 4.0 2.2 1.0 ! A.847 at 2.69e+07 ! SEGID b ! K12 assign (resid 212 and name HA or resid 238 and name HB2) (resid 215 and name HN or resid 240 and name HN) 3.0 1.2 0.5 ! A.479 ! L13 ! L14 assign (resid 214 and name HN ) (resid 214 and name HB2 or resid 213 and name HB2 ) 2.5 0.7 0.4 ! A.426 at 2.18e+08 assign (resid 214 and name HA or resid 211 and name HA) (resid 215 and name HN ) 4.0 2.2 1.0 ! A.484 at 4.18e+07 ! D15 assign (resid 215 and name HN or resid 240 and name HN) (resid 217 and name HB2 or resid 38 and name HB2) 4.0 2.2 1.0 ! A.475 ! E16 ! L17 ! R18 assign (resid 218 and name HA or resid 217 and name HA ) (resid 221 and name HN ) 4.0 2.2 1.0 ! A.20 at 5.92e+07 ! S19 ! I20 assign (resid 220 and name HN ) (resid 220 and name HB or resid 220 and name HG11 ) 2.5 0.7 0.4 ! A.145 at 3.37e+08 ! Y21 assign (resid 221 and name HA or resid 222 and name HA ) (resid 225 and name HN ) 3.0 1.2 0.5 ! A.741 at 7.96e+07 ! R22 assign (resid 222 and name HG1 or resid 224 and name HB ) (resid 223 and name HN ) 3.0 1.2 0.5 ! A.217 at 6.96e+07 assign (resid 222 and name HN ) (resid 263 and name HD* ) 3.0 1.2 1.0 ! A.781 at 9.54e+07 ! T23 ! I24 assign (resid 224 and name HN or resid 226 and name HN) (resid 225 and name HN ) 2.5 0.7 0.4 ! A.748 at 2.28e+08 assign (resid 224 and name HA or resid 225 and name HA) (resid 227 and name HN ) 4.0 2.2 1.0 ! A.796 at 4.87e+07 assign (resid 224 and name HA or resid 225 and name HA) (resid 228 and name HN ) 4.0 2.2 1.0 ! A.512 at 5.87e+07 assign (resid 224 and name HG12 or resid 224 and name HD1# ) (resid 238 and name HN ) 4.0 2.2 1.5 ! A.313 at 3.66e+07 assign (resid 224 and name HD1# or resid 224 and name HG11 ) (resid 239 and name HN ) 3.0 1.2 1.0 ! A.413 at 1.16e+08 ! V25 assign (resid 225 and name HN or resid 227 and name HN) (resid 226 and name HN ) 2.5 0.7 0.4 ! A.703 at 1.95e+08 ! L26 assign (resid 226 and name HN ) (resid 226 and name HD* ) 3.0 1.2 1.0 ! A.709 at 1.77e+08 assign (resid 226 and name HD2# or resid 235 and name HG2# ) (resid 227 and name HN ) 4.0 2.2 1.5 ! A.791 at 4.58e+07 ! E27 ! Y28 ! F29 assign (resid 229 and name HN ) (resid 229 and name HB1 or resid 228 and name HB2 ) 3.0 1.2 0.5 ! A.176 at -1.55e+08 ! N30 ! T31 ! D32 ! A33 ! K34 ! V35 ! N36 ! E37 ! R38 assign (resid 238 and name HN ) (resid 239 and name HD1# or resid 239 and name HG12 ) 4.0 2.2 1.5 ! A.312 at 3.13e+07 assign (resid 238 and name HN ) (resid 240 and name HB1 or resid 236 and name HB1 ) 4.0 2.2 2.0 ! A.308 at 1.63e+07 ! I39 assign (resid 239 and name HN ) (resid 239 and name HG12 or resid 239 and name HD1# ) 3.0 1.2 0.5 ! A.414 at 1.52e+08 assign (resid 239 and name HN or resid 285 and name HN) (resid 241 and name HN or resid 83 and name HN) 4.0 2.2 1.0 ! A.411 ! D40 ! E41 ! F42 ! V43 ! S44 ! K45 ! A46 ! F47 ! F48 assign (resid 248 and name HN ) (resid 249 and name HB# or resid 251 and name HG11) 4.0 2.2 2.5 ! A.451 at 1.78e+07 ! A49 assign (resid 249 and name HA or resid 248 and name HA) (resid 250 and name HN ) 3.0 1.2 0.5 ! A.698 at 7.88e+07 ! D50 ! I51 ! S52 assign (resid 252 and name HB2 or resid 254 and name HA ) (resid 255 and name HN ) 3.0 1.2 0.5 ! A.588 at 9.97e+07 ! V53 assign (resid 253 and name HN ) (resid 253 and name HB or resid 97 and name HG2) 3.0 1.2 0.5 ! A.32 at 1.01e+08 ! S54 ! Q55 ! V56 assign (resid 256 and name HG1# or resid 259 and name HG2#) (resid 260 and name HN ) 3.0 1.2 1.0 ! A.674 at 9.07e+07 ! L57 ! E58 assign (resid 258 and name HN ) (resid 258 and name HB2 or resid 258 and name HG2 ) 2.5 0.7 0.4 ! A.726 at 3.21e+08 assign (resid 258 and name HB2 or resid 261 and name HB) (resid 260 and name HN ) 4.0 2.2 1.0 ! A.671 at 2.55e+07 ! I59 ! H60 assign (resid 260 and name HA or resid 263 and name HA) (resid 264 and name HN ) 3.0 1.2 0.5 ! A.81 at 7.53e+07 ! V61 assign (resid 261 and name HG1# or resid 281 and name HD1#) (resid 265 and name HN ) 4.0 2.2 2.5 ! A.357 at 2.14e+07 ! E62 assign (resid 262 and name HN ) (resid 262 and name HB1 or resid 261 and name HB) 2.5 0.7 0.4 ! A.434 at 4.75e+08 assign (resid 262 and name HB1 or resid 262 and name HG2) (resid 266 and name HN ) 4.0 2.2 2.0 ! A.812 at 2.15e+07 ! L63 assign (resid 263 and name HN ) (resid 263 and name HD2# or resid 259 and name HG2#) 3.0 1.2 1.0 ! A.526 at 1.25e+08 ! M64 ! D65 assign (resid 265 and name HN ) (resid 266 and name HN or resid 263 and name HN) 3.0 1.2 0.5 ! A.353 at 1.17e+08 ! T66 assign (resid 266 and name HA or resid 263 and name HA) (resid 267 and name HN ) 3.0 1.2 0.5 ! A.134 at 8.15e+07 ! F67 ! S68 ! K69 ! Q70 ! L71 ! K72 ! L73 assign (resid 273 and name HN ) (resid 273 and name HD* ) 4.0 2.2 1.5 ! A.546 at 4.97e+07 ! E74 ! G75 ! R76 ! S77 ! E78 assign (resid 278 and name HA or resid 281 and name HA) (resid 281 and name HN ) 4.0 2.2 1.0 ! A.652 at 4.39e+07 ! D79 ! I80 ! L81 assign (resid 281 and name HA or resid 278 and name HA) (resid 282 and name HN ) 3.0 1.2 0.5 ! A.613 at 7.19e+07 assign (resid 281 and name HN ) (resid 282 and name HN or resid 283 and name HN ) 4.0 2.2 1.0 ! A.653 at 4.56e+07 ! L82 ! D83 ! Y84 ! R85 assign (resid 285 and name HA or resid 288 and name HA) (resid 289 and name HN ) 4.0 2.2 1.0 ! A.724 at 4.98e+07 assign (resid 285 and name HD2# or resid 53 and name HG1#) (resid 294 and name HN ) 4.0 2.2 1.5 ! A.819 at 2.62e+07 ! L86 ! T87 assign (resid 287 and name HG2# or resid 288 and name HD2#) (resid 288 and name HN ) 3.0 1.2 1.0 ! A.285 at 8.03e+07 ! L88 assign (resid 288 and name HN ) (resid 289 and name HG11 or resid 289 and name HB) 4.0 2.2 1.0 ! A.280 at 2.88e+07 ! I89 assign (resid 289 and name HN ) (resid 289 and name HG2# or resid 289 and name HD1# or resid 89 and name HD1#) 3.0 1.2 1.0 ! A.720 at 1.45e+08 ! D90 ! V91 ! I92 ! A93 ! H94 ! L95 assign (resid 295 and name HA or resid 293 and name HA) (resid 296 and name HN ) 3.0 1.2 0.5 ! A.40 at 9.12e+07 ! C96 ! E97 ! M98 assign (resid 298 and name HN or resid 299 and name HD#) (resid 299 and name HN ) 2.5 0.7 0.4 ! A.756 at 1.81e+08 assign (resid 298 and name HN or resid 99 and name HB1) (resid 300 and name HN ) 4.0 2.2 1.0 ! A.380 at 5.87e+07 ! Y99 assign (resid 299 and name HB1 or resid 99 and name HB1) (resid 300 and name HN ) 4.0 2.2 1.0 ! A.374 at 5.25e+07 ! R100 assign (resid 300 and name HN ) (resid 303 and name HB or resid 301 and name HB2) 4.0 2.2 2.0 ! A.375 at 2.01e+07 ! R101 assign (resid 301 and name HG2 or resid 298 and name HB2) (resid 302 and name HN ) 4.0 2.2 1.0 ! A.204 at 3.50e+07 ! I103 assign (resid 103 and name HN) (resid 104 and name HD1 or resid 304 and name HD1) 4.0 2.2 1.0 ! A.848 at 5.49e+07 assign (resid 103 and name HN) (resid 104 and name HD2 or resid 304 and name HD2) 4.0 2.2 1.0 ! A.847 at 2.69e+07
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