NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
569600 2mbg 17608 cing 1-original 4 XPLOR/CNS distance hydrogen bond simple


!Hbonds for helices
!Helix 1 194-201
!
assign (resid  194 and     name O    )(resid  198 and     name N    ) 0.0 0.0 3.3
assign (resid  194 and     name O    )(resid  198 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  195 and     name O    )(resid  199 and     name N    ) 0.0 0.0 3.3
assign (resid  195 and     name O    )(resid  199 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  196 and     name O    )(resid  200 and     name N    ) 0.0 0.0 3.3
assign (resid  196 and     name O    )(resid  200 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  197 and     name O    )(resid  201 and     name N    ) 0.0 0.0 3.3
assign (resid  197 and     name O    )(resid  201 and     name H   ) 0.0 0.0 2.3
!
!Helix 2 211-223
!
assign (resid  211 and     name O    )(resid  215 and     name N    ) 0.0 0.0 3.3
assign (resid  211 and     name O    )(resid  215 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  212 and     name O    )(resid  216 and     name N    ) 0.0 0.0 3.3
assign (resid  212 and     name O    )(resid  216 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  213 and     name O    )(resid  217 and     name N    ) 0.0 0.0 3.3
assign (resid  213 and     name O    )(resid  217 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  214 and     name O    )(resid  218 and     name N    ) 0.0 0.0 3.3
assign (resid  214 and     name O    )(resid  218 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  215 and     name O    )(resid  219 and     name N    ) 0.0 0.0 3.3
assign (resid  215 and     name O    )(resid  219 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  216 and     name O    )(resid  220 and     name N    ) 0.0 0.0 3.3
assign (resid  216 and     name O    )(resid  220 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  217 and     name O    )(resid  221 and     name N    ) 0.0 0.0 3.3
assign (resid  217 and     name O    )(resid  221 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  218 and     name O    )(resid  222 and     name N    ) 0.0 0.0 3.3
assign (resid  218 and     name O    )(resid  222 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  219 and     name O    )(resid  223 and     name N    ) 0.0 0.0 3.3
assign (resid  219 and     name O    )(resid  223 and     name H   ) 0.0 0.0 2.3
!
!Helix 3 239-248
!
assign (resid  239 and     name O    )(resid  243 and     name N    ) 0.0 0.0 3.3
assign (resid  239 and     name O    )(resid  243 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  240 and     name O    )(resid  244 and     name N    ) 0.0 0.0 3.3
assign (resid  240 and     name O    )(resid  244 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  241 and     name O    )(resid  245 and     name N    ) 0.0 0.0 3.3
assign (resid  241 and     name O    )(resid  245 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  242 and     name O    )(resid  246 and     name N    ) 0.0 0.0 3.3
assign (resid  242 and     name O    )(resid  246 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  243 and     name O    )(resid  247 and     name N    ) 0.0 0.0 3.3
assign (resid  243 and     name O    )(resid  247 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  244 and     name O    )(resid  248 and     name N    ) 0.0 0.0 3.3
assign (resid  244 and     name O    )(resid  248 and     name H   ) 0.0 0.0 2.3
!
!
!Helix 4 260-273
assign (resid  260 and     name O    )(resid  264 and     name N    ) 0.0 0.0 3.3
assign (resid  260 and     name O    )(resid  264 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  261 and     name O    )(resid  265 and     name N    ) 0.0 0.0 3.3
assign (resid  261 and     name O    )(resid  265 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  262 and     name O    )(resid  266 and     name N    ) 0.0 0.0 3.3
assign (resid  262 and     name O    )(resid  266 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  263 and     name O    )(resid  267 and     name N    ) 0.0 0.0 3.3
assign (resid  263 and     name O    )(resid  267 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  264 and     name O    )(resid  268 and     name N    ) 0.0 0.0 3.3
assign (resid  264 and     name O    )(resid  268 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  265 and     name O    )(resid  269 and     name N    ) 0.0 0.0 3.3
assign (resid  265 and     name O    )(resid  269 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  266 and     name O    )(resid  270 and     name N    ) 0.0 0.0 3.3
assign (resid  266 and     name O    )(resid  270 and     name H   ) 0.0 0.0 2.3
!
assign (resid  267 and     name O    )(resid  271 and     name N    ) 0.0 0.0 3.3
assign (resid  267 and     name O    )(resid  271 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  268 and     name O    )(resid  272 and     name N    ) 0.0 0.0 3.3
assign (resid  268 and     name O    )(resid  272 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  269 and     name O    )(resid  273 and     name N    ) 0.0 0.0 3.3
assign (resid  269 and     name O    )(resid  273 and     name H   ) 0.0 0.0 2.3
!
!
!Helix 5 280-291
assign (resid  280 and     name O    )(resid  284 and     name N    ) 0.0 0.0 3.3
assign (resid  280 and     name O    )(resid  284 and     name H   ) 0.0 0.0 2.3
!
!
!285PRO
!assign (resid  281 and     name O    )(resid  285 and     name N    ) 0.0 0.0 3.3
!assign (resid  281 and     name O    )(resid  285 and     name H   ) 0.0 0.0 2.3
!
!
!assign (resid  282 and     name O    )(resid  286 and     name N    ) 0.0 0.0 3.3
!assign (resid  282 and     name O    )(resid  286 and     name H   ) 0.0 0.0 2.3
!
!
!assign (resid  283 and     name O    )(resid  287 and     name N    ) 0.0 0.0 3.3
!assign (resid  283 and     name O    )(resid  287 and     name H   ) 0.0 0.0 2.3
!
!
!assign (resid  284 and     name O    )(resid  288 and     name N    ) 0.0 0.0 3.3
!assign (resid  284 and     name O    )(resid  288 and     name H   ) 0.0 0.0 2.3
!
!
!assign (resid  285 and     name O    )(resid  289 and     name N    ) 0.0 0.0 3.3
!assign (resid  285 and     name O    )(resid  289 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  286 and     name O    )(resid  290 and     name N    ) 0.0 0.0 3.3
assign (resid  286 and     name O    )(resid  290 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  287 and     name O    )(resid  291 and     name N    ) 0.0 0.0 3.3
assign (resid  287 and     name O    )(resid  291 and     name H   ) 0.0 0.0 2.3
!
! Helix 6 296-309
!
assign (resid  296 and     name O    )(resid  300 and     name N    ) 0.0 0.0 3.3
assign (resid  296 and     name O    )(resid  300 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  297 and     name O    )(resid  301 and     name N    ) 0.0 0.0 3.3
assign (resid  297 and     name O    )(resid  301 and     name H   ) 0.0 0.0 2.3
!
assign (resid  298 and     name O    )(resid  302 and     name N    ) 0.0 0.0 3.3
assign (resid  298 and     name O    )(resid  302 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  299 and     name O    )(resid  303 and     name N    ) 0.0 0.0 3.3
assign (resid  299 and     name O    )(resid  303 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  300 and     name O    )(resid  304 and     name N    ) 0.0 0.0 3.3
assign (resid  300 and     name O    )(resid  304 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  301 and     name O    )(resid  305 and     name N    ) 0.0 0.0 3.3
assign (resid  301 and     name O    )(resid  305 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  302 and     name O    )(resid  306 and     name N    ) 0.0 0.0 3.3
assign (resid  302 and     name O    )(resid  306 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  303 and     name O    )(resid  307 and     name N    ) 0.0 0.0 3.3
assign (resid  303 and     name O    )(resid  307 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  304 and     name O    )(resid  308 and     name N    ) 0.0 0.0 3.3
assign (resid  304 and     name O    )(resid  308 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  305 and     name O    )(resid  309 and     name N    ) 0.0 0.0 3.3
assign (resid  305 and     name O    )(resid  309 and     name H   ) 0.0 0.0 2.3
!
! Helix 7 312-335
!
assign (resid  312 and     name O    )(resid  316 and     name N    ) 0.0 0.0 3.3
assign (resid  312 and     name O    )(resid  316 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  313 and     name O    )(resid  317 and     name N    ) 0.0 0.0 3.3
assign (resid  313 and     name O    )(resid  317 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  314 and     name O    )(resid  318 and     name N    ) 0.0 0.0 3.3
assign (resid  314 and     name O    )(resid  318 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  315 and     name O    )(resid  319 and     name N    ) 0.0 0.0 3.3
assign (resid  315 and     name O    )(resid  319 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  316 and     name O    )(resid  320 and     name N    ) 0.0 0.0 3.3
assign (resid  316 and     name O    )(resid  320 and     name H   ) 0.0 0.0 2.3
!
assign (resid  317 and     name O    )(resid  321 and     name N    ) 0.0 0.0 3.3
assign (resid  317 and     name O    )(resid  321 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  318 and     name O    )(resid  322 and     name N    ) 0.0 0.0 3.3
assign (resid  318 and     name O    )(resid  322 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  319 and     name O    )(resid  323 and     name N    ) 0.0 0.0 3.3
assign (resid  319 and     name O    )(resid  323 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  320 and     name O    )(resid  324 and     name N    ) 0.0 0.0 3.3
assign (resid  320 and     name O    )(resid  324 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  321 and     name O    )(resid  325 and     name N    ) 0.0 0.0 3.3
assign (resid  321 and     name O    )(resid  325 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  322 and     name O    )(resid  326 and     name N    ) 0.0 0.0 3.3
assign (resid  322 and     name O    )(resid  326 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  323 and     name O    )(resid  327 and     name N    ) 0.0 0.0 3.3
assign (resid  323 and     name O    )(resid  327 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  324 and     name O    )(resid  328 and     name N    ) 0.0 0.0 3.3
assign (resid  324 and     name O    )(resid  328 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  325 and     name O    )(resid  329 and     name N    ) 0.0 0.0 3.3
assign (resid  325 and     name O    )(resid  329 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  326 and     name O    )(resid  330 and     name N    ) 0.0 0.0 3.3
assign (resid  326 and     name O    )(resid  330 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  327 and     name O    )(resid  331 and     name N    ) 0.0 0.0 3.3
assign (resid  327 and     name O    )(resid  331 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  328 and     name O    )(resid  332 and     name N    ) 0.0 0.0 3.3
assign (resid  328 and     name O    )(resid  332 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  329 and     name O    )(resid  333 and     name N    ) 0.0 0.0 3.3
assign (resid  329 and     name O    )(resid  333 and     name H   ) 0.0 0.0 2.3
!
assign (resid  330 and     name O    )(resid  334 and     name N    ) 0.0 0.0 3.3
assign (resid  330 and     name O    )(resid  334 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  331 and     name O    )(resid  335 and     name N    ) 0.0 0.0 3.3
assign (resid  331 and     name O    )(resid  335 and     name H   ) 0.0 0.0 2.3
!
!Helix 8 339-348
assign (resid  339 and     name O    )(resid  343 and     name N    ) 0.0 0.0 3.3
assign (resid  339 and     name O    )(resid  343 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  340 and     name O    )(resid  344 and     name N    ) 0.0 0.0 3.3
assign (resid  340 and     name O    )(resid  344 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  341 and     name O    )(resid  345 and     name N    ) 0.0 0.0 3.3
assign (resid  341 and     name O    )(resid  345 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  342 and     name O    )(resid  346 and     name N    ) 0.0 0.0 3.3
assign (resid  342 and     name O    )(resid  346 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  343 and     name O    )(resid  347 and     name N    ) 0.0 0.0 3.3
assign (resid  343 and     name O    )(resid  347 and     name H   ) 0.0 0.0 2.3
!
!348PRO
!assign (resid  344 and     name O    )(resid  348 and     name N    ) 0.0 0.0 3.3
!assign (resid  344 and     name O    )(resid  348 and     name H   ) 0.0 0.0 2.3
!
! Helix 9 356-367
!
assign (resid  356 and     name O    )(resid  360 and     name N    ) 0.0 0.0 3.3
assign (resid  356 and     name O    )(resid  360 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  357 and     name O    )(resid  361 and     name N    ) 0.0 0.0 3.3
assign (resid  357 and     name O    )(resid  361 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  358 and     name O    )(resid  362 and     name N    ) 0.0 0.0 3.3
assign (resid  358 and     name O    )(resid  362 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  359 and     name O    )(resid  363 and     name N    ) 0.0 0.0 3.3
assign (resid  359 and     name O    )(resid  363 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  360 and     name O    )(resid  364 and     name N    ) 0.0 0.0 3.3
assign (resid  360 and     name O    )(resid  364 and     name H   ) 0.0 0.0 2.3
!
assign (resid  361 and     name O    )(resid  365 and     name N    ) 0.0 0.0 3.3
assign (resid  361 and     name O    )(resid  365 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  362 and     name O    )(resid  366 and     name N    ) 0.0 0.0 3.3
assign (resid  362 and     name O    )(resid  366 and     name H   ) 0.0 0.0 2.3
!
!
assign (resid  363 and     name O    )(resid  367 and     name N    ) 0.0 0.0 3.3
assign (resid  363 and     name O    )(resid  367 and     name H   ) 0.0 0.0 2.3
!
!
!Helix 10 395-417
!395-399
assign (resid  395 and     name O    )(resid  399 and     name N    ) 0.0 0.0 3.3
assign (resid  395 and     name O    )(resid  399 and     name H   ) 0.0 0.0 2.3
!
!396-400
assign (resid  396 and     name O    )(resid  400 and     name N    ) 0.0 0.0 3.3
assign (resid  396 and     name O    )(resid  400 and     name H   ) 0.0 0.0 2.3
!
!397-401
assign (resid  397 and     name O    )(resid  401 and     name N    ) 0.0 0.0 3.3
assign (resid  397 and     name O    )(resid  401 and     name H   ) 0.0 0.0 2.3
!
!398-402
assign (resid  398 and     name O    )(resid  402 and     name N    ) 0.0 0.0 3.3
assign (resid  398 and     name O    )(resid  402 and     name H   ) 0.0 0.0 2.3
!
!399-403
assign (resid  399 and     name O    )(resid  403 and     name N    ) 0.0 0.0 3.3
assign (resid  399 and     name O    )(resid  403 and     name H   ) 0.0 0.0 2.3
!
!400-404
assign (resid  400 and     name O    )(resid  404 and     name N    ) 0.0 0.0 3.3
assign (resid  400 and     name O    )(resid  404 and     name H   ) 0.0 0.0 2.3
!
!401-405
assign (resid  401 and     name O    )(resid  405 and     name N    ) 0.0 0.0 3.3
assign (resid  401 and     name O    )(resid  405 and     name H   ) 0.0 0.0 2.3
!
!402-406
assign (resid  402 and     name O    )(resid  406 and     name N    ) 0.0 0.0 3.3
assign (resid  402 and     name O    )(resid  406 and     name H   ) 0.0 0.0 2.3
!
!403-407
assign (resid  403 and     name O    )(resid  407 and     name N    ) 0.0 0.0 3.3
assign (resid  403 and     name O    )(resid  407 and     name H   ) 0.0 0.0 2.3
!
!404-408
assign (resid  404 and     name O    )(resid  408 and     name N    ) 0.0 0.0 3.3
assign (resid  404 and     name O    )(resid  408 and     name H   ) 0.0 0.0 2.3
!
!405-409
assign (resid  405 and     name O    )(resid  409 and     name N    ) 0.0 0.0 3.3
assign (resid  405 and     name O    )(resid  409 and     name H   ) 0.0 0.0 2.3
!
!406-410
assign (resid  406 and     name O    )(resid  410 and     name N    ) 0.0 0.0 3.3
assign (resid  406 and     name O    )(resid  410 and     name H   ) 0.0 0.0 2.3
!
!407-411
assign (resid  407 and     name O    )(resid  411 and     name N    ) 0.0 0.0 3.3
assign (resid  407 and     name O    )(resid  411 and     name H   ) 0.0 0.0 2.3
!
!408-412
assign (resid  408 and     name O    )(resid  412 and     name N    ) 0.0 0.0 3.3
assign (resid  408 and     name O    )(resid  412 and     name H   ) 0.0 0.0 2.3
!
!409-413
assign (resid  409 and     name O    )(resid  413 and     name N    ) 0.0 0.0 3.3
assign (resid  409 and     name O    )(resid  413 and     name H   ) 0.0 0.0 2.3
!
!410-414
assign (resid  410 and     name O    )(resid  414 and     name N    ) 0.0 0.0 3.3
assign (resid  410 and     name O    )(resid  414 and     name H   ) 0.0 0.0 2.3
!
!411-415
assign (resid  411 and     name O    )(resid  415 and     name N    ) 0.0 0.0 3.3
assign (resid  411 and     name O    )(resid  415 and     name H   ) 0.0 0.0 2.3
!
!412-416
!assign (resid  412 and     name O    )(resid  416 and     name N    ) 0.0 0.0 3.3
!assign (resid  412 and     name O    )(resid  416 and     name H   ) 0.0 0.0 2.3
!
!413-417
!assign (resid  413 and     name O    )(resid  417 and     name N    ) 0.0 0.0 3.3
!assign (resid  413 and     name O    )(resid  417 and     name H   ) 0.0 0.0 2.3
!
!Helix 12 422-443
!
!422-426
assign (resid  422 and     name O    )(resid  426 and     name N    ) 0.0 0.0 3.3
assign (resid  422 and     name O    )(resid  426 and     name H   ) 0.0 0.0 2.3
!423-427
assign (resid  423 and     name O    )(resid  427 and     name N    ) 0.0 0.0 3.3
assign (resid  423 and     name O    )(resid  427 and     name H   ) 0.0 0.0 2.3
!
!424-428
assign (resid  424 and     name O    )(resid  428 and     name N    ) 0.0 0.0 3.3
assign (resid  424 and     name O    )(resid  428 and     name H   ) 0.0 0.0 2.3
!
!425-429
assign (resid  425 and     name O    )(resid  429 and     name N    ) 0.0 0.0 3.3
assign (resid  425 and     name O    )(resid  429 and     name H   ) 0.0 0.0 2.3
!
!426-430
assign (resid  426 and     name O    )(resid  430 and     name N    ) 0.0 0.0 3.3
assign (resid  426 and     name O    )(resid  430 and     name H   ) 0.0 0.0 2.3
!
!427-431
assign (resid  427 and     name O    )(resid  431 and     name N    ) 0.0 0.0 3.3
assign (resid  427 and     name O    )(resid  431 and     name H   ) 0.0 0.0 2.3
!
!428-432
assign (resid  428 and     name O    )(resid  432 and     name N    ) 0.0 0.0 3.3
assign (resid  428 and     name O    )(resid  432 and     name H   ) 0.0 0.0 2.3
!
!429-433
assign (resid  429 and     name O    )(resid  433 and     name N    ) 0.0 0.0 3.3
assign (resid  429 and     name O    )(resid  433 and     name H   ) 0.0 0.0 2.3
!
!430-434
assign (resid  430 and     name O    )(resid  434 and     name N    ) 0.0 0.0 3.3
assign (resid  430 and     name O    )(resid  434 and     name H   ) 0.0 0.0 2.3
!
!431-435
assign (resid  431 and     name O    )(resid  435 and     name N    ) 0.0 0.0 3.3
assign (resid  431 and     name O    )(resid  435 and     name H   ) 0.0 0.0 2.3
!
!432-436
assign (resid  432 and     name O    )(resid  436 and     name N    ) 0.0 0.0 3.3
assign (resid  432 and     name O    )(resid  436 and     name H   ) 0.0 0.0 2.3
!
!433-437
assign (resid  433 and     name O    )(resid  437 and     name N    ) 0.0 0.0 3.3
assign (resid  433 and     name O    )(resid  437 and     name H   ) 0.0 0.0 2.3
!
!434-438
assign (resid  434 and     name O    )(resid  438 and     name N    ) 0.0 0.0 3.3
assign (resid  434 and     name O    )(resid  438 and     name H   ) 0.0 0.0 2.3
!
!435-439
assign (resid  435 and     name O    )(resid  439 and     name N    ) 0.0 0.0 3.3
assign (resid  435 and     name O    )(resid  439 and     name H   ) 0.0 0.0 2.3
!
!436-440
assign (resid  436 and     name O    )(resid  440 and     name N    ) 0.0 0.0 3.3
assign (resid  436 and     name O    )(resid  440 and     name H   ) 0.0 0.0 2.3
!
!437-441
assign (resid  437 and     name O    )(resid  441 and     name N    ) 0.0 0.0 3.3
assign (resid  437 and     name O    )(resid  441 and     name H   ) 0.0 0.0 2.3
!
!438-442
assign (resid  438 and     name O    )(resid  442 and     name N    ) 0.0 0.0 3.3
assign (resid  438 and     name O    )(resid  442 and     name H   ) 0.0 0.0 2.3
!
!439-443
assign (resid  439 and     name O    )(resid  443 and     name N    ) 0.0 0.0 3.3
assign (resid  439 and     name O    )(resid  443 and     name H   ) 0.0 0.0 2.3
!
!


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