NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
28057 | 2xbd | 4241 | cing | 1-original | 6 | XPLOR/CNS | distance | NOE | ambi |
! ! Appended after NOE back-calc analysis ! 205 cons in total ! assign (resid 320 and name hn ) ((resid 319 and name hb2 ) or (resid 319 and name hg+ )) 3.70 1.80 0.00 ! 6 assign ((resid 279 and name hn ) or (resid 267 and name hn )) ((resid 314 and name ha2 ) or (resid 303 and name ha )) 4.97 3.07 0.00 ! 3 assign (resid 259 and name hn ) ((resid 258 and name hb+ ) or (resid 258 and name hg+ )) 4.51 2.61 0.00 ! 4 assign ((resid 268 and name hn ) or (resid 285 and name hn )) ((resid 253 and name ha ) or (resid 284 and name ha )) 3.70 1.80 0.00 ! 6 assign (resid 267 and name hh ) ((resid 325 and name ha ) or (resid 281 and name ha )) 5.50 3.60 0.00 ! 2 assign (resid 267 and name hh ) ((resid 253 and name hb+ ) or (resid 279 and name hb1 )) 4.08 2.18 0.00 ! 5 assign (resid 258 and name hn ) ((resid 258 and name hb+ ) or (resid 258 and name hg+ )) 4.08 2.18 0.00 ! 5 assign (resid 286 and name hn ) ((resid 318 and name hb2 ) or (resid 318 and name he+ )) 3.35 1.45 0.00 ! 7 assign (resid 320 and name hd2+ ) ((resid 318 and name hb2 ) or (resid 318 and name he+ )) 4.51 2.61 0.00 ! 4 assign (resid 267 and name he+ ) ((resid 326 and name hg+ ) or (resid 267 and name hb1 ) or (resid 265 and name hb )) 2.50 0.60 0.00 ! 10 assign (resid 267 and name he+ ) ((resid 267 and name hb2 ) or (resid 315 and name hg++ )) 2.50 0.60 0.00 ! 10 assign ((resid 313 and name hz ) or (resid 267 and name hd+ )) (resid 279 and name hd2+ ) 3.35 1.45 0.00 ! 7 assign ((resid 326 and name hd2 ) or (resid 333 and name hb+ )) ((resid 325 and name ha ) or (resid 281 and name ha ) or (resid 248 and name ha+ )) 3.35 1.45 0.00 ! 7 assign ((resid 279 and name ha ) or (resid 267 and name ha )) ((resid 251 and name hg1+ ) or (resid 277 and name hg++ )) 4.97 3.07 0.00 ! 3 assign (resid 318 and name ha ) ((resid 317 and name hg1+ ) or (resid 317 and name hb )) 5.50 3.60 0.00 ! 2 assign ((resid 252 and name ha ) or (resid 295 and name ha )) ((resid 253 and name hb+ ) or (resid 305 and name hg2+ )) 4.97 3.07 0.00 ! 3 assign ((resid 300 and name ha ) or (resid 265 and name ha )) ((resid 281 and name hb1 ) or (resid 255 and name hg+ )) 4.51 2.61 0.00 ! 4 assign ((resid 321 and name ha1 ) or (resid 326 and name ha )) ((resid 326 and name hg+ ) or (resid 319 and name hd+ )) 3.35 1.45 0.00 ! 7 assign ((resid 332 and name ha+ ) or (resid 255 and name ha )) ((resid 276 and name hg2+ ) or (resid 253 and name hb+ )) 5.50 3.60 0.00 ! 2 assign ((resid 281 and name ha ) or (resid 325 and name ha )) (resid 281 and name hd++ ) 2.50 0.60 0.00 ! 10 assign ((resid 281 and name ha ) or (resid 300 and name hb+ )) ((resid 281 and name hg ) or (resid 281 and name hb1 )) 2.75 0.85 0.00 ! 9 assign (resid 281 and name hb2 ) ((resid 281 and name ha ) or (resid 300 and name hb+ )) 4.51 2.61 0.00 ! 4 assign (resid 331 and name hb+ ) ((resid 332 and name ha+ ) or (resid 276 and name hb )) 3.35 1.45 0.00 ! 7 assign (resid 326 and name hd2 ) ((resid 317 and name hb ) or (resid 317 and name hg1+ )) 4.97 3.07 0.00 ! 3 assign ((resid 324 and name hb ) or (resid 322 and name hb+ )) ((resid 282 and name hb+ ) or (resid 320 and name hb2 )) 4.51 2.61 0.00 ! 4 assign ((resid 322 and name hb+ ) or (resid 283 and name ha+ )) ((resid 282 and name hb+ ) or (resid 320 and name hb2 )) 5.50 3.60 0.00 ! 2 assign ((resid 324 and name hb ) or (resid 322 and name hb+ )) (resid 282 and name hb+ ) 5.50 3.60 0.00 ! 2 assign (resid 268 and name hb+ ) ((resid 312 and name hg2+ ) or (resid 252 and name hg2+ )) 3.35 1.45 0.00 ! 7 assign (resid 259 and name hb2 ) ((resid 262 and name hb2 ) or (resid 262 and name hg+ )) 4.51 2.61 0.00 ! 4 assign (resid 263 and name hb+ ) ((resid 258 and name hb+ ) or (resid 258 and name hg+ )) 4.97 3.07 0.00 ! 3 assign (resid 304 and name hg2+ ) ((resid 277 and name hg++ ) or (resid 295 and name hg2+ )) 3.04 1.14 0.00 ! 8 assign (resid 277 and name hg++ ) ((resid 279 and name hd2+ ) or (resid 269 and name hg1+ )) 2.50 0.60 0.00 ! 10 assign (resid 265 and name hg1+ ) ((resid 315 and name hg++ ) or (resid 267 and name hb2 )) 3.70 1.80 0.00 ! 6 assign (resid 262 and name ha ) ((resid 262 and name hg+ ) or (resid 319 and name hg+ )) 3.35 1.45 0.00 ! 7 assign (resid 285 and name hn ) ((resid 281 and name hg ) or (resid 281 and name hb1 )) 5.50 3.60 0.00 ! 2 assign (resid 282 and name hn ) ((resid 281 and name hg ) or (resid 281 and name hb1 )) 3.35 1.45 0.00 ! 7 assign (resid 328 and name hb+ ) ((resid 251 and name hg1+ ) or (resid 277 and name hg++ )) 2.50 0.60 0.00 ! 10 assign (resid 304 and name hg2+ ) ((resid 279 and name hb2 ) or (resid 279 and name hg )) 3.04 1.14 0.00 ! 8 assign (resid 277 and name hg++ ) ((resid 279 and name hb2 ) or (resid 279 and name hg )) 3.70 1.80 0.00 ! 6 assign (resid 279 and name hd1+ ) ((resid 302 and name hb2 ) or (resid 302 and name hg+ )) 4.97 3.07 0.00 ! 3 assign (resid 304 and name hg2+ ) ((resid 302 and name hb2 ) or (resid 302 and name hg+ )) 5.50 3.60 0.00 ! 2 assign (resid 295 and name hg1+ ) ((resid 302 and name hb2 ) or (resid 302 and name hg+ )) 4.08 2.18 0.00 ! 5 assign (resid 261 and name hn ) ((resid 261 and name hb2 ) or (resid 319 and name he+ )) 4.97 3.07 0.00 ! 3 assign (resid 261 and name hn ) ((resid 262 and name hb2 ) or (resid 319 and name hd+ )) 5.50 3.60 0.00 ! 2 assign (resid 262 and name hn ) ((resid 261 and name hb2 ) or (resid 319 and name he+ )) 4.51 2.61 0.00 ! 4 assign (resid 263 and name hn ) ((resid 262 and name hb2 ) or (resid 262 and name hg+ )) 3.35 1.45 0.00 ! 7 assign (resid 273 and name hn ) ((resid 273 and name hb+ ) or (resid 272 and name hb+ )) 2.50 0.60 0.00 ! 10 assign (resid 274 and name hn ) ((resid 272 and name hb+ ) or (resid 273 and name hb+ )) 4.51 2.61 0.00 ! 4 assign (resid 278 and name hn ) ((resid 331 and name hn ) or (resid 279 and name hn )) 5.50 3.60 0.00 ! 1 assign (resid 279 and name hn ) ((resid 279 and name ha ) or (resid 302 and name ha )) 4.08 2.18 0.00 ! 5 assign (resid 279 and name hn ) ((resid 279 and name hb2 ) or (resid 279 and name hg )) 3.35 1.45 0.00 ! 7 assign (resid 281 and name hn ) ((resid 281 and name hg ) or (resid 281 and name hb1 ) or (resid 302 and name hb2 )) 2.50 0.60 0.00 ! 10 assign (resid 281 and name hn ) ((resid 301 and name hg2+ ) or (resid 302 and name hg+ )) 4.97 3.07 0.00 ! 3 assign (resid 282 and name hn ) ((resid 281 and name hg ) or (resid 281 and name hb1 ) or (resid 285 and name hb1 )) 4.51 2.61 0.00 ! 4 assign (resid 282 and name hd2+ ) ((resid 323 and name ha ) or (resid 326 and name ha )) 3.04 1.14 0.00 ! 8 assign (resid 285 and name hn ) ((resid 317 and name hg1+ ) or (resid 281 and name hd++ )) 5.50 3.60 0.00 ! 1 assign (resid 285 and name he2+ ) ((resid 285 and name ha ) or (resid 326 and name hd1 )) 4.97 3.07 0.00 ! 3 assign (resid 285 and name he2+ ) ((resid 282 and name hb+ ) or (resid 320 and name hb2 )) 4.97 3.07 0.00 ! 3 assign (resid 288 and name hn ) ((resid 288 and name hg+ ) or (resid 318 and name hg+ )) 4.97 3.07 0.00 ! 3 assign (resid 288 and name hn ) ((resid 287 and name hb ) or (resid 288 and name hb+ )) 3.04 1.14 0.00 ! 8 assign (resid 296 and name hn ) ((resid 296 and name hg2+ ) or (resid 303 and name hg2+ )) 3.35 1.45 0.00 ! 7 assign (resid 298 and name hn ) ((resid 297 and name ha+ ) or (resid 298 and name hb+ )) 2.50 0.60 0.00 ! 10 assign (resid 299 and name hn ) ((resid 297 and name ha+ ) or (resid 298 and name hb+ )) 2.75 0.85 0.00 ! 9 assign (resid 302 and name he ) ((resid 302 and name hb2 ) or (resid 302 and name hg+ )) 4.51 2.61 0.00 ! 4 assign (resid 302 and name he ) ((resid 287 and name hg1+ ) or (resid 302 and name hg+ )) 4.51 2.61 0.00 ! 4 assign (resid 262 and name he ) ((resid 262 and name hg+ ) or (resid 262 and name hb2 )) 3.35 1.45 0.00 ! 7 assign (resid 305 and name hn ) ((resid 305 and name ha ) or (resid 295 and name ha )) 4.97 3.07 0.00 ! 3 assign (resid 305 and name hn ) ((resid 305 and name hg2+ ) or (resid 293 and name hb+ )) 4.51 2.61 0.00 ! 4 assign (resid 311 and name hn ) ((resid 311 and name hb1 ) or (resid 292 and name hb+ )) 4.08 2.18 0.00 ! 5 assign (resid 312 and name hn ) ((resid 311 and name hb2 ) or (resid 313 and name hb1 )) 5.50 3.60 0.00 ! 1 assign (resid 313 and name hn ) ((resid 313 and name ha ) or (resid 268 and name ha )) 3.70 1.80 0.00 ! 6 assign (resid 318 and name hn ) ((resid 286 and name hg2+ ) or (resid 316 and name hg2+ )) 5.50 3.60 0.00 ! 2 assign (resid 320 and name hd2+ ) ((resid 320 and name ha ) or (resid 284 and name hb+ )) 5.50 3.60 0.00 ! 2 assign (resid 321 and name hn ) ((resid 319 and name hb2 ) or (resid 319 and name hg+ )) 4.97 3.07 0.00 ! 3 assign (resid 322 and name hn ) ((resid 320 and name ha ) or (resid 319 and name ha )) 5.50 3.60 0.00 ! 2 assign (resid 322 and name hn ) ((resid 321 and name ha2 ) or (resid 322 and name hb+ )) 5.50 3.60 0.00 ! 2 assign (resid 323 and name hn ) ((resid 323 and name hb+ ) or (resid 322 and name hb+ )) 3.35 1.45 0.00 ! 7 assign (resid 325 and name hn ) ((resid 324 and name hb ) or (resid 323 and name hb+ )) 4.97 3.07 0.00 ! 3 assign (resid 328 and name hn ) ((resid 279 and name hg ) or (resid 329 and name hg2+ )) 5.50 3.60 0.00 ! 1 assign (resid 263 and name hz ) ((resid 326 and name ha ) or (resid 323 and name ha )) 5.50 3.60 0.00 ! 2 assign (resid 263 and name hz ) ((resid 326 and name hd2 ) or (resid 322 and name hb+ )) 4.08 2.18 0.00 ! 5 assign (resid 263 and name hz ) ((resid 326 and name hg+ ) or (resid 285 and name hb1 ) or (resid 319 and name hd+ )) 4.97 3.07 0.00 ! 3 assign (resid 263 and name he+ ) ((resid 326 and name hd2 ) or (resid 322 and name hb+ )) 4.51 2.61 0.00 ! 4 assign (resid 263 and name he+ ) ((resid 255 and name hd+ ) or (resid 285 and name hg+ )) 4.97 3.07 0.00 ! 3 assign (resid 263 and name he+ ) ((resid 319 and name hb+ ) or (resid 319 and name hg+ )) 5.50 3.60 0.00 ! 2 assign (resid 263 and name he+ ) ((resid 265 and name hb ) or (resid 326 and name hg+ ) or (resid 285 and name hb1 ) or (resid 319 and name hd+ )) 2.75 0.85 0.00 ! 9 assign (resid 263 and name he+ ) ((resid 255 and name hg+ ) or (resid 319 and name hg+ )) 4.51 2.61 0.00 ! 4 assign (resid 263 and name hd+ ) ((resid 319 and name hd+ ) or (resid 265 and name hb )) 2.50 0.60 0.00 ! 10 assign (resid 263 and name hd+ ) ((resid 255 and name hg+ ) or (resid 255 and name hb2 ) or (resid 319 and name hg+ )) 4.97 3.07 0.00 ! 3 assign ((resid 275 and name hd1 ) or (resid 278 and name hd2+ )) ((resid 301 and name hg2+ ) or (resid 269 and name hb )) 4.97 3.07 0.00 ! 3 assign (resid 313 and name hd+ ) ((resid 313 and name ha ) or (resid 268 and name ha )) 5.50 3.60 0.00 ! 2 assign ((resid 291 and name hh2 ) or (resid 259 and name hz3 )) (resid 264 and name hb1 ) 4.97 3.07 0.00 ! 3 assign ((resid 291 and name hh2 ) or (resid 259 and name hz3 )) (resid 264 and name hb2 ) 4.97 3.07 0.00 ! 3 assign ((resid 291 and name hh2 ) or (resid 259 and name hz3 )) (resid 316 and name hg2+ ) 4.51 2.61 0.00 ! 4 assign ((resid 275 and name hh2 ) or (resid 278 and name hd2+ )) ((resid 301 and name hg2+ ) or (resid 269 and name hb )) 5.50 3.60 0.00 ! 2 assign ((resid 319 and name hn ) or (resid 322 and name hn )) (resid 319 and name hb1 ) 4.08 2.18 0.00 ! 5 assign ((resid 319 and name hn ) or (resid 322 and name hn )) ((resid 319 and name hb2 ) or (resid 319 and name hg+ )) 3.70 1.80 0.00 ! 6 assign ((resid 317 and name hb ) or (resid 317 and name hg1+ )) ((resid 285 and name hb2 ) or (resid 326 and name hg+ )) 3.35 1.45 0.00 ! 7 assign (resid 281 and name hd++ ) ((resid 285 and name hb2 ) or (resid 326 and name hg+ )) 2.75 0.85 0.00 ! 9 assign (resid 281 and name hg ) ((resid 285 and name hb2 ) or (resid 326 and name hg+ )) 3.04 1.14 0.00 ! 8 assign (resid 279 and name hd2+ ) ((resid 302 and name hb1 ) or (resid 326 and name hg+ )) 5.50 3.60 0.00 ! 2 assign (resid 281 and name hd++ ) ((resid 302 and name hg+ ) or (resid 302 and name hb2 )) 3.70 1.80 0.00 ! 6 assign (resid 281 and name hd++ ) ((resid 279 and name hb2 ) or (resid 287 and name hg1+ )) 3.70 1.80 0.00 ! 6 assign ((resid 259 and name hz3 ) or (resid 291 and name hh2 )) (resid 264 and name hd21 ) 4.08 2.18 0.00 ! 5 assign (resid 285 and name he2+ ) ((resid 322 and name hb+ ) or (resid 324 and name hb )) 3.70 1.80 0.00 ! 6 ! ! CONS added below after NOE back-calc analysis... ! assign ((resid 253 and name hn ) or (resid 318 and name hn )) ((resid 253 and name ha ) or (resid 318 and name ha )) 3.35 1.45 0.00 ! 7 assign (resid 255 and name hn ) ((resid 255 and name hb2 ) or (resid 255 and name hg+ )) 3.35 1.45 0.00 ! 7 assign (resid 255 and name he ) ((resid 255 and name hb2 ) or (resid 255 and name hg+ )) 4.97 3.07 0.00 ! 3 assign ((resid 291 and name hh2 ) or (resid 259 and name hz3 )) (resid 264 and name ha ) 5.50 3.60 0.00 ! 1 assign (resid 262 and name hn ) ((resid 262 and name hb2 ) or (resid 262 and name hg+ )) 3.70 1.80 0.00 ! 6 assign ((resid 263 and name hn ) or (resid 279 and name hn )) ((resid 262 and name hg+ ) or (resid 302 and name hg+ )) 5.50 3.60 0.00 ! 2 assign (resid 263 and name hd+ ) ((resid 319 and name hg+ ) or (resid 255 and name hg+ )) 3.35 1.45 0.00 ! 7 assign (resid 263 and name hd+ ) ((resid 326 and name ha ) or (resid 323 and name ha )) 4.51 2.61 0.00 ! 4 assign (resid 263 and name he+ ) ((resid 317 and name hb ) or (resid 317 and name hg1+ )) 4.97 3.07 0.00 ! 3 assign ((resid 282 and name hd2+ ) or (resid 263 and name he+ )) ((resid 324 and name ha ) or (resid 325 and name hb )) 5.50 3.60 0.00 ! 1 assign ((resid 266 and name hn ) or (resid 252 and name hn ) or (resid 328 and name hn )) (resid 267 and name hd+ ) 5.50 3.60 0.00 ! 2 assign ((resid 313 and name hz ) or (resid 267 and name hd+ )) ((resid 253 and name hb+ ) or (resid 279 and name hg )) 2.75 0.85 0.00 ! 9 assign ((resid 313 and name hz ) or (resid 267 and name hd+ )) (resid 279 and name hd1+ ) 3.70 1.80 0.00 ! 6 assign (resid 269 and name hn ) ((resid 268 and name hb+ ) or (resid 311 and name hb1 )) 4.08 2.18 0.00 ! 5 assign (resid 275 and name he3 ) ((resid 276 and name hg2+ ) or (resid 305 and name hg2+ )) 5.50 3.60 0.00 ! 1 assign (resid 275 and name hh2 ) ((resid 313 and name hb1 ) or (resid 311 and name hb2 )) 5.50 3.60 0.00 ! 1 assign ((resid 282 and name hn ) or (resid 274 and name hn )) ((resid 275 and name hb1 ) or (resid 285 and name hg+ )) 5.50 3.60 0.00 ! 1 assign (resid 285 and name hn ) ((resid 283 and name ha+ ) or (resid 322 and name hb+ )) 4.51 2.61 0.00 ! 4 assign (resid 285 and name he2+ ) ((resid 263 and name he+ ) or (resid 282 and name hd2+ )) 3.70 1.80 0.00 ! 6 assign (resid 285 and name he2+ ) ((resid 285 and name hb1 ) or (resid 319 and name hd+ ) or (resid 326 and name hg+ )) 5.50 3.60 0.00 ! 1 assign (resid 285 and name he2+ ) ((resid 317 and name hg1+ ) or (resid 317 and name hb )) 4.08 2.18 0.00 ! 5 assign (resid 286 and name hn ) ((resid 317 and name hg1+ ) or (resid 317 and name hb )) 4.51 2.61 0.00 ! 4 assign (resid 289 and name hn ) ((resid 287 and name hb ) or (resid 288 and name hb+ )) 4.08 2.18 0.00 ! 5 assign (resid 291 and name hn ) ((resid 291 and name he3 ) or (resid 291 and name hd1 )) 4.97 3.07 0.00 ! 3 assign (resid 301 and name hn ) ((resid 301 and name hb ) or (resid 299 and name ha+ )) 3.35 1.45 0.00 ! 7 assign (resid 303 and name hn ) ((resid 303 and name ha ) or (resid 297 and name ha+ )) 4.97 3.07 0.00 ! 3 assign (resid 307 and name hd2+ ) ((resid 308 and name ha1 ) or (resid 292 and name ha )) 5.50 3.60 0.00 ! 1 assign (resid 316 and name hn ) ((resid 315 and name hg++ ) or (resid 287 and name hg2+ )) 3.04 1.14 0.00 ! 8 assign (resid 317 and name hn ) ((resid 317 and name hb ) or (resid 317 and name hg1+ )) 2.75 0.85 0.00 ! 9 assign (resid 318 and name hn ) ((resid 317 and name hb ) or (resid 317 and name hg1+ )) 3.35 1.45 0.00 ! 7 assign (resid 319 and name hn ) ((resid 318 and name hb2 ) or (resid 262 and name hb1 )) 4.97 3.07 0.00 ! 3 assign (resid 320 and name hn ) ((resid 320 and name ha ) or (resid 319 and name ha )) 2.50 0.60 0.00 ! 10 assign (resid 324 and name hn ) ((resid 324 and name hb ) or (resid 322 and name hb+ ) or (resid 323 and name hb+ )) 2.50 0.60 0.00 ! 10 assign ((resid 330 and name hb+ ) or (resid 314 and name ha1 )) ((resid 250 and name ha ) or (resid 266 and name ha )) 4.51 2.61 0.00 ! 4LOW assign ((resid 251 and name ha ) or (resid 304 and name ha )) ((resid 269 and name hg1+ ) or (resid 279 and name hd2+ )) 5.50 3.60 0.00 ! 1 assign (resid 269 and name hg2+ ) ((resid 251 and name hg1+ ) or (resid 277 and name hg++ )) 2.50 0.60 0.00 ! 10 assign ((resid 255 and name ha ) or (resid 254 and name ha )) ((resid 255 and name hb2 ) or (resid 255 and name hg+ )) 4.08 2.18 0.00 ! 5 assign ((resid 255 and name hd+ ) or (resid 264 and name hb1 )) ((resid 255 and name hb1 ) or (resid 257 and name hg+ )) 4.97 3.07 0.00 ! 3 assign ((resid 257 and name ha ) or (resid 323 and name hb+ )) ((resid 257 and name hb2 ) or (resid 319 and name hd+ )) 4.08 2.18 0.00 ! 5 assign (resid 261 and name ha ) ((resid 319 and name hb2 ) or (resid 319 and name hg+ )) 5.50 3.60 0.00 ! 2 assign (resid 262 and name ha ) ((resid 262 and name hb2 ) or (resid 262 and name hg+ )) 3.04 1.14 0.00 ! 8 assign ((resid 262 and name hb1 ) or (resid 326 and name hb+ )) ((resid 280 and name hb+ ) or (resid 262 and name hg+ )) 4.51 2.61 0.00 ! 4 assign ((resid 262 and name hd+ ) or (resid 302 and name hd+ )) ((resid 262 and name hg+ ) or (resid 302 and name hg+ )) 4.51 2.61 0.00 ! 4 assign (resid 263 and name ha ) ((resid 262 and name hb2 ) or (resid 262 and name hg+ )) 5.50 3.60 0.00 ! 1 assign (resid 263 and name hb+ ) ((resid 258 and name hb+ ) or (resid 258 and name hg+ )) 5.50 3.60 0.00 ! 1 assign ((resid 265 and name ha ) or (resid 300 and name ha )) ((resid 256 and name hb+ ) or (resid 302 and name hg+ )) 5.50 3.60 0.00 ! 1 assign ((resid 265 and name ha ) or (resid 300 and name ha )) ((resid 281 and name hb2 ) or (resid 265 and name hb )) 4.97 3.07 0.00 ! 3 assign ((resid 279 and name ha ) or (resid 267 and name ha )) (resid 328 and name hb+ ) 4.51 2.61 0.00 ! 4 assign (resid 269 and name hg2+ ) ((resid 330 and name ha ) or (resid 251 and name ha ) or (resid 268 and name ha ) or (resid 277 and name ha )) 4.08 2.18 0.00 ! 5 assign ((resid 285 and name ha ) or (resid 271 and name ha1 )) ((resid 285 and name hg+ ) or (resid 249 and name hb2 )) 4.08 2.18 0.00 ! 5 assign ((resid 272 and name hb+ ) or (resid 284 and name hb+ )) ((resid 275 and name hb1 ) or (resid 285 and name hg+ ) or (resid 249 and name hb2 )) 5.50 3.60 0.00 ! 2 assign ((resid 275 and name hb2 ) or (resid 249 and name hb1 )) (resid 269 and name hg2+ ) 5.50 3.60 0.00 ! 1 assign ((resid 275 and name hb2 ) or (resid 249 and name hb1 )) (resid 269 and name hg1+ ) 3.70 1.80 0.00 ! 6 assign (resid 278 and name ha ) ((resid 279 and name hb2 ) or (resid 279 and name hg )) 5.50 3.60 0.00 ! 1 assign ((resid 281 and name ha ) or (resid 325 and name ha )) (resid 326 and name hb+ ) 3.70 1.80 0.00 ! 6 assign ((resid 287 and name ha ) or (resid 284 and name ha )) ((resid 284 and name hb+ ) or (resid 317 and name ha )) 4.08 2.18 0.00 ! 5 assign ((resid 326 and name hd1 ) or (resid 285 and name ha )) (resid 281 and name hd++ ) 5.50 3.60 0.00 ! 1 assign ((resid 285 and name ha ) or (resid 326 and name hd1 )) ((resid 317 and name hg1+ ) or (resid 317 and name hb )) 3.70 1.80 0.00 ! 6 assign (resid 285 and name hg+ ) ((resid 317 and name hg1+ ) or (resid 317 and name hb )) 3.35 1.45 0.00 ! 7 assign (resid 287 and name hb ) ((resid 287 and name hg1+ ) or (resid 302 and name hg+ )) 3.70 1.80 0.00 ! 6 assign ((resid 289 and name hb+ ) or (resid 319 and name hg+ ) or (resid 319 and name hb2 )) ((resid 288 and name hg+ ) or (resid 318 and name hg+ )) 5.50 3.60 0.00 ! 1 assign ((resid 288 and name ha ) or (resid 306 and name ha )) ((resid 288 and name hb+ ) or (resid 287 and name hb ) or (resid 306 and name hb2 )) 3.04 1.14 0.00 ! 8 assign ((resid 288 and name ha ) or (resid 285 and name ha )) ((resid 318 and name hg+ ) or (resid 288 and name hg+ )) 4.51 2.61 0.00 ! 4 assign ((resid 288 and name ha ) or (resid 285 and name ha )) ((resid 288 and name hg+ ) or (resid 320 and name hb2 )) 4.97 3.07 0.00 ! 3 assign (resid 290 and name hb+ ) ((resid 315 and name hg++ ) or (resid 287 and name hg2+ )) 2.75 0.85 0.00 ! 9 assign ((resid 292 and name ha ) or (resid 308 and name ha1 )) (resid 309 and name hb+ ) 3.70 1.80 0.00 ! 6 assign ((resid 296 and name ha ) or (resid 250 and name ha )) ((resid 295 and name hg1+ ) or (resid 251 and name hg2+ )) 5.50 3.60 0.00 ! 1 assign ((resid 302 and name ha ) or (resid 279 and name ha )) ((resid 302 and name hb2 ) or (resid 302 and name hg+ )) 4.97 3.07 0.00 ! 3 assign (resid 302 and name hd+ ) ((resid 302 and name hg+ ) or (resid 287 and name hg1+ )) 4.97 3.07 0.00 ! 3 assign (resid 304 and name ha ) ((resid 303 and name hg2+ ) or (resid 296 and name hg2+ )) 5.50 3.60 0.00 ! 1 assign (resid 304 and name hb ) ((resid 277 and name hg++ ) or (resid 295 and name hg1+ )) 4.08 2.18 0.00 ! 5 assign ((resid 306 and name ha ) or (resid 327 and name ha )) ((resid 326 and name hb+ ) or (resid 306 and name hb1 )) 3.04 1.14 0.00 ! 8 assign ((resid 311 and name hb1 ) or (resid 270 and name hb+ )) (resid 269 and name hg1+ ) 5.50 3.60 0.00 ! 1 assign ((resid 315 and name hb ) or (resid 326 and name hb+ )) (resid 279 and name hd2+ ) 4.51 2.61 0.00 ! 4 assign ((resid 316 and name hb ) or (resid 310 and name ha+ )) ((resid 288 and name hb+ ) or (resid 306 and name hb2 )) 5.50 3.60 0.00 ! 2 assign (resid 317 and name ha ) ((resid 317 and name hb ) or (resid 317 and name hg1+ )) 2.50 0.60 0.00 ! 10 assign ((resid 317 and name ha ) or (resid 320 and name ha )) ((resid 318 and name hb2 ) or (resid 262 and name hb1 )) 5.50 3.60 0.00 ! 2 assign (resid 318 and name ha ) ((resid 318 and name hg+ ) or (resid 262 and name hd+ )) 5.50 3.60 0.00 ! 2 assign ((resid 326 and name hb+ ) or (resid 318 and name hb2 )) ((resid 317 and name hb ) or (resid 317 and name hg1+ )) 4.97 3.07 0.00 ! 3 assign ((resid 319 and name ha ) or (resid 320 and name ha ) or (resid 317 and name ha )) ((resid 288 and name hb+ ) or (resid 319 and name hb1 )) 4.08 2.18 0.00 ! 5 assign ((resid 319 and name ha ) or (resid 317 and name ha )) ((resid 319 and name hg+ ) or (resid 281 and name hg ) or (resid 281 and name hb1 )) 5.50 3.60 0.00 ! 2 assign ((resid 319 and name ha ) or (resid 317 and name ha )) ((resid 319 and name hd+ ) or (resid 285 and name hb1 ) or (resid 288 and name hb+ )) 3.35 1.45 0.00 ! 7 assign (resid 319 and name he+ ) ((resid 319 and name hg+ ) or (resid 319 and name hb2 )) 5.50 3.60 0.00 ! 1 assign ((resid 321 and name ha1 ) or (resid 323 and name ha )) (resid 319 and name hb1 ) 5.50 3.60 0.00 ! 1 assign ((resid 322 and name hb+ ) or (resid 283 and name ha+ )) (resid 282 and name hb+ ) 5.50 3.60 0.00 ! 1 assign ((resid 322 and name hb+ ) or (resid 283 and name ha+ )) (resid 285 and name hg+ ) 5.50 3.60 0.00 ! 1 assign ((resid 323 and name ha ) or (resid 321 and name ha1 ) or (resid 329 and name ha )) ((resid 319 and name he+ ) or (resid 320 and name hb1 ) or (resid 330 and name hb+ )) 5.50 3.60 0.00 ! 2LOW assign ((resid 326 and name hd2 ) or (resid 333 and name hb+ )) ((resid 325 and name hg2+ ) or (resid 274 and name hb+ )) 3.04 1.14 0.00 ! 8 assign ((resid 326 and name hd2 ) or (resid 283 and name ha+ ) or (resid 322 and name hb+ )) ((resid 285 and name hb2 ) or (resid 326 and name hg+ )) 5.50 3.60 0.00 ! 2 assign ((resid 285 and name ha ) or (resid 326 and name hd1 )) (resid 317 and name hg2+ ) 4.08 2.18 0.00 ! 5 assign (resid 326 and name hd1 ) ((resid 325 and name ha ) or (resid 281 and name ha )) 2.75 0.85 0.00 ! 9 assign ((resid 326 and name hd1 ) or (resid 285 and name ha )) ((resid 326 and name hg+ ) or (resid 285 and name hb2 )) 4.08 2.18 0.00 ! 5 assign (resid 328 and name ha ) ((resid 329 and name hg2+ ) or (resid 279 and name hb2 ) or (resid 279 and name hg )) 4.97 3.07 0.00 ! 3 assign (resid 302 and name hn ) ((resid 302 and name hb2 ) or (resid 302 and name hg+ )) 3.35 1.45 0.00 ! 7 assign ((resid 292 and name hb+ ) or (resid 323 and name hb+ ) or (resid 250 and name hb+ )) ((resid 319 and name he+ ) or (resid 314 and name ha1 ) or (resid 330 and name hb+ )) 5.50 3.60 0.00 ! 1LOW assign ((resid 255 and name hb1 ) or (resid 326 and name hb+ )) ((resid 255 and name hg+ ) or (resid 281 and name hg ) or (resid 281 and name hb1 )) 4.51 2.61 0.00 ! 4 assign ((resid 295 and name hg1+ ) or (resid 277 and name hg++ )) (resid 304 and name hg1+ ) 4.97 3.07 0.00 ! 3 assign ((resid 295 and name hg1+ ) or (resid 277 and name hg++ )) (resid 304 and name hg2+ ) 3.04 1.14 0.00 ! 8 assign ((resid 330 and name hb+ ) or (resid 285 and name hg+ )) ((resid 251 and name hg2+ ) or (resid 281 and name hd++ )) 4.51 2.61 0.00 ! 4HIGH assign ((resid 286 and name ha ) or (resid 326 and name ha )) (resid 281 and name hd++ ) 3.70 1.80 0.00 ! 6
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