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 |
|
|
15254 |
1xut   |
6384 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign (resid 2 and name HA and segid A )(resid 3 and name HD2 and segid A ) 4.5 2.7 0.0 ! A_3.30 C579 3530 A2 assign (resid 2 and name HA and segid A )(resid 3 and name HD1 and segid A ) 4.5 2.7 0.0 ! A_3.78 C577 1580 A1 assign (resid 2 and name HA and segid A )(resid 3 and name HG1 and segid A ) 5.6 3.8 0.0 ! A_5.08r C232 266 A1 assign (resid 2 and name HA and segid A )(resid 3 and name HG2 and segid A ) 5.6 3.8 0.0 ! A_5.20r C231 230 A2 assign (resid 3 and name HB1 and segid A )(resid 3 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_4.09r C53 978 22 assign (resid 3 and name HB2 and segid A )(resid 3 and name HD1 and segid A ) 5.6 3.8 0.0 ! A_5.03 C49 282 11 assign (resid 3 and name HB1 and segid A )(resid 3 and name HD1 and segid A ) 5.6 3.8 0.0 ! A_5.22 C50 225 21 assign (resid 3 and name HB2 and segid A )(resid 3 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_5.50r C52 152 12 assign (resid 3 and name HB# and segid A )(resid 3 and name HG# and segid A ) 4.5 2.7 2.0 ! A_3.84r C308 1430 22 assign (resid 3 and name HB# and segid A )(resid 4 and name HZ2 and segid A ) 5.6 3.8 1.0 ! A_5.50 C510 166 1A assign (resid 3 and name HD1 and segid A )(resid 4 and name HE3 and segid A ) 5.6 3.8 0.0 ! A_5.50r C442 119 1A assign (resid 3 and name HD2 and segid A )(resid 4 and name HE3 and segid A ) 5.6 3.8 0.0 ! A_5.50r D336 97.4 2A assign (resid 3 and name HD1 and segid A )(resid 4 and name HZ3 and segid A ) 5.6 3.8 0.0 ! A_4.46r D90 2970 1A assign (resid 3 and name HD2 and segid A )(resid 4 and name HZ3 and segid A ) 5.6 3.8 0.0 ! A_5.50r D80 379 2A assign (resid 3 and name HG2 and segid A )(resid 3 and name HD2 and segid A ) 4.5 2.7 0.0 ! A_3.51 C40 2430 22 assign (resid 3 and name HG1 and segid A )(resid 3 and name HD2 and segid A ) 4.5 2.7 0.0 ! A_4.05 C42 1030 12 assign (resid 3 and name HG1 and segid A )(resid 3 and name HD1 and segid A ) 4.5 2.7 0.0 ! A_4.14r C276 910 11 assign (resid 3 and name HG2 and segid A )(resid 3 and name HD1 and segid A ) 4.5 2.7 0.0 ! A_4.36r C274 669 21 assign (resid 3 and name HG# and segid A )(resid 4 and name HE3 and segid A ) 5.6 3.8 1.0 ! A_5.50r D351 164 1A assign (resid 3 and name HG# and segid A )(resid 4 and name HZ2 and segid A ) 5.6 3.8 1.0 ! A_5.50r D349 119 2A assign (resid 4 and name HA and segid A )(resid 4 and name HD1 and segid A ) 5.6 3.8 0.0 ! A_4.63r C564 466 AA assign (resid 4 and name HA and segid A )(resid 4 and name HE3 and segid A ) 4.5 2.7 0.0 ! A_4.34 C534 682 AA assign (resid 4 and name HD1 and segid A )(resid 4 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.72 C515 416 A2 assign (resid 4 and name HD1 and segid A )(resid 4 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.72 C517 414 A1 assign (resid 4 and name HE1 and segid A )(resid 4 and name HZ2 and segid A ) 5.6 3.8 0.0 ! A_5.42r N228 74.7 AA assign (resid 4 and name HE3 and segid A )(resid 4 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.63 C514 466 A2 assign (resid 4 and name HE3 and segid A )(resid 4 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.79 C516 380 A1 assign (resid 4 and name HE3 and segid A )(resid 4 and name HH2 and segid A ) 5.6 3.8 0.0 ! A_5.50 D127 831 AA assign (resid 4 and name HE3 and segid A )(resid 4 and name HZ3 and segid A ) 5.6 3.8 0.0 ! A_4.81r C535 369 AA assign (resid 4 and name HE3 and segid A )(resid 18 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 D35 844 A1 assign (resid 4 and name HN and segid A )(resid 4 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N259 18.1 AA assign (resid 4 and name HZ2 and segid A )(resid 4 and name HH2 and segid A ) 4.5 2.7 0.0 ! A_3.68 C499 1830 AA assign (resid 4 and name HZ2 and segid A )(resid 4 and name HZ3 and segid A ) 5.6 3.8 0.0 ! A_5.24 D126 1120 AA assign (resid 4 and name HZ3 and segid A )(resid 18 and name HA and segid A ) 3.0 1.2 0.0 ! A_3.06 D79 28200 AA assign (resid 4 and name HZ3 and segid A )(resid 18 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 D54 592 A1 assign (resid 7 and name HA and segid A )(resid 7 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 C65 117 A2 assign (resid 11 and name HA and segid A )(resid 13 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N5 26.5 AA assign (resid 11 and name HB# and segid A )(resid 13 and name HN and segid A ) 4.5 2.7 1.0 ! A_4.58 N247 206 1A assign (resid 11 and name HB2 and segid A )(resid 14 and name HG2 and segid A ) 5.6 3.8 0.0 ! A_4.65 C545 454 12 assign (resid 11 and name HB1 and segid A )(resid 14 and name HG2 and segid A ) 5.6 3.8 0.0 ! A_4.80 C542 376 22 assign (resid 11 and name HB2 and segid A )(resid 14 and name HG1 and segid A ) 5.6 3.8 0.0 ! A_5.32 C544 201 11 assign (resid 11 and name HB1 and segid A )(resid 14 and name HG1 and segid A ) 5.6 3.8 0.0 ! A_5.41 C543 183 21 assign (resid 11 and name HG# and segid A )(resid 13 and name HN and segid A ) 5.6 3.8 1.0 ! A_5.50 N4 49.5 1A assign (resid 12 and name HA and segid A )(resid 13 and name HA# and segid A ) 5.6 3.8 1.0 ! A_5.43 C557 178 A2 assign (resid 14 and name HA and segid A )(resid 25 and name HA and segid A ) 4.5 2.7 0.0 ! A_3.64r C246 1950 AA assign (resid 14 and name HA and segid A )(resid 26 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.19 N206 97.2 AA assign (resid 14 and name HB# and segid A )(resid 15 and name HA and segid A ) 5.6 3.8 1.0 ! A_4.72 C230 414 2A assign (resid 14 and name HB2 and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.03 D200 5410 1A assign (resid 14 and name HB1 and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.57r C562 503 2A assign (resid 14 and name HG1 and segid A )(resid 15 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.09 N91 109 1A assign (resid 14 and name HG2 and segid A )(resid 15 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N90 44.7 2A assign (resid 14 and name HG2 and segid A )(resid 25 and name HA and segid A ) 4.5 2.7 0.0 ! A_2.91 C220 7500 2A assign (resid 14 and name HG1 and segid A )(resid 25 and name HA and segid A ) 4.5 2.7 0.0 ! A_3.83 C219 1440 1A assign (resid 14 and name HG# and segid A )(resid 25 and name HB2 and segid A ) 5.6 3.8 1.0 ! A_4.83 D311 1840 11 assign (resid 14 and name HG# and segid A )(resid 25 and name HB1 and segid A ) 5.6 3.8 1.0 ! A_5.20 C486 231 12 assign (resid 14 and name HG# and segid A )(resid 26 and name HN and segid A ) 5.6 3.8 1.0 ! A_5.50 N212 38.4 1A assign (resid 15 and name HA and segid A )(resid 16 and name HN and segid A ) 3.0 1.2 0.0 ! A_3.49 N196 1040 AA assign (resid 15 and name HN and segid A )(resid 24 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.89r N85 139 AA assign (resid 15 and name HZ and segid A )(resid 17 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.50 D42 193 A1 assign (resid 15 and name HZ and segid A )(resid 17 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.50 D44 325 A2 assign (resid 15 and name HZ and segid A )(resid 24 and name HB and segid A ) 3.6 1.8 0.0 ! A_3.47 C571 2640 AA assign (resid 15 and name HZ and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.21 C375 229 Am assign (resid 15 and name HZ and segid A )(resid 24 and name HG12 and segid A ) 5.6 3.8 0.0 ! A_5.50 C565 163 A2 assign (resid 15 and name HZ and segid A )(resid 24 and name HG11 and segid A ) 5.6 3.8 0.0 ! A_5.50 C569 69.2 A1 assign (resid 15 and name HZ and segid A )(resid 24 and name HG2# and segid A ) 5.6 3.8 0.5 ! A_4.93 C189 320 Am assign (resid 15 and name HZ and segid A )(resid 26 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D340 135 AA assign (resid 15 and name HZ and segid A )(resid 29 and name HD1# and segid A ) 4.5 2.7 0.5 ! A_3.52 C415 2420 Am assign (resid 15 and name HZ and segid A )(resid 34 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 D43 228 A2 assign (resid 15 and name HZ and segid A )(resid 34 and name HD# and segid A ) 5.6 3.8 1.0 ! A_5.50 D338 83.3 A2 assign (resid 16 and name HA and segid A )(resid 17 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50r D171 507 A1 assign (resid 16 and name HA and segid A )(resid 23 and name HA and segid A ) 3.6 1.8 0.0 ! A_3.54r C266 2310 AA assign (resid 16 and name HA and segid A )(resid 24 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.37 N233 79.4 AA assign (resid 16 and name HN and segid A )(resid 16 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N197 68.8 AA assign (resid 17 and name HA and segid A )(resid 18 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r C471 104 AA assign (resid 17 and name HA and segid A )(resid 18 and name HN and segid A ) 3.0 1.2 0.0 ! A_2.55 N202 6850 AA assign (resid 17 and name HA and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.36r C446 193 Am assign (resid 17 and name HA and segid A )(resid 24 and name HG1# and segid A ) 5.6 3.8 1.0 ! A_5.49r C447 168 A1 assign (resid 17 and name HB2 and segid A )(resid 20 and name HB2 and segid A ) 4.5 2.7 0.0 ! A_2.81r D283 46800 1R assign (resid 17 and name HB1 and segid A )(resid 20 and name HB2 and segid A ) 4.5 2.7 0.0 ! A_4.07r D314 5110 2R assign (resid 17 and name HB2 and segid A )(resid 20 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.59r C383 491 1R assign (resid 17 and name HB1 and segid A )(resid 20 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.03r C389 284 2R assign (resid 17 and name HB1 and segid A )(resid 20 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_4.18r C393 856 2R assign (resid 17 and name HB2 and segid A )(resid 20 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_4.31 C599 715 1R assign (resid 17 and name HB# and segid A )(resid 20 and name HG and segid A ) 5.6 3.8 1.0 ! A_5.15r C382 246 1A assign (resid 17 and name HB2 and segid A )(resid 20 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.40 N135 76.3 1A assign (resid 17 and name HB1 and segid A )(resid 20 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N136 40.7 2A assign (resid 17 and name HB# and segid A )(resid 21 and name HN and segid A ) 5.6 3.8 1.0 ! A_5.50 N59 33.8 1A assign (resid 17 and name HB# and segid A )(resid 22 and name HN and segid A ) 5.6 3.8 1.0 ! A_5.50 N47 51.7 1A assign (resid 17 and name HB# and segid A )(resid 24 and name HA and segid A ) 5.6 3.8 1.0 ! A_5.50r C561 118 1A assign (resid 17 and name HB# and segid A )(resid 24 and name HB and segid A ) 5.6 3.8 1.0 ! A_5.50 C572 101 2A assign (resid 17 and name HB2 and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_4.53 C379 528 1m assign (resid 17 and name HB1 and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.31r C392 204 2m assign (resid 17 and name HB2 and segid A )(resid 24 and name HG11 and segid A ) 5.6 3.8 0.0 ! A_3.68r C388 1840 11 assign (resid 17 and name HB1 and segid A )(resid 24 and name HG12 and segid A ) 5.6 3.8 0.0 ! A_3.86 C616 1390 22 assign (resid 17 and name HB1 and segid A )(resid 24 and name HG11 and segid A ) 5.6 3.8 0.0 ! A_4.36 C615 667 21 assign (resid 17 and name HB2 and segid A )(resid 24 and name HG12 and segid A ) 5.6 3.8 0.0 ! A_5.44r C384 176 12 assign (resid 17 and name HB1 and segid A )(resid 24 and name HG2# and segid A ) 5.6 3.8 0.5 ! A_5.06 C192 272 2m assign (resid 17 and name HB2 and segid A )(resid 24 and name HG2# and segid A ) 5.6 3.8 0.5 ! A_5.50 C550 78.2 1m assign (resid 17 and name HN and segid A )(resid 17 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.10r N265 108 AA assign (resid 17 and name HN and segid A )(resid 22 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50r N245 62.8 AA assign (resid 17 and name HN and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.50r N269 23.2 Am assign (resid 17 and name HN and segid A )(resid 24 and name HG1# and segid A ) 5.6 3.8 1.0 ! A_5.50r N270 23.1 A1 assign (resid 17 and name HN and segid A )(resid 24 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N268 6.56 AA assign (resid 18 and name HA and segid A )(resid 21 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.48 C225 567 AA assign (resid 18 and name HA and segid A )(resid 21 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.60 N55 200 AA assign (resid 18 and name HB# and segid A )(resid 20 and name HN and segid A ) 5.6 3.8 1.0 ! A_5.50 N134 22.8 2A assign (resid 18 and name HB# and segid A )(resid 21 and name HN and segid A ) 5.6 3.8 1.0 ! A_5.50 N58 58.6 2A assign (resid 18 and name HD2 and segid A )(resid 18 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.28 C304 742 A1 assign (resid 18 and name HD2 and segid A )(resid 18 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.50 C303 55.8 A2 assign (resid 18 and name HD2 and segid A )(resid 19 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 D100 457 A1 assign (resid 18 and name HD2 and segid A )(resid 19 and name HD2# and segid A ) 5.6 3.8 0.5 ! A_5.50 D102 341 AR assign (resid 18 and name HN and segid A )(resid 18 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N201 57.5 AA assign (resid 18 and name HN and segid A )(resid 18 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_5.50r N203 26.3 AA assign (resid 18 and name HN and segid A )(resid 20 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.94 N261 131 AA assign (resid 19 and name HA and segid A )(resid 20 and name HD2# and segid A ) 5.6 3.8 0.5 ! A_5.50r D302 418 AR assign (resid 19 and name HA and segid A )(resid 21 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N56 17.4 AA assign (resid 19 and name HB# and segid A )(resid 20 and name HD2# and segid A ) 5.6 3.8 1.5 ! A_5.31 C206 204 2R assign (resid 19 and name HG and segid A )(resid 20 and name HN and segid A ) 3.0 1.2 0.0 ! A_3.53 N139 981 AA assign (resid 19 and name HN and segid A )(resid 19 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.71r N168 174 AA assign (resid 19 and name HN and segid A )(resid 19 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.50r N171 25.8 AR assign (resid 19 and name HN and segid A )(resid 19 and name HD2# and segid A ) 5.6 3.8 0.5 ! A_5.50r N175 48.2 AR assign (resid 19 and name HN and segid A )(resid 20 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.50r N174 38.3 AR assign (resid 19 and name HN and segid A )(resid 20 and name HN and segid A ) 4.5 2.7 0.0 ! A_4.17r N166 361 AA assign (resid 19 and name HN and segid A )(resid 21 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.37 N54 78.7 AA assign (resid 20 and name HA and segid A )(resid 20 and name HB1 and segid A ) 3.0 1.2 0.0 ! A_2.96r C96 6790 AR assign (resid 20 and name HB2 and segid A )(resid 20 and name HG and segid A ) 3.6 1.8 0.0 ! A_3.20r C98 4250 RA assign (resid 20 and name HB2 and segid A )(resid 21 and name HN and segid A ) 3.0 1.2 0.0 ! A_3.10 N63 2120 RA assign (resid 20 and name HB2 and segid A )(resid 22 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.96 C403 306 R2 assign (resid 20 and name HB2 and segid A )(resid 22 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.33 C406 200 R1 assign (resid 20 and name HB2 and segid A )(resid 22 and name HN and segid A ) 4.5 2.7 0.0 ! A_4.17 N250 361 RA assign (resid 20 and name HB2 and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.50r D290 686 Rm assign (resid 20 and name HB1 and segid A )(resid 22 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.71 C402 421 R2 assign (resid 20 and name HB1 and segid A )(resid 22 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.90 C405 329 R1 assign (resid 20 and name HB1 and segid A )(resid 22 and name HN and segid A ) 3.0 1.2 0.0 ! A_3.09 N251 2180 RA assign (resid 20 and name HB1 and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.06r D289 1380 Rm assign (resid 20 and name HD2# and segid A )(resid 21 and name HN and segid A ) 5.6 3.8 0.5 ! A_5.33 N64 83.1 RA assign (resid 20 and name HD2# and segid A )(resid 22 and name HB# and segid A ) 5.6 3.8 1.5 ! A_5.08r C205 266 R1 assign (resid 20 and name HN and segid A )(resid 20 and name HA and segid A ) 4.5 2.7 0.0 ! A_4.57r N132 208 AA assign (resid 20 and name HN and segid A )(resid 20 and name HG and segid A ) 3.0 1.2 0.0 ! A_3.48r N138 1070 AA assign (resid 20 and name HN and segid A )(resid 21 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N133 52.6 AA assign (resid 20 and name HN and segid A )(resid 22 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50r N130 23 AA assign (resid 21 and name HB# and segid A )(resid 22 and name HA and segid A ) 5.6 3.8 1.0 ! A_5.27 D195 1080 1A assign (resid 21 and name HN and segid A )(resid 21 and name HA and segid A ) 3.6 1.8 0.0 ! A_4.02r N57 447 AA assign (resid 22 and name HA and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.04 C426 280 Am assign (resid 22 and name HB2 and segid A )(resid 23 and name HN and segid A ) 4.5 2.7 0.0 ! A_3.89 N238 549 1A assign (resid 22 and name HB1 and segid A )(resid 23 and name HN and segid A ) 4.5 2.7 0.0 ! A_4.30 N237 300 2A assign (resid 22 and name HB2 and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_3.84 C576 1420 1m assign (resid 22 and name HB1 and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_4.54 C378 520 2m assign (resid 22 and name HB# and segid A )(resid 24 and name HG2# and segid A ) 5.6 3.8 1.5 ! A_5.50 C191 168 2m assign (resid 22 and name HN and segid A )(resid 22 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N82 39.5 AA assign (resid 23 and name HA and segid A )(resid 24 and name HG2# and segid A ) 9.9 8.1 0.5 ! A_5.50 C552 116 Am !UB++ assign (resid 24 and name HA and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D130 752 AA assign (resid 24 and name HA and segid A )(resid 25 and name HN and segid A ) 3.0 1.2 0.0 ! A_3.41 N110 1210 AA assign (resid 24 and name HB and segid A )(resid 24 and name HG1# and segid A ) 2.5 0.7 1.0 ! A_2.40r C335 70100 A1 assign (resid 24 and name HD1# and segid A )(resid 25 and name HN and segid A ) 5.6 3.8 0.5 ! A_5.48 N114 69.8 mA assign (resid 24 and name HG2# and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.5 ! A_5.50 D299 379 mA assign (resid 24 and name HG2# and segid A )(resid 25 and name HN and segid A ) 5.6 3.8 0.5 ! A_4.77 N113 160 mA assign (resid 24 and name HG2# and segid A )(resid 26 and name HA and segid A ) 5.6 3.8 0.5 ! A_5.50 D301 438 mA assign (resid 24 and name HG2# and segid A )(resid 29 and name HD1# and segid A ) 5.6 3.8 1.0 ! A_4.03 C425 1070 mm assign (resid 24 and name HN and segid A )(resid 24 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.46r N234 71.4 AA assign (resid 24 and name HN and segid A )(resid 24 and name HG11 and segid A ) 5.6 3.8 0.0 ! A_3.11r N236 2090 A1 assign (resid 24 and name HN and segid A )(resid 24 and name HG12 and segid A ) 5.6 3.8 0.0 ! A_4.68r N231 181 A2 assign (resid 25 and name HB1 and segid A )(resid 27 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.01 C203 289 2m assign (resid 25 and name HB2 and segid A )(resid 27 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.35r C485 196 1m assign (resid 25 and name HN and segid A )(resid 25 and name HB# and segid A ) 3.0 1.2 1.0 ! A_3.48r N111 1060 A2 assign (resid 25 and name HN and segid A )(resid 29 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_4.61r N112 199 Am assign (resid 26 and name HA and segid A )(resid 29 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_4.19r C221 849 Am assign (resid 26 and name HA and segid A )(resid 29 and name HG2# and segid A ) 5.6 3.8 0.5 ! A_5.28 C195 212 Am assign (resid 26 and name HA and segid A )(resid 29 and name HN and segid A ) 3.6 1.8 0.0 ! A_3.65 N264 795 AA assign (resid 26 and name HA and segid A )(resid 37 and name HB2 and segid A ) 4.5 2.7 0.0 ! A_4.34 C346 688 AR assign (resid 26 and name HA and segid A )(resid 37 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.79r C585 380 AR assign (resid 26 and name HB1 and segid A )(resid 27 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.15 C583 245 2A assign (resid 26 and name HB2 and segid A )(resid 27 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 C573 163 1A assign (resid 26 and name HB1 and segid A )(resid 27 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.42 C438 182 2m assign (resid 26 and name HB2 and segid A )(resid 27 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.50 C439 73.7 1m assign (resid 26 and name HB2 and segid A )(resid 37 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 C253 -63.4 1A assign (resid 26 and name HB1 and segid A )(resid 37 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r C529 159 2A assign (resid 26 and name HB1 and segid A )(resid 37 and name HB1 and segid A ) 4.5 2.7 0.0 ! A_4.21r C323 825 2R assign (resid 26 and name HB2 and segid A )(resid 37 and name HB1 and segid A ) 4.5 2.7 0.0 ! A_4.40r C324 632 1R assign (resid 26 and name HN and segid A )(resid 26 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.02r N208 118 AA assign (resid 26 and name HN and segid A )(resid 27 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.50r N213 46.6 Am assign (resid 27 and name HB# and segid A )(resid 28 and name HB# and segid A ) 5.6 3.8 1.5 ! A_4.82r C201 367 m1 assign (resid 27 and name HN and segid A )(resid 27 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.64r N93 191 AA assign (resid 27 and name HN and segid A )(resid 29 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N29 18 AA assign (resid 28 and name HA and segid A )(resid 28 and name HB# and segid A ) 3.6 1.8 1.0 ! A_3.63 C118 2910 A1 assign (resid 28 and name HB# and segid A )(resid 29 and name HG2# and segid A ) 5.6 3.8 1.5 ! A_4.95 C196 313 2m assign (resid 28 and name HN and segid A )(resid 28 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N9 48.3 AA assign (resid 29 and name HB and segid A )(resid 30 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.24 C525 222 AA assign (resid 29 and name HB and segid A )(resid 32 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.02r C465 287 A1 assign (resid 29 and name HB and segid A )(resid 33 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.72r C466 416 AA assign (resid 29 and name HB and segid A )(resid 33 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.61 N106 197 AA assign (resid 29 and name HD1# and segid A )(resid 30 and name HN and segid A ) 5.6 3.8 0.5 ! A_5.50 N164 44.7 mA assign (resid 29 and name HD1# and segid A )(resid 32 and name HN and segid A ) 9.9 8.1 0.5 ! A_5.50 N276 1.6 mA !UB++ assign (resid 29 and name HD1# and segid A )(resid 33 and name HA and segid A ) 5.6 3.8 0.5 ! A_3.98 C252 1150 mA assign (resid 29 and name HD1# and segid A )(resid 33 and name HB2 and segid A ) 5.6 3.8 0.5 ! A_4.39r C423 643 mR assign (resid 29 and name HD1# and segid A )(resid 33 and name HB1 and segid A ) 5.6 3.8 0.5 ! A_4.67r C422 440 mR assign (resid 29 and name HD1# and segid A )(resid 33 and name HD2 and segid A ) 5.6 3.8 0.5 ! A_5.50r D319 128 mA assign (resid 29 and name HD1# and segid A )(resid 33 and name HN and segid A ) 5.6 3.8 0.5 ! A_5.50 N109 40.7 mA assign (resid 29 and name HD1# and segid A )(resid 34 and name HD1 and segid A ) 5.6 3.8 0.5 ! A_4.06r C421 1020 m1 assign (resid 29 and name HD1# and segid A )(resid 34 and name HD2 and segid A ) 5.6 3.8 0.5 ! A_4.13r C419 917 m2 assign (resid 29 and name HD1# and segid A )(resid 34 and name HG# and segid A ) 5.6 3.8 1.5 ! A_4.19r C424 850 m2 assign (resid 29 and name HG2# and segid A )(resid 30 and name HN and segid A ) 5.6 3.8 0.5 ! A_5.44 N165 72.7 mA assign (resid 29 and name HG2# and segid A )(resid 32 and name HB# and segid A ) 5.6 3.8 1.5 ! A_5.50r C193 157 m1 assign (resid 29 and name HG2# and segid A )(resid 33 and name HA and segid A ) 5.6 3.8 0.5 ! A_5.00r C197 291 mA assign (resid 29 and name HG2# and segid A )(resid 33 and name HB2 and segid A ) 5.6 3.8 0.5 ! A_5.50r C431 132 mR assign (resid 29 and name HG2# and segid A )(resid 33 and name HB1 and segid A ) 5.6 3.8 0.5 ! A_5.50r C433 139 mR assign (resid 29 and name HG2# and segid A )(resid 34 and name HD2 and segid A ) 5.6 3.8 0.5 ! A_5.50 D226 428 m2 assign (resid 29 and name HG2# and segid A )(resid 34 and name HD1 and segid A ) 5.6 3.8 0.5 ! A_5.50r C432 137 m1 assign (resid 29 and name HN and segid A )(resid 29 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_4.85r N26 146 Am assign (resid 29 and name HN and segid A )(resid 30 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.42r N22 74.6 A2 assign (resid 29 and name HN and segid A )(resid 30 and name HN and segid A ) 3.6 1.8 0.0 ! A_3.90 N157 535 AA assign (resid 30 and name HA and segid A )(resid 31 and name HA2 and segid A ) 5.6 3.8 0.0 ! A_5.04r C524 281 AR assign (resid 30 and name HA and segid A )(resid 33 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.27r D145 1080 AR assign (resid 30 and name HA and segid A )(resid 33 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_5.50r C635 87.3 AA assign (resid 30 and name HA and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.21r C636 228 AA assign (resid 30 and name HA and segid A )(resid 41 and name HB# and segid A ) 5.6 3.8 1.0 ! A_4.59r C260 486 A2 assign (resid 30 and name HB# and segid A )(resid 32 and name HN and segid A ) 5.6 3.8 1.0 ! A_5.50 N191 34.4 1A assign (resid 30 and name HB2 and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.50r D31 151 1A assign (resid 30 and name HB1 and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.50r D64 121 2A assign (resid 30 and name HB# and segid A )(resid 41 and name HA and segid A ) 5.6 3.8 1.0 ! A_4.78 C528 385 1A assign (resid 30 and name HB# and segid A )(resid 41 and name HB# and segid A ) 5.6 3.8 0.0 ! A_3.69 C456 1810 22 assign (resid 30 and name HN and segid A )(resid 41 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50r N161 43.4 A2 assign (resid 31 and name HA2 and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.25r C408 218 RA assign (resid 31 and name HA2 and segid A )(resid 33 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.38 N102 78.2 RA assign (resid 31 and name HA2 and segid A )(resid 41 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.71r D223 2140 R1 assign (resid 31 and name HA2 and segid A )(resid 41 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.92 C455 324 R2 assign (resid 31 and name HA2 and segid A )(resid 42 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.75 C630 401 RA assign (resid 31 and name HA2 and segid A )(resid 42 and name HG# and segid A ) 5.6 3.8 1.0 ! A_5.50r C410 166 R2 assign (resid 31 and name HA1 and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.24r C409 220 RA assign (resid 32 and name HN and segid A )(resid 32 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N188 4.76 AA assign (resid 32 and name HN and segid A )(resid 33 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.50r N190 32.9 AR assign (resid 32 and name HN and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.50r N274 4.39 AA assign (resid 33 and name HA and segid A )(resid 33 and name HB1 and segid A ) 3.0 1.2 0.0 ! A_2.95r C135 6870 AR assign (resid 33 and name HA and segid A )(resid 33 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_5.50r C479 81.4 AA assign (resid 33 and name HA and segid A )(resid 34 and name HD2 and segid A ) 4.5 2.7 0.0 ! A_3.65r C250 1930 A2 assign (resid 33 and name HA and segid A )(resid 34 and name HD1 and segid A ) 4.5 2.7 0.0 ! A_3.75r C251 1650 A1 assign (resid 33 and name HA and segid A )(resid 34 and name HG# and segid A ) 5.6 3.8 1.0 ! A_4.82r C478 364 A2 assign (resid 33 and name HA and segid A )(resid 37 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.21r D141 1160 AR assign (resid 33 and name HB2 and segid A )(resid 34 and name HD1 and segid A ) 4.5 2.7 0.0 ! A_2.53r C315 17300 R1 assign (resid 33 and name HB2 and segid A )(resid 34 and name HD2 and segid A ) 4.5 2.7 0.0 ! A_4.27 C519 753 R2 assign (resid 33 and name HB1 and segid A )(resid 34 and name HD# and segid A ) 5.6 3.8 1.0 ! A_4.69r C294 432 R2 assign (resid 33 and name HD2 and segid A )(resid 33 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.02 C297 287 AR assign (resid 33 and name HD2 and segid A )(resid 33 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.28 C296 210 AR assign (resid 33 and name HD2 and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.50 D327 174 AA assign (resid 33 and name HD2 and segid A )(resid 34 and name HD# and segid A ) 5.6 3.8 1.0 ! A_5.50 C592 53.5 A1 assign (resid 33 and name HD2 and segid A )(resid 35 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.97 C428 304 AA assign (resid 33 and name HD2 and segid A )(resid 37 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 C477 106 AA assign (resid 33 and name HD2 and segid A )(resid 37 and name HB2 and segid A ) 4.5 2.7 0.0 ! A_4.36r C240 663 AR assign (resid 33 and name HD2 and segid A )(resid 37 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.80 C344 373 AR assign (resid 33 and name HD2 and segid A )(resid 37 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.42 N31 74.7 AA assign (resid 33 and name HD2 and segid A )(resid 38 and name HA and segid A ) 4.5 2.7 0.0 ! A_4.14 C215 908 AA assign (resid 33 and name HD2 and segid A )(resid 38 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.11r C255 257 Am assign (resid 33 and name HD2 and segid A )(resid 38 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N218 68.3 AA assign (resid 33 and name HD2 and segid A )(resid 42 and name HG2 and segid A ) 5.6 3.8 0.0 ! A_5.50 D29 137 A2 assign (resid 33 and name HD2 and segid A )(resid 42 and name HG1 and segid A ) 5.6 3.8 0.0 ! A_5.50 D30 199 A1 assign (resid 33 and name HE1 and segid A )(resid 38 and name HB# and segid A ) 9.9 8.1 0.5 ! A_5.50 D324 93.6 Am !UB++ assign (resid 33 and name HE1 and segid A )(resid 41 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D66 98.5 AA assign (resid 33 and name HE1 and segid A )(resid 41 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.45 C457 174 A2 assign (resid 33 and name HE1 and segid A )(resid 41 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.50 C458 120 A1 assign (resid 33 and name HE1 and segid A )(resid 42 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D67 117 AA assign (resid 33 and name HE1 and segid A )(resid 42 and name HG1 and segid A ) 5.6 3.8 0.0 ! A_5.16 C460 243 A1 assign (resid 33 and name HE1 and segid A )(resid 42 and name HG2 and segid A ) 5.6 3.8 0.0 ! A_5.50 C459 165 A2 assign (resid 33 and name HN and segid A )(resid 33 and name HA and segid A ) 4.5 2.7 0.0 ! A_4.52r N100 223 AA assign (resid 33 and name HN and segid A )(resid 33 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_5.50r N254 12.4 AA assign (resid 33 and name HN and segid A )(resid 33 and name HE1 and segid A ) 5.6 3.8 0.0 ! A_5.50r N98 40 AA assign (resid 33 and name HN and segid A )(resid 34 and name HD# and segid A ) 5.6 3.8 1.0 ! A_5.41r N103 75.2 A1 assign (resid 34 and name HA and segid A )(resid 35 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.17 C429 240 AA assign (resid 34 and name HB1 and segid A )(resid 34 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_4.54 C521 525 22 assign (resid 34 and name HB1 and segid A )(resid 34 and name HD1 and segid A ) 5.6 3.8 0.0 ! A_4.91r C596 325 21 assign (resid 34 and name HB2 and segid A )(resid 34 and name HD1 and segid A ) 5.6 3.8 0.0 ! A_5.09r C595 262 11 assign (resid 34 and name HB2 and segid A )(resid 34 and name HD2 and segid A ) 5.6 3.8 0.0 ! A_5.50r C594 -28.4 12 assign (resid 34 and name HB# and segid A )(resid 34 and name HG# and segid A ) 5.6 3.8 0.0 ! A_4.52r C604 536 11 assign (resid 34 and name HG# and segid A )(resid 34 and name HD# and segid A ) 4.5 2.7 0.0 ! A_4.04r C559 1050 11 assign (resid 35 and name HA and segid A )(resid 35 and name HB# and segid A ) 4.5 2.7 1.0 ! A_3.96r D239 6080 A1 assign (resid 35 and name HA and segid A )(resid 37 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.21 N77 95 AA assign (resid 35 and name HA and segid A )(resid 38 and name HB# and segid A ) 3.6 1.8 0.5 ! A_2.88r C25 7960 Am assign (resid 35 and name HA and segid A )(resid 38 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.99 N222 122 AA assign (resid 35 and name HA and segid A )(resid 43 and name HD22 and segid A ) 5.6 3.8 0.0 ! A_5.50 N71 27.1 Aa assign (resid 36 and name HA and segid A )(resid 38 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.49 N221 69.5 AA assign (resid 37 and name HA and segid A )(resid 38 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.35r C472 194 AA assign (resid 37 and name HA and segid A )(resid 38 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.50r C474 132 Am assign (resid 37 and name HA and segid A )(resid 40 and name HB# and segid A ) 5.6 3.8 1.0 ! A_4.67r C598 443 A1 assign (resid 37 and name HA and segid A )(resid 40 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N117 31.3 AA assign (resid 37 and name HB1 and segid A )(resid 38 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.97r C343 305 RA assign (resid 37 and name HN and segid A )(resid 37 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.68r N32 181 AA assign (resid 37 and name HN and segid A )(resid 37 and name HB2 and segid A ) 3.6 1.8 0.0 ! A_4.24r N39 637 AR assign (resid 37 and name HN and segid A )(resid 38 and name HN and segid A ) 3.6 1.8 0.0 ! A_4.09r N78 404 AA assign (resid 38 and name HA and segid A )(resid 40 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N257 8.4 AA assign (resid 38 and name HA and segid A )(resid 41 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.94 N35 131 AA assign (resid 38 and name HA and segid A )(resid 42 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.30 C631 207 A2 assign (resid 38 and name HA and segid A )(resid 42 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.50 C632 159 A1 assign (resid 38 and name HA and segid A )(resid 42 and name HG2 and segid A ) 5.6 3.8 0.0 ! A_5.03r D228 1660 A2 assign (resid 38 and name HA and segid A )(resid 42 and name HG1 and segid A ) 5.6 3.8 0.0 ! A_5.17r D229 2370 A1 assign (resid 38 and name HA and segid A )(resid 42 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N146 61.4 AA assign (resid 38 and name HB# and segid A )(resid 39 and name HB2 and segid A ) 9.9 8.1 0.5 ! A_4.99 C608 297 m1 !UB++ assign (resid 38 and name HB# and segid A )(resid 39 and name HB1 and segid A ) 5.6 3.8 0.5 ! A_5.50 C607 93.8 m2 assign (resid 38 and name HN and segid A )(resid 38 and name HA and segid A ) 4.5 2.7 0.0 ! A_4.44r N223 248 AA assign (resid 39 and name HA and segid A )(resid 42 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N144 31.7 AA assign (resid 40 and name HN and segid A )(resid 40 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.01r N118 120 AA assign (resid 40 and name HN and segid A )(resid 41 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D70 349 AA assign (resid 40 and name HN and segid A )(resid 41 and name HN and segid A ) 4.5 2.7 0.0 ! A_4.23 N80 331 AA assign (resid 40 and name HN and segid A )(resid 42 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N147 49 AA assign (resid 41 and name HN and segid A )(resid 41 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.64r N36 190 AA assign (resid 41 and name HN and segid A )(resid 42 and name HN and segid A ) 4.5 2.7 0.0 ! A_4.47 N148 238 AA assign (resid 42 and name HA and segid A )(resid 42 and name HG1 and segid A ) 3.6 1.8 0.0 ! A_3.00r C170 6260 A1 assign (resid 42 and name HA and segid A )(resid 42 and name HG2 and segid A ) 3.6 1.8 0.0 ! A_3.07r C226 5440 A2 assign (resid 42 and name HN and segid A )(resid 42 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.60r N143 199 AA assign (resid 43 and name HD21 and segid A )(resid 44 and name HG# and segid A ) 5.6 3.8 1.0 ! A_5.50 D115 499 a2 assign (resid 44 and name HA and segid A )(resid 45 and name HD2# and segid A ) 5.6 3.8 0.5 ! A_5.30r D217 1050 AR assign (resid 44 and name HN and segid A )(resid 44 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r N176 47.4 AA assign (resid 45 and name HN and segid A )(resid 45 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.41r N183 75.4 AA assign (resid 45 and name HN and segid A )(resid 45 and name HD2# and segid A ) 5.6 3.8 0.5 ! A_5.50r N275 36 AR assign (resid 2 and name HA and segid A )(resid 2 and name HB# and segid A ) 3.6 1.8 0.0 ! A_2.75r C228 10500 AQ assign (resid 6 and name HA and segid A )(resid 6 and name HB# and segid A ) 3.0 1.2 0.0 ! A_2.40 C43 32200 AQ assign (resid 8 and name HA and segid A )(resid 9 and name HG# and segid A ) 5.6 3.8 0.0 ! A_5.09r D197 1340 AQ assign (resid 9 and name HB# and segid A )(resid 9 and name HD# and segid A ) 5.6 3.8 1.0 ! A_5.04 D267 1410 2Q assign (resid 9 and name HG# and segid A )(resid 9 and name HD# and segid A ) 3.0 1.2 0.0 ! A_2.40 C6 40400 QQ assign (resid 10 and name HA and segid A )(resid 10 and name HB# and segid A ) 4.5 2.7 0.0 ! A_3.95 C31 1200 AQ assign (resid 10 and name HA and segid A )(resid 10 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.50 C71 101 AQ assign (resid 10 and name HB# and segid A )(resid 10 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.90 C72 332 QQ assign (resid 10 and name HD# and segid A )(resid 10 and name HE# and segid A ) 3.0 1.2 0.0 ! A_2.40 C18 37800 QQ assign (resid 11 and name HB2 and segid A )(resid 14 and name HD# and segid A ) 5.6 3.8 0.0 ! A_3.96 C634 1180 1Q assign (resid 11 and name HB1 and segid A )(resid 14 and name HD# and segid A ) 5.6 3.8 0.0 ! A_4.18 C633 860 2Q assign (resid 11 and name HB1 and segid A )(resid 14 and name HE# and segid A ) 5.6 3.8 0.0 ! A_3.89 C623 1320 2Q assign (resid 11 and name HB2 and segid A )(resid 14 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.42 C369 616 1Q assign (resid 12 and name HA and segid A )(resid 12 and name HB# and segid A ) 3.0 1.2 0.0 ! A_2.52 C74 17900 AQ assign (resid 12 and name HA and segid A )(resid 12 and name HG# and segid A ) 3.0 1.2 0.0 ! A_2.48 C75 19600 AQ assign (resid 13 and name HA2 and segid A )(resid 40 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.06r C413 273 1P assign (resid 13 and name HA1 and segid A )(resid 40 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.07r C411 271 2P assign (resid 14 and name HA and segid A )(resid 14 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.40 C79 185 AQ assign (resid 14 and name HA and segid A )(resid 15 and name HD# and segid A ) 5.6 3.8 0.0 ! A_5.50r D20 303 AP assign (resid 14 and name HB1 and segid A )(resid 14 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.50r C84 548 2Q assign (resid 14 and name HB2 and segid A )(resid 14 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.60r C83 480 1Q assign (resid 14 and name HD# and segid A )(resid 14 and name HE# and segid A ) 3.6 1.8 0.0 ! A_2.48 C359 19700 QQ assign (resid 14 and name HD# and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.00r C555 1110 QA assign (resid 14 and name HE# and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.13r C368 927 QA assign (resid 14 and name HE# and segid A )(resid 25 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.35r C367 674 Q1 assign (resid 14 and name HE# and segid A )(resid 25 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.50 C482 160 Q2 assign (resid 14 and name HG1 and segid A )(resid 14 and name HE# and segid A ) 5.6 3.8 0.0 ! A_3.97 C361 1170 1Q assign (resid 14 and name HG2 and segid A )(resid 14 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.00 C360 1110 2Q assign (resid 15 and name HB# and segid A )(resid 36 and name HE2# and segid A ) 5.6 3.8 1.0 ! A_5.50 N15 58.7 2Q assign (resid 15 and name HD# and segid A )(resid 15 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.38 D57 3280 P1 assign (resid 15 and name HD# and segid A )(resid 15 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.70 D56 2150 P2 assign (resid 15 and name HD# and segid A )(resid 17 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.69 C451 427 PA assign (resid 15 and name HD# and segid A )(resid 17 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 D91 357 P1 assign (resid 15 and name HD# and segid A )(resid 24 and name HB and segid A ) 5.6 3.8 0.0 ! A_5.50 C333 137 PA assign (resid 15 and name HD# and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.50 C377 164 Pm assign (resid 15 and name HD# and segid A )(resid 24 and name HG1# and segid A ) 5.6 3.8 1.0 ! A_5.50 C570 147 P1 assign (resid 15 and name HD# and segid A )(resid 24 and name HG2# and segid A ) 5.6 3.8 0.5 ! A_5.50 C188 138 Pm assign (resid 15 and name HD# and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D84 555 PA assign (resid 15 and name HD# and segid A )(resid 26 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.89 C584 335 PA assign (resid 15 and name HD# and segid A )(resid 29 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.26 C417 215 Pm assign (resid 15 and name HE# and segid A )(resid 15 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 D50 834 P1 assign (resid 15 and name HE# and segid A )(resid 16 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N263 29.3 PA assign (resid 15 and name HE# and segid A )(resid 17 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.28 C450 742 PA assign (resid 15 and name HE# and segid A )(resid 17 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.88 C373 339 P2 assign (resid 15 and name HE# and segid A )(resid 17 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.06 C372 272 P1 assign (resid 15 and name HE# and segid A )(resid 17 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N272 28.3 PA assign (resid 15 and name HE# and segid A )(resid 24 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D77 277 PA assign (resid 15 and name HE# and segid A )(resid 24 and name HB and segid A ) 5.6 3.8 0.0 ! A_4.71 D105 2140 PA assign (resid 15 and name HE# and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.05 C376 275 Pm assign (resid 15 and name HE# and segid A )(resid 24 and name HG11 and segid A ) 5.6 3.8 0.0 ! A_5.27 C568 213 P1 assign (resid 15 and name HE# and segid A )(resid 24 and name HG12 and segid A ) 5.6 3.8 0.0 ! A_5.44 C566 177 P2 assign (resid 15 and name HE# and segid A )(resid 24 and name HG2# and segid A ) 5.6 3.8 0.5 ! A_4.89 C187 336 Pm assign (resid 15 and name HE# and segid A )(resid 25 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.80 D82 1890 PA assign (resid 15 and name HE# and segid A )(resid 26 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.64 C216 459 PA assign (resid 15 and name HE# and segid A )(resid 29 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_3.58 C416 2160 Pm assign (resid 15 and name HE# and segid A )(resid 29 and name HG1# and segid A ) 5.6 3.8 0.0 ! A_5.50 D104 777 PQ assign (resid 15 and name HE# and segid A )(resid 29 and name HG2# and segid A ) 5.6 3.8 0.5 ! A_5.50 C434 106 Pm assign (resid 15 and name HE# and segid A )(resid 34 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.50 D52 489 P2 assign (resid 15 and name HE# and segid A )(resid 34 and name HD# and segid A ) 5.6 3.8 1.0 ! A_5.50 C591 64.4 P1 assign (resid 15 and name HN and segid A )(resid 15 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.50r N84 35.2 AP assign (resid 15 and name HZ and segid A )(resid 29 and name HG1# and segid A ) 5.6 3.8 0.0 ! A_5.50 D322 318 AQ assign (resid 16 and name HA and segid A )(resid 16 and name HB# and segid A ) 4.5 2.7 0.0 ! A_3.54r C86 2340 AQ assign (resid 16 and name HA and segid A )(resid 16 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.87 C492 344 AP assign (resid 16 and name HA and segid A )(resid 23 and name HB# and segid A ) 5.6 3.8 0.0 ! A_4.45 C351 589 AQ assign (resid 16 and name HD# and segid A )(resid 16 and name HB# and segid A ) 5.6 3.8 0.0 ! A_3.53 C581 2370 PQ assign (resid 16 and name HD# and segid A )(resid 17 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.62 N244 194 PA assign (resid 16 and name HD# and segid A )(resid 23 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.58 C247 495 PA assign (resid 16 and name HD# and segid A )(resid 23 and name HB# and segid A ) 5.6 3.8 0.0 ! A_4.31 C352 716 PQ assign (resid 16 and name HE# and segid A )(resid 16 and name HB# and segid A ) 5.6 3.8 0.0 ! A_4.47r C496 576 PQ assign (resid 16 and name HE# and segid A )(resid 18 and name HA and segid A ) 4.5 2.7 0.0 ! A_3.74 C270 1680 PA assign (resid 16 and name HE# and segid A )(resid 18 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.31r C494 709 P1 assign (resid 16 and name HE# and segid A )(resid 18 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.52 D9 2720 P2 assign (resid 16 and name HE# and segid A )(resid 20 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N260 10.9 PA assign (resid 16 and name HE# and segid A )(resid 21 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.41 C234 618 PA assign (resid 16 and name HE# and segid A )(resid 21 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.22 C637 227 P1 assign (resid 16 and name HE# and segid A )(resid 21 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.50 D317 305 P2 assign (resid 16 and name HE# and segid A )(resid 21 and name HG# and segid A ) 5.6 3.8 0.0 ! A_4.64r C539 458 PQ assign (resid 16 and name HE# and segid A )(resid 21 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N252 21.3 PA assign (resid 16 and name HE# and segid A )(resid 22 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.54 C443 520 PA assign (resid 16 and name HE# and segid A )(resid 22 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.44 N52 73 PA assign (resid 16 and name HE# and segid A )(resid 23 and name HB# and segid A ) 5.6 3.8 0.0 ! A_4.78r C495 384 PQ assign (resid 17 and name HN and segid A )(resid 23 and name HB# and segid A ) 5.6 3.8 0.0 ! A_5.50r N271 49.6 AQ assign (resid 21 and name HA and segid A )(resid 21 and name HD# and segid A ) 4.5 2.7 0.0 ! A_3.79 C99 1550 AQ assign (resid 21 and name HB2 and segid A )(resid 21 and name HD# and segid A ) 5.6 3.8 0.0 ! A_2.53 D268 89500 1Q assign (resid 21 and name HB1 and segid A )(resid 21 and name HD# and segid A ) 5.6 3.8 0.0 ! A_4.09 D266 4970 2Q assign (resid 21 and name HB# and segid A )(resid 21 and name HG# and segid A ) 4.5 2.7 1.0 ! A_3.55 C102 2290 2Q assign (resid 21 and name HG# and segid A )(resid 21 and name HD# and segid A ) 3.0 1.2 0.0 ! A_2.40 C105 29800 QQ assign (resid 21 and name HN and segid A )(resid 21 and name HG# and segid A ) 4.5 2.7 0.0 ! A_4.07r N62 418 AQ assign (resid 23 and name HA and segid A )(resid 23 and name HB# and segid A ) 4.5 2.7 0.0 ! A_3.90 C357 1290 AQ assign (resid 23 and name HB# and segid A )(resid 24 and name HD1# and segid A ) 5.6 3.8 0.5 ! A_5.50r D304 638 Qm assign (resid 24 and name HG2# and segid A )(resid 29 and name HG1# and segid A ) 5.6 3.8 0.5 ! A_4.48r C194 565 mQ assign (resid 26 and name HA and segid A )(resid 29 and name HG1# and segid A ) 3.6 1.8 0.0 ! A_3.23r D256 20600 AQ assign (resid 26 and name HB# and segid A )(resid 29 and name HG1# and segid A ) 5.6 3.8 1.0 ! A_4.85r C606 353 2Q assign (resid 26 and name HB1 and segid A )(resid 40 and name HD# and segid A ) 5.6 3.8 0.0 ! A_4.33 C503 692 2P assign (resid 26 and name HB2 and segid A )(resid 40 and name HD# and segid A ) 5.6 3.8 0.0 ! A_4.61r C326 477 1P assign (resid 26 and name HB1 and segid A )(resid 40 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.18r D39 1200 2P assign (resid 26 and name HB2 and segid A )(resid 40 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.50r D41 359 1P assign (resid 27 and name HA and segid A )(resid 40 and name HD# and segid A ) 5.6 3.8 0.0 ! A_5.38r D75 955 AP assign (resid 27 and name HA and segid A )(resid 40 and name HE# and segid A ) 4.5 2.7 0.0 ! A_4.16r C249 1530 AP assign (resid 27 and name HB# and segid A )(resid 40 and name HD# and segid A ) 5.6 3.8 0.5 ! A_4.90 C501 330 mP assign (resid 27 and name HB# and segid A )(resid 40 and name HE# and segid A ) 5.6 3.8 0.5 ! A_4.62r C199 686 mP assign (resid 27 and name HN and segid A )(resid 40 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.95r N255 129 AP assign (resid 29 and name HB and segid A )(resid 29 and name HG1# and segid A ) 4.5 2.7 0.0 ! A_3.74r C347 1660 AQ assign (resid 29 and name HG1# and segid A )(resid 30 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.69 C259 696 QA assign (resid 29 and name HG1# and segid A )(resid 30 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.64 N163 189 QA assign (resid 29 and name HG1# and segid A )(resid 32 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.45 N278 72.3 QA assign (resid 29 and name HG1# and segid A )(resid 33 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50r C614 137 QA assign (resid 29 and name HG1# and segid A )(resid 33 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_4.49 C298 560 QR assign (resid 29 and name HG1# and segid A )(resid 33 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_4.30 C185 723 QR assign (resid 29 and name HG1# and segid A )(resid 33 and name HD2 and segid A ) 9.9 8.1 0.0 ! A_5.50r D116 360 QA !UB++ assign (resid 29 and name HG1# and segid A )(resid 33 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N108 27.9 QA assign (resid 29 and name HN and segid A )(resid 29 and name HG1# and segid A ) 4.5 2.7 0.0 ! A_3.78r N25 646 AQ assign (resid 31 and name HA1 and segid A )(resid 32 and name HG# and segid A ) 4.5 2.7 0.0 ! A_3.81r C629 1500 RQ assign (resid 34 and name HG# and segid A )(resid 36 and name HE2# and segid A ) 5.6 3.8 1.0 ! A_5.50 N16 30.6 1Q assign (resid 35 and name HD# and segid A )(resid 35 and name HE# and segid A ) 5.6 3.8 0.0 ! A_3.66 C13 1910 QQ assign (resid 35 and name HE# and segid A )(resid 36 and name HE2# and segid A ) 5.6 3.8 0.0 ! A_5.50r D55 664 QQ assign (resid 35 and name HE# and segid A )(resid 38 and name HB# and segid A ) 5.6 3.8 0.5 ! A_5.50 C435 95.9 Qm assign (resid 35 and name HG# and segid A )(resid 36 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D254 -828 QA assign (resid 36 and name HB1 and segid A )(resid 36 and name HG# and segid A ) 4.5 2.7 0.0 ! A_3.68 C151 1830 2Q assign (resid 36 and name HB2 and segid A )(resid 36 and name HG# and segid A ) 4.5 2.7 0.0 ! A_3.68r C153 1830 1Q assign (resid 36 and name HB# and segid A )(resid 39 and name HE# and segid A ) 5.6 3.8 1.0 ! A_5.39 C497 188 1P assign (resid 36 and name HE2# and segid A )(resid 36 and name HB# and segid A ) 5.6 3.8 1.0 ! A_4.44r N17 246 Q2 assign (resid 36 and name HE2# and segid A )(resid 36 and name HG# and segid A ) 5.6 3.8 0.0 ! A_4.42r N13 254 QQ assign (resid 36 and name HG# and segid A )(resid 37 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.47 C473 170 QA assign (resid 36 and name HG# and segid A )(resid 38 and name HN and segid A ) 5.6 3.8 0.0 ! A_5.50 N226 43.2 QA assign (resid 37 and name HA and segid A )(resid 39 and name HE# and segid A ) 5.6 3.8 0.0 ! A_4.77r C236 685 AP assign (resid 37 and name HA and segid A )(resid 40 and name HD# and segid A ) 5.6 3.8 0.0 ! A_4.28r C237 742 AP assign (resid 37 and name HB1 and segid A )(resid 40 and name HD# and segid A ) 5.6 3.8 0.0 ! A_5.50r D89 79 RP assign (resid 37 and name HN and segid A )(resid 39 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.50r N30 44.5 AP assign (resid 38 and name HB# and segid A )(resid 39 and name HD# and segid A ) 5.6 3.8 0.5 ! A_5.50r C440 41.6 mP assign (resid 38 and name HN and segid A )(resid 39 and name HD# and segid A ) 5.6 3.8 0.0 ! A_5.50r N219 17.5 AP assign (resid 39 and name HD# and segid A )(resid 39 and name HB1 and segid A ) 3.6 1.8 0.0 ! A_2.91r C507 7470 P2 assign (resid 39 and name HD# and segid A )(resid 39 and name HB2 and segid A ) 3.6 1.8 0.0 ! A_2.93r C508 7230 P1 assign (resid 39 and name HD# and segid A )(resid 40 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.90 C272 350 PA assign (resid 39 and name HD# and segid A )(resid 40 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_5.34 C354 197 P2 assign (resid 39 and name HD# and segid A )(resid 40 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_5.42 C356 181 P1 assign (resid 39 and name HE# and segid A )(resid 39 and name HB# and segid A ) 5.6 3.8 1.0 ! A_4.44 D61 3040 P2 assign (resid 39 and name HE# and segid A )(resid 40 and name HA and segid A ) 5.6 3.8 0.0 ! A_5.50 D87 563 PA assign (resid 39 and name HE# and segid A )(resid 40 and name HB# and segid A ) 5.6 3.8 1.0 ! A_5.31r C498 205 P1 assign (resid 39 and name HE# and segid A )(resid 40 and name HE# and segid A ) 5.6 3.8 0.0 ! A_5.50r D2 622 PP assign (resid 40 and name HD# and segid A )(resid 40 and name HB1 and segid A ) 5.6 3.8 0.0 ! A_3.85 C353 1410 P2 assign (resid 40 and name HD# and segid A )(resid 40 and name HB2 and segid A ) 5.6 3.8 0.0 ! A_3.99 C355 1140 P1 assign (resid 40 and name HD# and segid A )(resid 41 and name HA and segid A ) 5.6 3.8 0.0 ! A_4.72 C248 415 PA assign (resid 40 and name HD# and segid A )(resid 41 and name HN and segid A ) 5.6 3.8 0.0 ! A_4.60 N81 201 PA assign (resid 41 and name HA and segid A )(resid 45 and name HB# and segid A ) 4.5 2.7 0.0 ! A_3.34r C527 3320 AQ assign (resid 42 and name HN and segid A )(resid 45 and name HB# and segid A ) 5.6 3.8 0.0 ! A_5.29r N155 86.3 AQ assign (resid 44 and name HD# and segid A )(resid 44 and name HE# and segid A ) 3.0 1.2 0.0 ! A_2.40r C175 46600 QQ assign (resid 44 and name HE# and segid A )(resid 45 and name HB# and segid A ) 5.6 3.8 0.0 ! A_4.58 C396 498 QQ assign (resid 44 and name HN and segid A )(resid 44 and name HD# and segid A ) 5.6 3.8 0.0 ! A_5.50r N178 34 AQ assign (resid 45 and name HA and segid A )(resid 45 and name HB# and segid A ) 4.5 2.7 0.0 ! A_3.46r C257 2650 AQ assign (resid 46 and name HA and segid A )(resid 46 and name HG# and segid A ) 3.0 1.2 0.0 ! A_2.77r D243 91000 AQ assign (resid 46 and name HB2 and segid A )(resid 46 and name HD# and segid A ) 5.6 3.8 0.0 ! A_5.00r C317 291 1Q assign (resid 46 and name HB1 and segid A )(resid 46 and name HD# and segid A ) 5.6 3.8 0.0 ! A_5.24r C316 220 2Q assign (resid 46 and name HG# and segid A )(resid 46 and name HD# and segid A ) 3.6 1.8 0.0 ! A_2.53 D269 88300 QQ
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