Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
614286 | 2h41 RC | 7127 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! G1 ! P2 ! L3 ! G4 ! S5 ! H6 ! L7 ! V8 ! A9 ! T10 assign (resid 10 and name HA ) (resid 11 and name HB# ) 4.0 2.2 1.0 ! A.1494 at 2.64e+05 ! S11 ! E12 assign (resid 12 and name HB1 ) (resid 14 and name HG2# ) 4.0 2.2 1.5 ! A.1658 at 3.91e+05 assign (resid 12 and name HG# ) (resid 17 and name HD1# ) 4.0 2.2 1.5 ! A.1480 at -4.29e+05 ! S13 assign (resid 13 and name HB# ) (resid 14 and name HG2# ) 4.0 2.2 1.5 ! A.1657 at 9.36e+05 ! V14 assign (resid 14 and name HG1# ) (resid 14 and name HA ) 3.0 1.2 0.8 ! A.2998 at 1.94e+06 ! T15 assign (resid 15 and name HB ) (resid 16 and name HG# ) 4.0 2.2 1.0 ! A.1380 at -3.65e+05 assign (resid 15 and name HG2# ) (resid 16 and name HA ) 4.0 2.2 2.5 ! A.1446 at 2.05e+05 assign (resid 15 and name HG2# ) (resid 17 and name HG11 ) 3.0 1.2 0.8 ! A.2808 at -2.89e+06 assign (resid 15 and name HG2# ) (resid 17 and name HD1# ) 4.0 2.2 2.0 ! A.1483 at 2.76e+05 assign (resid 15 and name HG2# ) (resid 21 and name HB1 ) 4.0 2.2 2.5 ! A.2965 at 1.77e+05 assign (resid 15 and name HB ) (resid 23 and name HB ) 4.0 2.2 2.0 ! A.1373 at -1.77e+05 assign (resid 15 and name HB ) (resid 23 and name HG1# ) 4.0 2.2 2.5 ! A.1224 at 2.39e+05 assign (resid 15 and name HG2# ) (resid 23 and name HB ) 4.0 2.2 1.5 ! A.1548 at -7.30e+05 ! E16 assign (resid 16 and name HB2 ) (resid 23 and name HG2# ) 4.0 2.2 1.5 ! A.1560 at 7.89e+05 ! I17 assign (resid 17 and name HA ) (resid 17 and name HG12 ) 4.0 2.2 1.0 ! A.1489 at 5.48e+05 assign (resid 17 and name HA ) (resid 17 and name HG11 ) 4.0 2.2 1.0 ! A.1484 at 5.94e+05 assign (resid 17 and name HG2# ) (resid 17 and name HA ) 3.0 1.2 0.8 ! A.78 at 2.81e+06 assign (resid 17 and name HD1# ) (resid 17 and name HA ) 4.0 2.2 1.5 ! A.79 at 7.44e+05 assign (resid 17 and name HD1# ) (resid 17 and name HB ) 3.0 1.2 0.8 ! A.1454 at -1.84e+06 assign (resid 17 and name HB ) (resid 18 and name HG2# ) 4.0 2.2 2.5 ! A.1134 at -2.11e+05 assign (resid 17 and name HG2# ) (resid 18 and name HA ) 4.0 2.2 1.5 ! A.1492 at 3.75e+05 assign (resid 17 and name HG2# ) (resid 19 and name HA ) 4.0 2.2 2.5 ! A.89 at -2.17e+05 assign (resid 17 and name HG2# ) (resid 19 and name HB# ) 4.0 2.2 2.0 ! A.100 at 3.98e+05 assign (resid 17 and name HG2# ) (resid 21 and name HB1 ) 4.0 2.2 1.5 ! A.1529 at 8.65e+05 assign (resid 17 and name HA ) (resid 22 and name HA ) 4.0 2.2 1.0 ! A.1453 at 7.48e+05 ! T18 assign (resid 18 and name HG2# ) (resid 18 and name HA ) 3.0 1.2 0.8 ! A.80 at 4.31e+06 assign (resid 18 and name HB ) (resid 19 and name HB# ) 4.0 2.2 1.5 ! A.103 at 2.54e+05 assign (resid 18 and name HG2# ) (resid 21 and name HB1 ) 4.0 2.2 1.5 ! A.1521 at 2.97e+05 ! A19 assign (resid 19 and name HA ) (resid 20 and name HB1 ) 4.0 2.2 1.0 ! A.88 at -2.83e+05 assign (resid 19 and name HB# ) (resid 20 and name HB2 ) 4.0 2.2 2.5 ! A.1502 at 1.52e+05 assign (resid 19 and name HB# ) (resid 20 and name HB1 ) 4.0 2.2 1.5 ! A.1517 at 2.79e+05 assign (resid 19 and name HB# ) (resid 20 and name HA ) 4.0 2.2 1.5 ! A.96 at 3.98e+05 assign (resid 19 and name HA ) (resid 20 and name HA ) 4.0 2.2 1.0 ! A.109 at -3.29e+05 assign (resid 19 and name HB# ) (resid 64 and name HA ) 4.0 2.2 1.5 ! A.541 at 3.63e+05 assign (resid 19 and name HB# ) (resid 65 and name HA ) 3.0 1.2 0.8 ! A.95 at 3.14e+06 assign (resid 19 and name HB# ) (resid 65 and name HB1 ) 4.0 2.2 1.5 ! A.1083 at -3.16e+05 assign (resid 19 and name HB# ) (resid 65 and name HB2 ) 4.0 2.2 2.5 ! A.2443 at -2.48e+05 assign (resid 19 and name HA ) (resid 65 and name HA ) 4.0 2.2 1.0 ! A.2436 at -3.09e+05 assign (resid 19 and name HA ) (resid 68 and name HD1 ) 4.0 2.2 1.0 ! A.83 at 5.80e+05 assign (resid 19 and name HA ) (resid 68 and name HG# ) 4.0 2.2 1.0 ! A.1496 at -2.60e+05 assign (resid 19 and name HA ) (resid 68 and name HD2 ) 4.0 2.2 2.0 ! A.85 at 4.71e+05 assign (resid 19 and name HB# ) (resid 68 and name HG# ) 4.0 2.2 2.5 ! A.99 at 1.76e+05 assign (resid 19 and name HB# ) (resid 68 and name HD2 ) 4.0 2.2 2.5 ! A.92 at -1.93e+05 assign (resid 19 and name HB# ) (resid 68 and name HD1 ) 4.0 2.2 2.5 ! A.93 at -2.08e+05 ! S20 assign (resid 20 and name HB2 ) (resid 22 and name HD# ) 4.0 2.2 2.0 ! A.2871 at -1.58e+05 assign (resid 20 and name HB1 ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.866 at 5.13e+05 assign (resid 20 and name HB2 ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.1507 at 2.68e+05 assign (resid 20 and name HB2 ) (resid 66 and name HB2 ) 4.0 2.2 1.0 ! A.1508 at -8.77e+05 assign (resid 20 and name HB1 ) (resid 66 and name HB2 ) 4.0 2.2 1.0 ! A.1515 at -6.58e+05 assign (resid 20 and name HA ) (resid 66 and name HB2 ) 4.0 2.2 1.0 ! A.2480 at -2.74e+05 assign (resid 20 and name HB1 ) (resid 66 and name HD2# ) 4.0 2.2 2.5 ! A.950 at 2.49e+05 assign (resid 20 and name HB1 ) (resid 67 and name HA ) 4.0 2.2 2.0 ! A.1512 at -2.33e+05 assign (resid 20 and name HB1 ) (resid 68 and name HB1 ) 4.0 2.2 1.0 ! A.2541 at 3.03e+05 assign (resid 20 and name HB2 ) (resid 95 and name HB ) 3.0 1.2 0.3 ! A.1350 at 2.18e+06 assign (resid 20 and name HB2 ) (resid 95 and name HG2# ) 3.0 1.2 0.8 ! A.1159 at 1.62e+06 assign (resid 20 and name HA ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.111 at 3.05e+05 assign (resid 20 and name HB2 ) (resid 95 and name HA ) 4.0 2.2 1.0 ! A.823 at 5.34e+05 assign (resid 20 and name HB1 ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.1510 at 9.24e+05 assign (resid 20 and name HB1 ) (resid 95 and name HA ) 4.0 2.2 1.0 ! A.1513 at 2.56e+05 ! S21 assign (resid 21 and name HB2 ) (resid 23 and name HG2# ) 4.0 2.2 1.5 ! A.1527 at 3.79e+05 assign (resid 21 and name HB2 ) (resid 63 and name HG2# ) 4.0 2.2 2.5 ! A.928 at 1.97e+05 assign (resid 21 and name HA ) (resid 63 and name HB ) 4.0 2.2 1.0 ! A.169 at -3.17e+05 assign (resid 21 and name HA ) (resid 63 and name HG2# ) 4.0 2.2 2.5 ! A.122 at 2.30e+05 assign (resid 21 and name HB1 ) (resid 64 and name HB1 ) 4.0 2.2 1.0 ! A.1528 at -2.74e+05 assign (resid 21 and name HB1 ) (resid 64 and name HA ) 3.0 1.2 0.3 ! A.1523 at 2.52e+06 assign (resid 21 and name HB2 ) (resid 64 and name HB1 ) 4.0 2.2 1.0 ! A.2863 at -2.84e+05 assign (resid 21 and name HB2 ) (resid 64 and name HA ) 3.0 1.2 0.3 ! A.1524 at 2.43e+06 assign (resid 21 and name HA ) (resid 64 and name HA ) 3.0 1.2 0.3 ! A.530 at 1.99e+06 assign (resid 21 and name HA ) (resid 66 and name HD1# ) 3.0 1.2 0.8 ! A.860 at 1.83e+06 assign (resid 21 and name HA ) (resid 66 and name HG ) 4.0 2.2 1.0 ! A.2460 at 5.38e+05 assign (resid 21 and name HA ) (resid 66 and name HB2 ) 4.0 2.2 1.0 ! A.2479 at -3.32e+05 assign (resid 21 and name HA ) (resid 66 and name HD2# ) 4.0 2.2 1.5 ! A.949 at 3.64e+05 assign (resid 21 and name HA ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.1520 at 2.96e+05 ! F22 assign (resid 22 and name HB1 ) (resid 22 and name HD# ) 4.0 2.2 1.0 ! A.1176 at 9.15e+05 assign (resid 22 and name HB2 ) (resid 22 and name HD# ) 3.0 1.2 0.3 ! A.143 at 1.03e+06 assign (resid 22 and name HA ) (resid 22 and name HD# ) 4.0 2.2 1.0 ! A.142 at -5.63e+05 assign (resid 22 and name HA ) (resid 23 and name HG2# ) 4.0 2.2 1.5 ! A.1553 at 7.45e+05 assign (resid 22 and name HA ) (resid 23 and name HA ) 4.0 2.2 1.0 ! A.154 at 3.54e+05 assign (resid 22 and name HD# ) (resid 23 and name HA ) 4.0 2.2 2.0 ! A.1531 at -2.00e+05 assign (resid 22 and name HA ) (resid 23 and name HB ) 4.0 2.2 2.0 ! A.132 at -2.39e+05 assign (resid 22 and name HD# ) (resid 24 and name HG2# ) 3.0 1.2 0.8 ! A.147 at -1.52e+06 assign (resid 22 and name HE# ) (resid 24 and name HG2# ) 4.0 2.2 1.5 ! A.1599 at -1.65e+06 assign (resid 22 and name HD# ) (resid 24 and name HG1# ) 4.0 2.2 2.5 ! A.1589 at -4.36e+05 assign (resid 22 and name HB2 ) (resid 24 and name HG2# ) 4.0 2.2 1.5 ! A.1409 at -3.67e+05 assign (resid 22 and name HD# ) (resid 24 and name HB ) 4.0 2.2 2.0 ! A.1573 at 2.26e+05 assign (resid 22 and name HD# ) (resid 61 and name HG1# ) 4.0 2.2 2.5 ! A.2315 at -1.70e+05 assign (resid 22 and name HD# ) (resid 63 and name HB ) 4.0 2.2 1.0 ! A.2371 at 2.77e+05 assign (resid 22 and name HE# ) (resid 63 and name HG2# ) 4.0 2.2 2.5 ! A.138 at -2.27e+05 assign (resid 22 and name HE# ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.140 at -5.28e+05 assign (resid 22 and name HB2 ) (resid 63 and name HB ) 4.0 2.2 1.0 ! A.2373 at 3.40e+05 assign (resid 22 and name HD# ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.135 at -6.70e+05 assign (resid 22 and name HE# ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.858 at -9.50e+05 assign (resid 22 and name HZ ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.2457 at -2.78e+05 assign (resid 22 and name HB2 ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.862 at -4.12e+05 assign (resid 22 and name HB1 ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.864 at -4.13e+05 assign (resid 22 and name HZ ) (resid 72 and name HB2 ) 4.0 2.2 1.0 ! A.1167 at 3.04e+05 assign (resid 22 and name HD# ) (resid 74 and name HB ) 4.0 2.2 2.0 ! A.1177 at 2.37e+05 assign (resid 22 and name HZ ) (resid 74 and name HG2# ) 4.0 2.2 1.5 ! A.1169 at -1.49e+06 assign (resid 22 and name HE# ) (resid 74 and name HG2# ) 3.0 1.2 0.8 ! A.1170 at -1.04e+06 assign (resid 22 and name HD# ) (resid 91 and name HG2# ) 4.0 2.2 2.5 ! A.1146 at -2.74e+05 assign (resid 22 and name HE# ) (resid 93 and name HB# ) 4.0 2.2 2.0 ! A.2990 at -2.24e+05 assign (resid 22 and name HZ ) (resid 93 and name HB# ) 4.0 2.2 2.0 ! A.2988 at -1.99e+05 assign (resid 22 and name HE# ) (resid 93 and name HG1 ) 4.0 2.2 2.0 ! A.1178 at 2.25e+05 assign (resid 22 and name HD# ) (resid 95 and name HB ) 4.0 2.2 2.0 ! A.1355 at -1.37e+05 assign (resid 22 and name HD# ) (resid 95 and name HA ) 4.0 2.2 1.0 ! A.2997 at -3.09e+05 assign (resid 22 and name HE# ) (resid 95 and name HG2# ) 3.0 1.2 0.8 ! A.134 at -1.20e+06 assign (resid 22 and name HZ ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.1166 at -3.84e+05 assign (resid 22 and name HD# ) (resid 95 and name HG2# ) 3.0 1.2 0.8 ! A.1164 at -1.44e+06 assign (resid 22 and name HB2 ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.3003 at -3.19e+05 assign (resid 22 and name HA ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.3001 at 2.69e+05 assign (resid 22 and name HB1 ) (resid 95 and name HG2# ) 4.0 2.2 2.5 ! A.2567 at -2.77e+05 ! V23 assign (resid 23 and name HA ) (resid 23 and name HG2# ) 3.0 1.2 0.8 ! A.1555 at 4.72e+06 assign (resid 23 and name HA ) (resid 23 and name HG1# ) 3.0 1.2 0.8 ! A.1216 at 3.43e+06 assign (resid 23 and name HG1# ) (resid 24 and name HA ) 4.0 2.2 1.5 ! A.1235 at 2.80e+05 assign (resid 23 and name HA ) (resid 24 and name HG1# ) 4.0 2.2 1.5 ! A.158 at 4.57e+05 assign (resid 23 and name HG1# ) (resid 25 and name HB# ) 3.0 1.2 0.8 ! A.1608 at 1.21e+06 assign (resid 23 and name HG1# ) (resid 25 and name HA ) 4.0 2.2 1.5 ! A.1219 at 5.86e+05 assign (resid 23 and name HG1# ) (resid 60 and name HB1 ) 4.0 2.2 1.5 ! A.2285 at 1.91e+06 assign (resid 23 and name HG1# ) (resid 60 and name HB2 ) 3.0 1.2 0.8 ! A.2291 at 2.13e+06 assign (resid 23 and name HG2# ) (resid 60 and name HB2 ) 4.0 2.2 1.5 ! A.1557 at 4.04e+05 assign (resid 23 and name HG1# ) (resid 60 and name HA ) 4.0 2.2 1.5 ! A.1218 at 5.47e+05 assign (resid 23 and name HA ) (resid 60 and name HB2 ) 4.0 2.2 2.0 ! A.156 at 1.68e+05 assign (resid 23 and name HA ) (resid 61 and name HG1# ) 4.0 2.2 1.5 ! A.157 at 3.89e+05 assign (resid 23 and name HB ) (resid 62 and name HA ) 4.0 2.2 1.0 ! A.2344 at 3.24e+05 assign (resid 23 and name HG2# ) (resid 62 and name HA ) 3.0 1.2 0.8 ! A.2348 at -3.13e+06 assign (resid 23 and name HA ) (resid 62 and name HA ) 2.5 0.7 0.2 ! A.2342 at -6.14e+06 assign (resid 23 and name HG1# ) (resid 62 and name HA ) 3.0 1.2 0.8 ! A.2350 at -2.43e+06 assign (resid 23 and name HG2# ) (resid 62 and name HB2 ) 3.0 1.2 0.8 ! A.1559 at -1.65e+06 assign (resid 23 and name HG1# ) (resid 62 and name HB1 ) 4.0 2.2 1.5 ! A.1227 at -2.55e+05 assign (resid 23 and name HG1# ) (resid 62 and name HB2 ) 4.0 2.2 1.5 ! A.1226 at -3.34e+05 assign (resid 23 and name HA ) (resid 62 and name HB2 ) 4.0 2.2 1.0 ! A.152 at -5.15e+05 assign (resid 23 and name HA ) (resid 62 and name HB1 ) 4.0 2.2 1.0 ! A.1536 at -4.21e+05 assign (resid 23 and name HG2# ) (resid 62 and name HB1 ) 3.0 1.2 0.8 ! A.2354 at -1.11e+06 assign (resid 23 and name HA ) (resid 63 and name HD1# ) 4.0 2.2 2.5 ! A.153 at 1.80e+05 ! V24 assign (resid 24 and name HA ) (resid 24 and name HG2# ) 3.0 1.2 0.8 ! A.1135 at 2.81e+06 assign (resid 24 and name HA ) (resid 24 and name HG1# ) 3.0 1.2 0.8 ! A.1583 at 2.83e+06 assign (resid 24 and name HG1# ) (resid 25 and name HB# ) 4.0 2.2 1.5 ! A.1607 at 6.33e+05 assign (resid 24 and name HA ) (resid 25 and name HB# ) 4.0 2.2 1.0 ! A.1609 at 3.57e+05 assign (resid 24 and name HG1# ) (resid 25 and name HA ) 4.0 2.2 1.5 ! A.1585 at 4.71e+05 assign (resid 24 and name HA ) (resid 25 and name HA ) 4.0 2.2 2.0 ! A.1570 at 2.40e+05 assign (resid 24 and name HG1# ) (resid 26 and name HB1 ) 4.0 2.2 1.5 ! A.1621 at 2.61e+05 assign (resid 24 and name HG1# ) (resid 26 and name HB2 ) 4.0 2.2 2.5 ! A.1630 at 1.51e+05 assign (resid 24 and name HG1# ) (resid 26 and name HD1 ) 4.0 2.2 2.5 ! A.185 at -1.87e+05 assign (resid 24 and name HG1# ) (resid 26 and name HH2 ) 4.0 2.2 2.5 ! A.1588 at -2.02e+05 assign (resid 24 and name HG1# ) (resid 26 and name HZ3 ) 4.0 2.2 1.5 ! A.1586 at -6.90e+05 assign (resid 24 and name HG1# ) (resid 26 and name HE3 ) 3.0 1.2 0.8 ! A.1587 at -1.72e+06 assign (resid 24 and name HB ) (resid 26 and name HZ3 ) 4.0 2.2 1.0 ! A.1572 at 2.68e+05 assign (resid 24 and name HB ) (resid 26 and name HE3 ) 4.0 2.2 2.0 ! A.1571 at 2.08e+05 assign (resid 24 and name HG1# ) (resid 60 and name HB2 ) 4.0 2.2 2.5 ! A.2293 at 2.48e+05 assign (resid 24 and name HG1# ) (resid 60 and name HA ) 4.0 2.2 1.5 ! A.1584 at 3.43e+05 assign (resid 24 and name HB ) (resid 60 and name HA ) 4.0 2.2 2.0 ! A.2282 at -1.87e+05 assign (resid 24 and name HB ) (resid 61 and name HG1# ) 3.0 1.2 0.8 ! A.2326 at -2.38e+06 assign (resid 24 and name HG2# ) (resid 63 and name HG11 ) 4.0 2.2 1.5 ! A.2398 at 5.69e+05 assign (resid 24 and name HG1# ) (resid 63 and name HD1# ) 4.0 2.2 2.0 ! A.1595 at 9.44e+05 assign (resid 24 and name HB ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.1582 at -4.54e+05 assign (resid 24 and name HG1# ) (resid 76 and name HG1# ) 4.0 2.2 2.0 ! A.1596 at 4.35e+05 assign (resid 24 and name HG1# ) (resid 76 and name HG2# ) 2.5 0.7 1.2 ! A.1597 at 5.24e+06 assign (resid 24 and name HB ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.887 at -2.67e+05 assign (resid 24 and name HG1# ) (resid 89 and name HG ) 4.0 2.2 1.5 ! A.2933 at 3.06e+05 assign (resid 24 and name HB ) (resid 89 and name HD2# ) 4.0 2.2 1.5 ! A.2929 at -4.34e+05 assign (resid 24 and name HG2# ) (resid 91 and name HG2# ) 3.0 1.2 1.3 ! A.1152 at 2.75e+06 ! S25 assign (resid 25 and name HB# ) (resid 26 and name HE3 ) 4.0 2.2 2.0 ! A.1612 at -1.64e+05 assign (resid 25 and name HA ) (resid 26 and name HE3 ) 4.0 2.2 1.0 ! A.190 at -5.99e+05 assign (resid 25 and name HA ) (resid 26 and name HZ3 ) 4.0 2.2 2.0 ! A.119 at -2.19e+05 assign (resid 25 and name HB# ) (resid 59 and name HB ) 4.0 2.2 1.0 ! A.1376 at 4.28e+05 assign (resid 25 and name HA ) (resid 59 and name HA ) 4.0 2.2 2.0 ! A.494 at 2.30e+05 assign (resid 25 and name HB# ) (resid 60 and name HA ) 3.0 1.2 0.3 ! A.1610 at 1.79e+06 assign (resid 25 and name HA ) (resid 60 and name HB1 ) 3.0 1.2 0.3 ! A.2283 at 1.74e+06 assign (resid 25 and name HA ) (resid 60 and name HB2 ) 3.0 1.2 0.3 ! A.2289 at 1.75e+06 assign (resid 25 and name HA ) (resid 60 and name HA ) 2.5 0.7 0.2 ! A.168 at 8.65e+06 assign (resid 25 and name HA ) (resid 61 and name HG1# ) 4.0 2.2 1.5 ! A.2321 at 2.85e+05 assign (resid 25 and name HA ) (resid 76 and name HG2# ) 4.0 2.2 2.5 ! A.2704 at 1.77e+05 assign (resid 25 and name HB# ) (resid 89 and name HD2# ) 4.0 2.2 2.5 ! A.2923 at 1.93e+05 ! W26 assign (resid 26 and name HE3 ) (resid 26 and name HB1 ) 4.0 2.2 1.0 ! A.1439 at -4.90e+05 assign (resid 26 and name HD1 ) (resid 26 and name HB1 ) 4.0 2.2 1.0 ! A.1440 at -3.75e+05 assign (resid 26 and name HD1 ) (resid 26 and name HB2 ) 4.0 2.2 1.0 ! A.1623 at -4.32e+05 assign (resid 26 and name HE3 ) (resid 26 and name HB2 ) 4.0 2.2 1.0 ! A.1624 at -4.48e+05 assign (resid 26 and name HA ) (resid 26 and name HE3 ) 4.0 2.2 2.0 ! A.192 at -2.27e+05 assign (resid 26 and name HD1 ) (resid 26 and name HA ) 4.0 2.2 1.0 ! A.170 at -3.98e+05 assign (resid 26 and name HD1 ) (resid 27 and name HA ) 4.0 2.2 1.0 ! A.77 at -5.78e+05 assign (resid 26 and name HA ) (resid 27 and name HG* ) 3.0 1.2 0.8 ! A.1655 at 1.05e+06 assign (resid 26 and name HB2 ) (resid 27 and name HA ) 4.0 2.2 2.0 ! A.475 at 1.69e+05 assign (resid 26 and name HA ) (resid 27 and name HA ) 4.0 2.2 1.0 ! A.242 at 2.76e+05 assign (resid 26 and name HA ) (resid 27 and name HB ) 4.0 2.2 1.0 ! A.177 at -3.10e+05 assign (resid 26 and name HD1 ) (resid 28 and name HB# ) 4.0 2.2 1.0 ! A.1662 at -9.64e+05 assign (resid 26 and name HD1 ) (resid 28 and name HA ) 4.0 2.2 1.0 ! A.182 at -2.84e+05 assign (resid 26 and name HZ2 ) (resid 36 and name HB1 ) 4.0 2.2 1.0 ! A.216 at -4.49e+05 assign (resid 26 and name HZ2 ) (resid 36 and name HD# ) 4.0 2.2 2.0 ! A.218 at -2.36e+05 assign (resid 26 and name HD1 ) (resid 36 and name HE# ) 4.0 2.2 2.0 ! A.1058 at 2.36e+05 assign (resid 26 and name HZ2 ) (resid 36 and name HE# ) 4.0 2.2 2.0 ! A.1060 at -1.94e+05 assign (resid 26 and name HD1 ) (resid 36 and name HZ ) 4.0 2.2 2.0 ! A.1076 at 1.69e+05 assign (resid 26 and name HZ2 ) (resid 36 and name HB2 ) 4.0 2.2 1.0 ! A.1744 at -3.24e+05 assign (resid 26 and name HZ2 ) (resid 38 and name HG2# ) 4.0 2.2 1.5 ! A.212 at 3.79e+05 assign (resid 26 and name HE3 ) (resid 38 and name HG2# ) 4.0 2.2 2.5 ! A.1263 at -2.43e+05 assign (resid 26 and name HZ3 ) (resid 38 and name HG2# ) 4.0 2.2 1.5 ! A.1262 at -4.41e+05 assign (resid 26 and name HH2 ) (resid 38 and name HG2# ) 4.0 2.2 1.5 ! A.1261 at -7.68e+05 assign (resid 26 and name HZ2 ) (resid 54 and name HD2# ) 4.0 2.2 1.5 ! A.214 at 3.07e+05 assign (resid 26 and name HZ2 ) (resid 54 and name HG ) 4.0 2.2 1.0 ! A.1765 at 2.65e+05 assign (resid 26 and name HZ2 ) (resid 54 and name HD1# ) 3.0 1.2 0.8 ! A.1635 at 1.16e+06 assign (resid 26 and name HZ2 ) (resid 54 and name HB1 ) 4.0 2.2 1.0 ! A.2211 at -2.57e+05 assign (resid 26 and name HH2 ) (resid 54 and name HG ) 4.0 2.2 2.0 ! A.2175 at -2.34e+05 assign (resid 26 and name HH2 ) (resid 54 and name HD1# ) 3.0 1.2 0.8 ! A.2184 at -1.54e+06 assign (resid 26 and name HZ2 ) (resid 54 and name HB2 ) 4.0 2.2 2.0 ! A.2220 at -2.22e+05 assign (resid 26 and name HH2 ) (resid 54 and name HD2# ) 4.0 2.2 1.5 ! A.2115 at -4.26e+05 assign (resid 26 and name HH2 ) (resid 54 and name HB2 ) 4.0 2.2 2.0 ! A.233 at 1.52e+05 assign (resid 26 and name HZ2 ) (resid 58 and name HB# ) 3.0 1.2 0.8 ! A.208 at 1.74e+06 assign (resid 26 and name HH2 ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.1098 at -5.25e+05 assign (resid 26 and name HZ2 ) (resid 59 and name HA ) 4.0 2.2 1.0 ! A.217 at 4.62e+05 assign (resid 26 and name HD1 ) (resid 59 and name HB ) 4.0 2.2 2.0 ! A.1381 at -1.86e+05 assign (resid 26 and name HD1 ) (resid 59 and name HA ) 4.0 2.2 1.0 ! A.484 at -5.18e+05 assign (resid 26 and name HZ3 ) (resid 60 and name HA ) 4.0 2.2 1.0 ! A.499 at -3.49e+05 assign (resid 26 and name HE3 ) (resid 60 and name HA ) 4.0 2.2 1.0 ! A.500 at -4.26e+05 assign (resid 26 and name HH2 ) (resid 60 and name HA ) 4.0 2.2 1.0 ! A.501 at -2.76e+05 assign (resid 26 and name HZ2 ) (resid 61 and name HB ) 4.0 2.2 1.0 ! A.215 at -3.21e+05 assign (resid 26 and name HZ2 ) (resid 61 and name HG1# ) 4.0 2.2 1.5 ! A.213 at 3.11e+05 assign (resid 26 and name HH2 ) (resid 61 and name HG1# ) 3.0 1.2 0.8 ! A.2316 at -1.41e+06 assign (resid 26 and name HZ3 ) (resid 61 and name HG1# ) 3.0 1.2 0.8 ! A.2317 at -1.40e+06 assign (resid 26 and name HE3 ) (resid 61 and name HG1# ) 4.0 2.2 1.5 ! A.2318 at -5.02e+05 assign (resid 26 and name HH2 ) (resid 61 and name HB ) 4.0 2.2 1.0 ! A.224 at 7.36e+05 assign (resid 26 and name HH2 ) (resid 61 and name HG2# ) 4.0 2.2 1.5 ! A.229 at -2.74e+05 assign (resid 26 and name HH2 ) (resid 61 and name HA ) 4.0 2.2 2.0 ! A.231 at -1.86e+05 assign (resid 26 and name HZ3 ) (resid 61 and name HB ) 4.0 2.2 2.0 ! A.2335 at 2.23e+05 assign (resid 26 and name HB1 ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.1618 at 2.84e+05 assign (resid 26 and name HB1 ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.1620 at 2.53e+05 assign (resid 26 and name HB2 ) (resid 76 and name HG1# ) 4.0 2.2 2.5 ! A.1629 at 2.42e+05 assign (resid 26 and name HB2 ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.1632 at 2.62e+05 assign (resid 26 and name HZ2 ) (resid 76 and name HG1# ) 4.0 2.2 2.5 ! A.210 at 1.89e+05 assign (resid 26 and name HA ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.180 at 2.85e+05 assign (resid 26 and name HH2 ) (resid 76 and name HG2# ) 4.0 2.2 2.5 ! A.878 at -1.66e+05 assign (resid 26 and name HZ3 ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.877 at -2.52e+05 assign (resid 26 and name HE3 ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.876 at -8.64e+05 assign (resid 26 and name HD1 ) (resid 76 and name HG1# ) 4.0 2.2 2.5 ! A.902 at -2.09e+05 assign (resid 26 and name HE3 ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.898 at -4.06e+05 assign (resid 26 and name HA ) (resid 76 and name HG1# ) 4.0 2.2 2.5 ! A.904 at 1.58e+05 assign (resid 26 and name HZ3 ) (resid 76 and name HG1# ) 4.0 2.2 2.5 ! A.897 at -1.94e+05 assign (resid 26 and name HH2 ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.895 at -2.78e+05 assign (resid 26 and name HB1 ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.1619 at 4.98e+05 assign (resid 26 and name HB2 ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.1628 at 6.00e+05 assign (resid 26 and name HB2 ) (resid 88 and name HG12 ) 4.0 2.2 1.0 ! A.1627 at 6.60e+05 assign (resid 26 and name HB2 ) (resid 88 and name HG2# ) 4.0 2.2 2.5 ! A.1633 at 1.48e+05 assign (resid 26 and name HD1 ) (resid 88 and name HD1# ) 3.0 1.2 0.8 ! A.1028 at -1.13e+06 assign (resid 26 and name HA ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.178 at 4.57e+05 assign (resid 26 and name HB1 ) (resid 89 and name HD1# ) 4.0 2.2 1.5 ! A.2128 at 4.67e+05 assign (resid 26 and name HB1 ) (resid 89 and name HD2# ) 4.0 2.2 1.5 ! A.1617 at 6.14e+05 assign (resid 26 and name HB2 ) (resid 89 and name HD1# ) 4.0 2.2 1.5 ! A.1631 at 3.35e+05 assign (resid 26 and name HB2 ) (resid 89 and name HD2# ) 4.0 2.2 1.5 ! A.2925 at 5.14e+05 assign (resid 26 and name HA ) (resid 89 and name HD2# ) 3.0 1.2 0.8 ! A.175 at 1.11e+06 assign (resid 26 and name HE3 ) (resid 89 and name HD2# ) 4.0 2.2 1.5 ! A.2919 at -4.41e+05 assign (resid 26 and name HA ) (resid 89 and name HD1# ) 4.0 2.2 1.5 ! A.2118 at 7.82e+05 assign (resid 26 and name HA ) (resid 89 and name HB2 ) 4.0 2.2 2.0 ! A.1615 at -2.03e+05 ! V27 assign (resid 27 and name HA ) (resid 27 and name HG* ) 3.0 1.2 0.8 ! A.1656 at 4.18e+06 assign (resid 27 and name HA ) (resid 28 and name HB# ) 4.0 2.2 1.0 ! A.1664 at 5.17e+05 assign (resid 27 and name HA ) (resid 28 and name HA ) 4.0 2.2 1.0 ! A.241 at 4.14e+05 assign (resid 27 and name HB ) (resid 28 and name HA ) 4.0 2.2 2.0 ! A.1501 at -2.08e+05 assign (resid 27 and name HG* ) (resid 29 and name HA ) 4.0 2.2 1.5 ! A.249 at -4.85e+05 assign (resid 27 and name HB ) (resid 29 and name HB# ) 4.0 2.2 1.5 ! A.1096 at -4.62e+05 assign (resid 27 and name HA ) (resid 59 and name HG2# ) 3.0 1.2 0.8 ! A.2278 at 1.02e+06 assign (resid 27 and name HA ) (resid 59 and name HA ) 4.0 2.2 2.0 ! A.476 at 2.21e+05 assign (resid 27 and name HA ) (resid 59 and name HB ) 4.0 2.2 1.0 ! A.243 at 5.32e+05 ! S28 assign (resid 28 and name HB# ) (resid 29 and name HA ) 4.0 2.2 1.0 ! A.250 at -3.34e+05 assign (resid 28 and name HB# ) (resid 29 and name HB# ) 4.0 2.2 1.5 ! A.1089 at 3.02e+05 assign (resid 28 and name HA ) (resid 29 and name HB# ) 4.0 2.2 1.5 ! A.1086 at 7.75e+05 assign (resid 28 and name HB# ) (resid 33 and name HG2# ) 4.0 2.2 1.5 ! A.1667 at 1.25e+06 assign (resid 28 and name HA ) (resid 33 and name HG1# ) 4.0 2.2 1.5 ! A.1230 at 5.46e+05 assign (resid 28 and name HB# ) (resid 33 and name HG1# ) 3.0 1.2 0.8 ! A.1240 at 1.04e+06 assign (resid 28 and name HA ) (resid 33 and name HG2# ) 4.0 2.2 1.5 ! A.265 at 6.14e+05 assign (resid 28 and name HB# ) (resid 36 and name HE# ) 4.0 2.2 1.0 ! A.1063 at -6.12e+05 assign (resid 28 and name HB# ) (resid 36 and name HD# ) 4.0 2.2 2.0 ! A.303 at -1.51e+05 assign (resid 28 and name HA ) (resid 36 and name HZ ) 4.0 2.2 1.0 ! A.245 at -3.19e+05 assign (resid 28 and name HB# ) (resid 36 and name HZ ) 3.0 1.2 0.3 ! A.1661 at -1.29e+06 assign (resid 28 and name HA ) (resid 36 and name HE# ) 4.0 2.2 2.0 ! A.246 at -1.95e+05 assign (resid 28 and name HB# ) (resid 59 and name HG2# ) 3.0 1.2 0.8 ! A.1666 at 1.71e+06 assign (resid 28 and name HB# ) (resid 59 and name HA ) 4.0 2.2 2.0 ! A.1670 at 2.09e+05 assign (resid 28 and name HA ) (resid 59 and name HG2# ) 3.0 1.2 0.8 ! A.107 at 1.44e+06 assign (resid 28 and name HB# ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.1668 at 8.41e+05 assign (resid 28 and name HB# ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.1669 at 2.52e+05 assign (resid 28 and name HA ) (resid 88 and name HD1# ) 3.0 1.2 0.8 ! A.825 at 1.08e+06 assign (resid 28 and name HA ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.1500 at 3.49e+05 ! A29 assign (resid 29 and name HA ) (resid 30 and name HB2 ) 4.0 2.2 1.0 ! A.251 at -3.04e+05 assign (resid 29 and name HB# ) (resid 30 and name HB1 ) 4.0 2.2 1.5 ! A.1091 at 2.77e+05 assign (resid 29 and name HB# ) (resid 30 and name HB2 ) 4.0 2.2 1.5 ! A.1087 at 2.53e+05 assign (resid 29 and name HA ) (resid 33 and name HG1# ) 4.0 2.2 2.5 ! A.253 at -2.23e+05 assign (resid 29 and name HB# ) (resid 33 and name HG2# ) 4.0 2.2 2.0 ! A.1252 at 6.96e+05 assign (resid 29 and name HB# ) (resid 33 and name HG1# ) 4.0 2.2 2.0 ! A.1707 at 6.21e+05 assign (resid 29 and name HB# ) (resid 36 and name HZ ) 4.0 2.2 1.5 ! A.1085 at -3.07e+05 assign (resid 29 and name HA ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.252 at -2.61e+05 assign (resid 29 and name HB# ) (resid 88 and name HD1# ) 4.0 2.2 2.0 ! A.1095 at 3.41e+05 assign (resid 29 and name HB# ) (resid 88 and name HG2# ) 3.0 1.2 1.3 ! A.1094 at 1.02e+06 ! S30 assign (resid 30 and name HB2 ) (resid 33 and name HG1# ) 3.0 1.2 0.8 ! A.1518 at 1.97e+06 assign (resid 30 and name HB2 ) (resid 33 and name HB ) 4.0 2.2 2.0 ! A.1681 at -2.14e+05 assign (resid 30 and name HB2 ) (resid 33 and name HG2# ) 4.0 2.2 1.5 ! A.1255 at 8.57e+05 assign (resid 30 and name HA ) (resid 33 and name HB ) 4.0 2.2 2.0 ! A.1652 at -2.45e+05 ! D31 assign (resid 31 and name HB# ) (resid 32 and name HG2# ) 4.0 2.2 1.5 ! A.1126 at -7.35e+05 assign (resid 31 and name HB# ) (resid 32 and name HA ) 4.0 2.2 1.0 ! A.1693 at -2.72e+05 assign (resid 31 and name HA ) (resid 32 and name HA ) 4.0 2.2 1.0 ! A.1565 at 2.68e+05 assign (resid 31 and name HA ) (resid 32 and name HG2# ) 4.0 2.2 2.5 ! A.1686 at 2.05e+05 assign (resid 31 and name HA ) (resid 33 and name HG2# ) 4.0 2.2 1.5 ! A.1247 at 6.38e+05 assign (resid 31 and name HA ) (resid 33 and name HG1# ) 4.0 2.2 1.5 ! A.1229 at 5.68e+05 ! T32 assign (resid 32 and name HA ) (resid 32 and name HG2# ) 2.5 0.7 0.7 ! A.1122 at 6.59e+06 assign (resid 32 and name HB ) (resid 33 and name HA ) 4.0 2.2 1.0 ! A.1696 at 2.54e+05 assign (resid 32 and name HG2# ) (resid 81 and name HB# ) 4.0 2.2 1.5 ! A.2825 at 3.99e+05 assign (resid 32 and name HA ) (resid 81 and name HB# ) 4.0 2.2 2.0 ! A.2827 at 2.18e+05 assign (resid 32 and name HB ) (resid 81 and name HB# ) 4.0 2.2 1.0 ! A.2021 at 5.16e+05 assign (resid 32 and name HB ) (resid 81 and name HG# ) 4.0 2.2 1.0 ! A.1364 at -6.62e+05 assign (resid 32 and name HG2# ) (resid 81 and name HG# ) 4.0 2.2 1.5 ! A.1125 at -5.30e+05 assign (resid 32 and name HA ) (resid 81 and name HG# ) 4.0 2.2 1.0 ! A.1567 at -5.20e+05 ! V33 assign (resid 33 and name HA ) (resid 33 and name HG2# ) 3.0 1.2 0.8 ! A.1250 at 3.55e+06 assign (resid 33 and name HA ) (resid 33 and name HG1# ) 3.0 1.2 0.8 ! A.1234 at 3.25e+06 assign (resid 33 and name HA ) (resid 34 and name HB# ) 4.0 2.2 1.0 ! A.1724 at 3.78e+05 assign (resid 33 and name HG2# ) (resid 34 and name HA ) 4.0 2.2 1.5 ! A.1248 at 4.00e+05 assign (resid 33 and name HA ) (resid 34 and name HA ) 4.0 2.2 1.0 ! A.1699 at 3.11e+05 assign (resid 33 and name HG2# ) (resid 35 and name HA1 ) 4.0 2.2 1.5 ! A.276 at -4.16e+05 assign (resid 33 and name HG2# ) (resid 35 and name HA2 ) 4.0 2.2 1.5 ! A.271 at -4.29e+05 assign (resid 33 and name HG1# ) (resid 36 and name HD# ) 4.0 2.2 1.5 ! A.297 at -4.71e+05 assign (resid 33 and name HG2# ) (resid 36 and name HE# ) 4.0 2.2 1.5 ! A.1065 at -8.94e+05 assign (resid 33 and name HG1# ) (resid 36 and name HZ ) 4.0 2.2 1.5 ! A.1079 at -8.75e+05 assign (resid 33 and name HG2# ) (resid 36 and name HZ ) 4.0 2.2 1.5 ! A.1080 at -7.12e+05 assign (resid 33 and name HG2# ) (resid 36 and name HA ) 4.0 2.2 2.5 ! A.1245 at 2.68e+05 assign (resid 33 and name HG1# ) (resid 36 and name HA ) 4.0 2.2 2.5 ! A.1232 at 2.07e+05 assign (resid 33 and name HG1# ) (resid 36 and name HE# ) 4.0 2.2 1.5 ! A.1238 at -4.95e+05 assign (resid 33 and name HG1# ) (resid 56 and name HB2 ) 3.0 1.2 0.8 ! A.2268 at 2.32e+06 assign (resid 33 and name HG2# ) (resid 56 and name HB2 ) 3.0 1.2 0.8 ! A.2267 at 2.32e+06 assign (resid 33 and name HB ) (resid 56 and name HB2 ) 4.0 2.2 1.0 ! A.1680 at -5.45e+05 assign (resid 33 and name HG2# ) (resid 56 and name HB1 ) 3.0 1.2 0.8 ! A.2271 at 1.22e+06 assign (resid 33 and name HG1# ) (resid 56 and name HB1 ) 3.0 1.2 0.8 ! A.2272 at 1.46e+06 assign (resid 33 and name HB ) (resid 56 and name HB1 ) 4.0 2.2 1.0 ! A.1649 at -3.51e+05 assign (resid 33 and name HG2# ) (resid 56 and name HA ) 3.0 1.2 0.8 ! A.1249 at 1.34e+06 assign (resid 33 and name HG1# ) (resid 56 and name HA ) 3.0 1.2 0.8 ! A.1233 at 1.36e+06 assign (resid 33 and name HB ) (resid 56 and name HA ) 4.0 2.2 1.0 ! A.1647 at -2.76e+05 assign (resid 33 and name HG1# ) (resid 78 and name HB1 ) 4.0 2.2 1.5 ! A.2768 at 7.97e+05 assign (resid 33 and name HA ) (resid 78 and name HG1 ) 4.0 2.2 1.0 ! A.1701 at -2.90e+05 assign (resid 33 and name HG1# ) (resid 78 and name HG1 ) 4.0 2.2 1.5 ! A.2069 at -5.60e+05 assign (resid 33 and name HG2# ) (resid 78 and name HG1 ) 4.0 2.2 1.5 ! A.2760 at -6.77e+05 assign (resid 33 and name HG2# ) (resid 79 and name HB ) 4.0 2.2 2.5 ! A.2787 at -1.94e+05 assign (resid 33 and name HG1# ) (resid 80 and name HB2 ) 4.0 2.2 2.5 ! A.2815 at 1.89e+05 assign (resid 33 and name HG2# ) (resid 80 and name HA ) 4.0 2.2 1.5 ! A.1246 at 7.02e+05 assign (resid 33 and name HG1# ) (resid 80 and name HA ) 4.0 2.2 1.5 ! A.1231 at 6.22e+05 assign (resid 33 and name HA ) (resid 80 and name HB1 ) 4.0 2.2 1.0 ! A.1698 at 5.03e+05 assign (resid 33 and name HA ) (resid 80 and name HB2 ) 4.0 2.2 1.0 ! A.1697 at 5.23e+05 assign (resid 33 and name HA ) (resid 80 and name HA ) 2.5 0.7 0.2 ! A.260 at 5.51e+06 assign (resid 33 and name HB ) (resid 80 and name HA ) 4.0 2.2 1.0 ! A.713 at -4.45e+05 assign (resid 33 and name HA ) (resid 81 and name HB# ) 4.0 2.2 2.0 ! A.263 at 2.28e+05 assign (resid 33 and name HA ) (resid 81 and name HG# ) 4.0 2.2 1.0 ! A.1700 at -2.71e+05 ! S34 assign (resid 34 and name HA ) (resid 35 and name HA1 ) 4.0 2.2 2.0 ! A.1344 at -1.77e+05 assign (resid 34 and name HA ) (resid 56 and name HB2 ) 4.0 2.2 1.0 ! A.2269 at 6.27e+05 assign (resid 34 and name HA ) (resid 56 and name HA ) 4.0 2.2 1.0 ! A.268 at 3.59e+05 assign (resid 34 and name HB# ) (resid 79 and name HG11 ) 4.0 2.2 2.0 ! A.1726 at 1.67e+05 assign (resid 34 and name HB# ) (resid 79 and name HG2# ) 3.0 1.2 0.8 ! A.1720 at 2.15e+06 assign (resid 34 and name HB# ) (resid 79 and name HD1# ) 4.0 2.2 2.5 ! A.1725 at 2.43e+05 assign (resid 34 and name HB# ) (resid 79 and name HB ) 3.0 1.2 0.3 ! A.1719 at -1.05e+06 assign (resid 34 and name HB# ) (resid 79 and name HG12 ) 4.0 2.2 2.0 ! A.1727 at 1.36e+05 assign (resid 34 and name HA ) (resid 79 and name HB ) 4.0 2.2 2.0 ! A.1716 at -1.99e+05 assign (resid 34 and name HB# ) (resid 80 and name HA ) 4.0 2.2 1.0 ! A.1723 at 7.17e+05 assign (resid 34 and name HB# ) (resid 81 and name HB# ) 4.0 2.2 1.0 ! A.2824 at 4.53e+05 assign (resid 34 and name HA ) (resid 81 and name HB# ) 4.0 2.2 2.0 ! A.2829 at 3.05e+05 assign (resid 34 and name HB# ) (resid 81 and name HA ) 3.0 1.2 0.3 ! A.1721 at 4.31e+06 assign (resid 34 and name HB# ) (resid 81 and name HG# ) 4.0 2.2 1.0 ! A.1718 at -9.22e+05 assign (resid 34 and name HA ) (resid 81 and name HG# ) 4.0 2.2 1.0 ! A.266 at -3.83e+05 ! G35 assign (resid 35 and name HA2 ) (resid 36 and name HA ) 4.0 2.2 2.0 ! A.1341 at -1.96e+05 assign (resid 35 and name HA2 ) (resid 36 and name HD# ) 4.0 2.2 2.0 ! A.1342 at 1.77e+05 assign (resid 35 and name HA1 ) (resid 55 and name HA ) 4.0 2.2 1.0 ! A.274 at -5.90e+05 assign (resid 35 and name HA2 ) (resid 55 and name HA ) 4.0 2.2 1.0 ! A.270 at -6.06e+05 assign (resid 35 and name HA1 ) (resid 56 and name HA ) 4.0 2.2 1.0 ! A.273 at -1.11e+06 assign (resid 35 and name HA2 ) (resid 56 and name HA ) 3.0 1.2 0.3 ! A.269 at -1.60e+06 assign (resid 35 and name HA1 ) (resid 79 and name HB ) 4.0 2.2 1.0 ! A.277 at 4.24e+05 assign (resid 35 and name HA1 ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.279 at -3.42e+05 assign (resid 35 and name HA2 ) (resid 79 and name HD1# ) 4.0 2.2 2.5 ! A.1340 at -2.01e+05 assign (resid 35 and name HA2 ) (resid 79 and name HB ) 4.0 2.2 2.0 ! A.272 at 2.43e+05 ! F36 assign (resid 36 and name HB1 ) (resid 36 and name HE# ) 4.0 2.2 1.0 ! A.1064 at 3.23e+05 assign (resid 36 and name HA ) (resid 36 and name HD# ) 4.0 2.2 1.0 ! A.290 at -6.90e+05 assign (resid 36 and name HB1 ) (resid 36 and name HD# ) 3.0 1.2 0.3 ! A.292 at 1.34e+06 assign (resid 36 and name HA ) (resid 36 and name HE# ) 4.0 2.2 1.0 ! A.1070 at -2.54e+05 assign (resid 36 and name HD# ) (resid 36 and name HB2 ) 4.0 2.2 1.0 ! A.1743 at 7.76e+05 assign (resid 36 and name HB1 ) (resid 38 and name HG2# ) 4.0 2.2 1.5 ! A.1738 at -3.98e+05 assign (resid 36 and name HB2 ) (resid 38 and name HG2# ) 4.0 2.2 1.5 ! A.1745 at -3.38e+05 assign (resid 36 and name HD# ) (resid 54 and name HD1# ) 4.0 2.2 2.5 ! A.304 at -1.97e+05 assign (resid 36 and name HD# ) (resid 54 and name HB2 ) 4.0 2.2 2.0 ! A.298 at 2.47e+05 assign (resid 36 and name HB2 ) (resid 54 and name HG ) 4.0 2.2 2.0 ! A.2176 at -2.40e+05 assign (resid 36 and name HB2 ) (resid 54 and name HD1# ) 4.0 2.2 1.5 ! A.2195 at -9.03e+05 assign (resid 36 and name HB2 ) (resid 54 and name HB1 ) 4.0 2.2 1.0 ! A.2217 at 7.19e+05 assign (resid 36 and name HB2 ) (resid 54 and name HB2 ) 4.0 2.2 1.0 ! A.2225 at 8.99e+05 assign (resid 36 and name HB1 ) (resid 54 and name HB2 ) 4.0 2.2 1.0 ! A.1753 at 8.93e+05 assign (resid 36 and name HB1 ) (resid 54 and name HD2# ) 4.0 2.2 1.5 ! A.1736 at -3.71e+05 assign (resid 36 and name HB1 ) (resid 54 and name HD1# ) 4.0 2.2 1.5 ! A.1737 at -5.69e+05 assign (resid 36 and name HB2 ) (resid 54 and name HD2# ) 4.0 2.2 1.5 ! A.1750 at -3.40e+05 assign (resid 36 and name HB1 ) (resid 54 and name HG ) 4.0 2.2 2.0 ! A.1740 at -2.14e+05 assign (resid 36 and name HA ) (resid 54 and name HB2 ) 4.0 2.2 1.0 ! A.285 at -2.69e+05 assign (resid 36 and name HE# ) (resid 56 and name HA ) 4.0 2.2 1.0 ! A.1062 at -7.36e+05 assign (resid 36 and name HD# ) (resid 56 and name HA ) 4.0 2.2 1.0 ! A.293 at -6.00e+05 assign (resid 36 and name HD# ) (resid 56 and name HB2 ) 4.0 2.2 2.0 ! A.301 at -1.55e+05 assign (resid 36 and name HZ ) (resid 56 and name HA ) 4.0 2.2 1.0 ! A.2259 at -4.62e+05 assign (resid 36 and name HE# ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.1066 at -2.98e+05 assign (resid 36 and name HD# ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.294 at -6.11e+05 assign (resid 36 and name HB1 ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.1735 at -2.79e+05 assign (resid 36 and name HB2 ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.1111 at -4.62e+05 assign (resid 36 and name HE# ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.1067 at -2.59e+05 assign (resid 36 and name HD# ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.295 at -6.76e+05 assign (resid 36 and name HB1 ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.1734 at -6.40e+05 assign (resid 36 and name HB2 ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.1746 at -5.33e+05 assign (resid 36 and name HA ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.899 at 2.76e+05 assign (resid 36 and name HE# ) (resid 78 and name HA ) 4.0 2.2 1.0 ! A.1061 at -3.77e+05 assign (resid 36 and name HE# ) (resid 78 and name HG2 ) 4.0 2.2 1.0 ! A.1071 at 2.52e+05 assign (resid 36 and name HE# ) (resid 78 and name HB1 ) 4.0 2.2 1.0 ! A.1072 at -3.57e+05 assign (resid 36 and name HD# ) (resid 78 and name HB1 ) 4.0 2.2 1.0 ! A.305 at -3.12e+05 assign (resid 36 and name HD# ) (resid 78 and name HA ) 3.0 1.2 0.3 ! A.291 at -1.37e+06 assign (resid 36 and name HB1 ) (resid 78 and name HA ) 4.0 2.2 1.0 ! A.1733 at -3.91e+05 assign (resid 36 and name HB2 ) (resid 78 and name HA ) 4.0 2.2 1.0 ! A.1742 at -3.34e+05 assign (resid 36 and name HA ) (resid 78 and name HA ) 3.0 1.2 0.3 ! A.283 at 3.69e+06 assign (resid 36 and name HA ) (resid 78 and name HB2 ) 4.0 2.2 1.0 ! A.289 at 3.67e+05 assign (resid 36 and name HZ ) (resid 78 and name HA ) 4.0 2.2 2.0 ! A.2758 at -1.87e+05 assign (resid 36 and name HA ) (resid 79 and name HG11 ) 4.0 2.2 1.0 ! A.2664 at 3.69e+05 assign (resid 36 and name HA ) (resid 79 and name HG12 ) 4.0 2.2 1.0 ! A.2797 at 3.75e+05 assign (resid 36 and name HA ) (resid 79 and name HB ) 4.0 2.2 2.0 ! A.2783 at -2.15e+05 assign (resid 36 and name HA ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.284 at 6.43e+05 assign (resid 36 and name HE# ) (resid 88 and name HD1# ) 3.0 1.2 0.8 ! A.1068 at -1.06e+06 assign (resid 36 and name HD# ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.296 at -6.46e+05 assign (resid 36 and name HD# ) (resid 88 and name HG11 ) 4.0 2.2 2.0 ! A.300 at -2.10e+05 assign (resid 36 and name HE# ) (resid 88 and name HG11 ) 4.0 2.2 2.0 ! A.1069 at -1.94e+05 assign (resid 36 and name HZ ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.1078 at -3.26e+05 assign (resid 36 and name HB1 ) (resid 88 and name HD1# ) 4.0 2.2 2.5 ! A.2913 at -2.23e+05 ! R37 assign (resid 37 and name HA ) (resid 37 and name HG1 ) 3.0 1.2 0.3 ! A.1757 at 1.13e+06 assign (resid 37 and name HA ) (resid 37 and name HG2 ) 4.0 2.2 1.0 ! A.1767 at 7.46e+05 assign (resid 37 and name HB2 ) (resid 37 and name HD# ) 3.0 1.2 0.3 ! A.1416 at 2.06e+06 assign (resid 37 and name HB1 ) (resid 37 and name HD# ) 3.0 1.2 0.3 ! A.1417 at 1.84e+06 assign (resid 37 and name HA ) (resid 37 and name HD# ) 4.0 2.2 1.0 ! A.1413 at -9.63e+05 assign (resid 37 and name HG1 ) (resid 38 and name HA ) 4.0 2.2 2.0 ! A.1764 at 1.63e+05 assign (resid 37 and name HA ) (resid 38 and name HG2# ) 4.0 2.2 1.5 ! A.1260 at 4.55e+05 assign (resid 37 and name HG2 ) (resid 51 and name HD# ) 4.0 2.2 1.0 ! A.427 at -5.59e+05 assign (resid 37 and name HG1 ) (resid 51 and name HD# ) 4.0 2.2 1.0 ! A.429 at -4.84e+05 assign (resid 37 and name HG2 ) (resid 51 and name HB2 ) 4.0 2.2 1.0 ! A.2090 at -2.98e+05 assign (resid 37 and name HG1 ) (resid 51 and name HB2 ) 4.0 2.2 1.0 ! A.2091 at -3.59e+05 assign (resid 37 and name HG1 ) (resid 51 and name HA ) 4.0 2.2 1.0 ! A.13 at 2.79e+05 assign (resid 37 and name HG2 ) (resid 51 and name HA ) 4.0 2.2 2.0 ! A.2080 at 1.28e+05 assign (resid 37 and name HB1 ) (resid 77 and name HD# ) 4.0 2.2 1.0 ! A.681 at 4.13e+05 assign (resid 37 and name HG2 ) (resid 77 and name HD# ) 4.0 2.2 1.0 ! A.678 at -3.86e+05 assign (resid 37 and name HG2 ) (resid 77 and name HB2 ) 4.0 2.2 2.0 ! A.1768 at -2.24e+05 assign (resid 37 and name HG1 ) (resid 77 and name HB2 ) 4.0 2.2 2.0 ! A.2733 at -1.74e+05 assign (resid 37 and name HB1 ) (resid 77 and name HB2 ) 4.0 2.2 1.0 ! A.2728 at 5.43e+05 assign (resid 37 and name HB2 ) (resid 77 and name HB2 ) 4.0 2.2 1.0 ! A.2730 at 3.13e+05 assign (resid 37 and name HB1 ) (resid 77 and name HB1 ) 4.0 2.2 1.0 ! A.2743 at 4.73e+05 assign (resid 37 and name HB2 ) (resid 77 and name HB1 ) 4.0 2.2 2.0 ! A.2744 at 2.94e+05 assign (resid 37 and name HB1 ) (resid 77 and name HA ) 4.0 2.2 2.0 ! A.2718 at -1.66e+05 assign (resid 37 and name HA ) (resid 77 and name HD# ) 4.0 2.2 2.0 ! A.1755 at -1.56e+05 assign (resid 37 and name HB2 ) (resid 77 and name HD# ) 4.0 2.2 1.0 ! A.1771 at 3.93e+05 assign (resid 37 and name HG1 ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.1761 at 3.31e+05 assign (resid 37 and name HD# ) (resid 79 and name HD1# ) 3.0 1.2 0.8 ! A.1414 at -1.17e+06 assign (resid 37 and name HB2 ) (resid 79 and name HD1# ) 3.0 1.2 0.8 ! A.1550 at -1.08e+06 assign (resid 37 and name HB1 ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.1786 at -9.03e+05 assign (resid 37 and name HA ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.2170 at 2.96e+05 ! V38 assign (resid 38 and name HA ) (resid 38 and name HG2# ) 3.0 1.2 0.8 ! A.1267 at 3.88e+06 assign (resid 38 and name HA ) (resid 38 and name HG1# ) 3.0 1.2 0.8 ! A.1805 at 4.12e+06 assign (resid 38 and name HG1# ) (resid 39 and name HA ) 4.0 2.2 1.5 ! A.326 at 4.88e+05 assign (resid 38 and name HG1# ) (resid 40 and name HD# ) 3.0 1.2 0.8 ! A.339 at -2.17e+06 assign (resid 38 and name HG1# ) (resid 40 and name HE# ) 4.0 2.2 1.5 ! A.1804 at -4.62e+05 assign (resid 38 and name HG1# ) (resid 51 and name HA ) 4.0 2.2 1.5 ! A.10 at 3.02e+05 assign (resid 38 and name HB ) (resid 52 and name HG ) 4.0 2.2 1.0 ! A.2180 at -4.10e+05 assign (resid 38 and name HB ) (resid 52 and name HD1# ) 3.0 1.2 0.8 ! A.2143 at -1.01e+06 assign (resid 38 and name HG2# ) (resid 52 and name HB2 ) 3.0 1.2 0.8 ! A.1268 at -1.03e+06 assign (resid 38 and name HG1# ) (resid 52 and name HB2 ) 4.0 2.2 1.5 ! A.2163 at -5.16e+05 assign (resid 38 and name HB ) (resid 52 and name HB2 ) 3.0 1.2 0.3 ! A.2157 at 1.68e+06 assign (resid 38 and name HB ) (resid 52 and name HB1 ) 4.0 2.2 1.0 ! A.2165 at 1.68e+06 assign (resid 38 and name HB ) (resid 52 and name HD2# ) 4.0 2.2 1.5 ! A.2125 at -5.93e+05 assign (resid 38 and name HG2# ) (resid 54 and name HA ) 4.0 2.2 2.5 ! A.2173 at -1.49e+05 assign (resid 38 and name HG2# ) (resid 54 and name HG ) 3.0 1.2 0.8 ! A.2111 at 1.07e+06 assign (resid 38 and name HG2# ) (resid 54 and name HD1# ) 3.0 1.2 1.3 ! A.2198 at 3.23e+06 assign (resid 38 and name HG2# ) (resid 54 and name HB2 ) 4.0 2.2 1.5 ! A.2669 at -4.47e+05 assign (resid 38 and name HG2# ) (resid 54 and name HD2# ) 3.0 1.2 1.3 ! A.2183 at 1.82e+06 assign (resid 38 and name HA ) (resid 54 and name HD1# ) 4.0 2.2 2.5 ! A.321 at 2.37e+05 assign (resid 38 and name HG2# ) (resid 61 and name HG1# ) 2.5 0.7 1.2 ! A.2332 at 5.52e+06 assign (resid 38 and name HG2# ) (resid 61 and name HB ) 4.0 2.2 1.5 ! A.2339 at -5.20e+05 assign (resid 38 and name HB ) (resid 61 and name HG1# ) 4.0 2.2 1.5 ! A.1798 at -7.78e+05 assign (resid 38 and name HG1# ) (resid 63 and name HG12 ) 4.0 2.2 1.5 ! A.2410 at 4.01e+05 assign (resid 38 and name HG1# ) (resid 63 and name HG11 ) 4.0 2.2 1.5 ! A.1809 at 4.31e+05 assign (resid 38 and name HG1# ) (resid 63 and name HD1# ) 3.0 1.2 1.3 ! A.1604 at 4.85e+06 assign (resid 38 and name HG1# ) (resid 63 and name HG2# ) 4.0 2.2 2.0 ! A.1808 at 5.31e+05 assign (resid 38 and name HB ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.1794 at -3.63e+05 assign (resid 38 and name HG2# ) (resid 76 and name HG2# ) 2.5 0.7 1.2 ! A.1275 at 6.95e+06 assign (resid 38 and name HG2# ) (resid 76 and name HG1# ) 3.0 1.2 1.3 ! A.1259 at 3.54e+06 assign (resid 38 and name HG2# ) (resid 76 and name HA ) 3.0 1.2 0.8 ! A.1266 at 1.35e+06 assign (resid 38 and name HG1# ) (resid 76 and name HG1# ) 4.0 2.2 2.0 ! A.1807 at 5.73e+05 assign (resid 38 and name HA ) (resid 76 and name HG2# ) 3.0 1.2 0.8 ! A.881 at 1.21e+06 assign (resid 38 and name HA ) (resid 76 and name HG1# ) 4.0 2.2 1.5 ! A.317 at 7.70e+05 assign (resid 38 and name HA ) (resid 76 and name HA ) 3.0 1.2 0.3 ! A.315 at 4.30e+06 assign (resid 38 and name HG1# ) (resid 76 and name HB ) 4.0 2.2 1.5 ! A.2713 at -6.19e+05 assign (resid 38 and name HA ) (resid 77 and name HD# ) 4.0 2.2 1.0 ! A.674 at -2.65e+05 ! E39 assign (resid 39 and name HA ) (resid 39 and name HG1 ) 4.0 2.2 1.0 ! A.1818 at -8.42e+05 assign (resid 39 and name HA ) (resid 39 and name HG2 ) 4.0 2.2 1.0 ! A.1823 at -6.32e+05 assign (resid 39 and name HA ) (resid 40 and name HD# ) 4.0 2.2 1.0 ! A.348 at -4.67e+05 assign (resid 39 and name HB2 ) (resid 51 and name HD# ) 4.0 2.2 1.0 ! A.430 at 4.99e+05 assign (resid 39 and name HA ) (resid 51 and name HD# ) 3.0 1.2 0.3 ! A.328 at -1.07e+06 assign (resid 39 and name HG1 ) (resid 51 and name HD# ) 4.0 2.2 1.0 ! A.1185 at 3.70e+05 assign (resid 39 and name HA ) (resid 51 and name HB1 ) 4.0 2.2 1.0 ! A.2084 at -7.37e+05 assign (resid 39 and name HG1 ) (resid 51 and name HB1 ) 4.0 2.2 1.0 ! A.2086 at 5.01e+05 assign (resid 39 and name HB2 ) (resid 51 and name HB1 ) 4.0 2.2 1.0 ! A.2087 at 5.48e+05 assign (resid 39 and name HG1 ) (resid 51 and name HE# ) 3.0 1.2 0.3 ! A.435 at 1.23e+06 assign (resid 39 and name HG2 ) (resid 51 and name HE# ) 4.0 2.2 1.0 ! A.1822 at 7.04e+05 assign (resid 39 and name HG2 ) (resid 51 and name HD# ) 4.0 2.2 2.0 ! A.1821 at 2.30e+05 assign (resid 39 and name HA ) (resid 51 and name HA ) 3.0 1.2 0.3 ! A.7 at 3.96e+06 assign (resid 39 and name HB2 ) (resid 51 and name HA ) 4.0 2.2 1.0 ! A.15 at -3.10e+05 assign (resid 39 and name HG2 ) (resid 51 and name HA ) 4.0 2.2 1.0 ! A.14 at -3.44e+05 assign (resid 39 and name HA ) (resid 51 and name HE# ) 4.0 2.2 1.0 ! A.329 at -6.69e+05 assign (resid 39 and name HB1 ) (resid 75 and name HB2 ) 4.0 2.2 1.0 ! A.2089 at 7.65e+05 assign (resid 39 and name HB1 ) (resid 75 and name HB1 ) 4.0 2.2 1.0 ! A.2688 at 4.75e+05 assign (resid 39 and name HG2 ) (resid 75 and name HB2 ) 4.0 2.2 2.0 ! A.1824 at 2.14e+05 assign (resid 39 and name HB2 ) (resid 75 and name HB1 ) 4.0 2.2 2.0 ! A.1843 at 2.45e+05 assign (resid 39 and name HB1 ) (resid 77 and name HD# ) 4.0 2.2 1.0 ! A.2749 at 3.41e+05 assign (resid 39 and name HB1 ) (resid 77 and name HE# ) 3.0 1.2 0.3 ! A.437 at 1.36e+06 assign (resid 39 and name HB2 ) (resid 77 and name HE# ) 3.0 1.2 0.3 ! A.438 at 1.74e+06 assign (resid 39 and name HB1 ) (resid 87 and name HD1# ) 4.0 2.2 2.5 ! A.1003 at -1.67e+05 ! Y40 assign (resid 40 and name HA ) (resid 40 and name HD# ) 4.0 2.2 1.0 ! A.349 at -7.93e+05 assign (resid 40 and name HB2 ) (resid 40 and name HD# ) 3.0 1.2 0.3 ! A.338 at 1.77e+06 assign (resid 40 and name HB1 ) (resid 40 and name HD# ) 3.0 1.2 0.3 ! A.337 at 1.57e+06 assign (resid 40 and name HE# ) (resid 40 and name HB1 ) 4.0 2.2 2.0 ! A.1850 at 2.32e+05 assign (resid 40 and name HE# ) (resid 40 and name HB2 ) 4.0 2.2 1.0 ! A.1688 at 3.72e+05 assign (resid 40 and name HD# ) (resid 41 and name HA ) 4.0 2.2 1.0 ! A.368 at -2.92e+05 assign (resid 40 and name HA ) (resid 41 and name HG1 ) 4.0 2.2 2.0 ! A.1847 at -3.40e+05 assign (resid 40 and name HB2 ) (resid 41 and name HA ) 4.0 2.2 2.0 ! A.1869 at -2.41e+05 assign (resid 40 and name HA ) (resid 41 and name HB2 ) 4.0 2.2 2.0 ! A.1882 at -2.07e+05 assign (resid 40 and name HE# ) (resid 50 and name HB1 ) 4.0 2.2 1.0 ! A.2070 at -5.44e+05 assign (resid 40 and name HD# ) (resid 50 and name HB1 ) 4.0 2.2 2.0 ! A.2071 at -2.13e+05 assign (resid 40 and name HD# ) (resid 50 and name HB2 ) 4.0 2.2 1.0 ! A.344 at -2.67e+05 assign (resid 40 and name HE# ) (resid 50 and name HB2 ) 4.0 2.2 1.0 ! A.2075 at -6.14e+05 assign (resid 40 and name HE# ) (resid 50 and name HG# ) 4.0 2.2 1.0 ! A.363 at 4.48e+05 assign (resid 40 and name HD# ) (resid 50 and name HG# ) 4.0 2.2 1.0 ! A.1878 at 2.59e+05 assign (resid 40 and name HE# ) (resid 50 and name HA ) 4.0 2.2 2.0 ! A.423 at -2.00e+05 assign (resid 40 and name HD# ) (resid 50 and name HA ) 4.0 2.2 2.0 ! A.419 at -2.21e+05 assign (resid 40 and name HD# ) (resid 51 and name HA ) 4.0 2.2 1.0 ! A.351 at -3.77e+05 assign (resid 40 and name HD# ) (resid 52 and name HD1# ) 4.0 2.2 1.5 ! A.345 at -3.51e+05 assign (resid 40 and name HD# ) (resid 52 and name HG ) 4.0 2.2 2.0 ! A.346 at -2.06e+05 assign (resid 40 and name HE# ) (resid 52 and name HG ) 3.0 1.2 0.3 ! A.2101 at -1.10e+06 assign (resid 40 and name HE# ) (resid 52 and name HD1# ) 3.0 1.2 0.8 ! A.2141 at -1.44e+06 assign (resid 40 and name HE# ) (resid 52 and name HB1 ) 4.0 2.2 1.0 ! A.2166 at 2.81e+05 assign (resid 40 and name HE# ) (resid 52 and name HB2 ) 4.0 2.2 1.0 ! A.2155 at 2.77e+05 assign (resid 40 and name HE# ) (resid 52 and name HD2# ) 4.0 2.2 1.5 ! A.2114 at -7.99e+05 assign (resid 40 and name HD# ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.342 at -7.63e+05 assign (resid 40 and name HD# ) (resid 63 and name HG2# ) 4.0 2.2 1.5 ! A.341 at -7.35e+05 assign (resid 40 and name HE# ) (resid 63 and name HG11 ) 4.0 2.2 2.0 ! A.2392 at -1.63e+05 assign (resid 40 and name HB1 ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.1852 at -4.22e+05 assign (resid 40 and name HB1 ) (resid 63 and name HG2# ) 4.0 2.2 2.5 ! A.1853 at -1.67e+05 assign (resid 40 and name HB2 ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.1858 at -3.92e+05 assign (resid 40 and name HB2 ) (resid 63 and name HG2# ) 4.0 2.2 2.5 ! A.1859 at -1.44e+05 assign (resid 40 and name HE# ) (resid 63 and name HG2# ) 3.0 1.2 0.8 ! A.921 at -1.08e+06 assign (resid 40 and name HE# ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.1182 at -3.61e+05 assign (resid 40 and name HA ) (resid 63 and name HD1# ) 4.0 2.2 1.5 ! A.5 at 3.63e+05 assign (resid 40 and name HD# ) (resid 66 and name HD2# ) 3.0 1.2 0.8 ! A.340 at -1.33e+06 assign (resid 40 and name HB2 ) (resid 66 and name HD1# ) 4.0 2.2 2.5 ! A.861 at -2.12e+05 assign (resid 40 and name HE# ) (resid 66 and name HD1# ) 4.0 2.2 2.5 ! A.849 at -1.55e+05 assign (resid 40 and name HB1 ) (resid 66 and name HD2# ) 4.0 2.2 2.5 ! A.1854 at -1.47e+05 assign (resid 40 and name HB2 ) (resid 66 and name HD2# ) 4.0 2.2 1.5 ! A.1860 at -3.64e+05 assign (resid 40 and name HE# ) (resid 66 and name HD2# ) 3.0 1.2 0.8 ! A.945 at -2.38e+06 assign (resid 40 and name HD# ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.336 at 7.62e+05 assign (resid 40 and name HA ) (resid 72 and name HD# ) 4.0 2.2 2.0 ! A.1846 at -2.06e+05 assign (resid 40 and name HA ) (resid 73 and name HG2# ) 4.0 2.2 1.5 ! A.1844 at 2.83e+05 assign (resid 40 and name HD# ) (resid 74 and name HA ) 4.0 2.2 2.0 ! A.347 at -2.16e+05 assign (resid 40 and name HD# ) (resid 74 and name HG1# ) 4.0 2.2 1.5 ! A.1265 at -4.21e+05 assign (resid 40 and name HB2 ) (resid 74 and name HG2# ) 3.0 1.2 0.8 ! A.1862 at -1.93e+06 assign (resid 40 and name HB1 ) (resid 74 and name HG2# ) 3.0 1.2 0.8 ! A.1855 at -1.54e+06 assign (resid 40 and name HB1 ) (resid 74 and name HA ) 4.0 2.2 1.0 ! A.1851 at -6.54e+05 assign (resid 40 and name HB2 ) (resid 74 and name HA ) 4.0 2.2 1.0 ! A.1694 at -6.30e+05 assign (resid 40 and name HA ) (resid 74 and name HG2# ) 3.0 1.2 0.8 ! A.1175 at 1.34e+06 assign (resid 40 and name HA ) (resid 74 and name HA ) 3.0 1.2 0.3 ! A.630 at 4.16e+06 ! E41 assign (resid 41 and name HA ) (resid 41 and name HG1 ) 4.0 2.2 1.0 ! A.1874 at -6.90e+05 assign (resid 41 and name HA ) (resid 42 and name HD2# ) 4.0 2.2 2.5 ! A.370 at 1.80e+05 assign (resid 41 and name HA ) (resid 49 and name HB1 ) 4.0 2.2 1.0 ! A.2046 at 6.27e+05 assign (resid 41 and name HA ) (resid 49 and name HA ) 3.0 1.2 0.3 ! A.416 at 2.05e+06 assign (resid 41 and name HG2 ) (resid 49 and name HA ) 4.0 2.2 1.0 ! A.2029 at -9.34e+05 assign (resid 41 and name HB1 ) (resid 49 and name HA ) 4.0 2.2 1.0 ! A.1884 at -9.72e+05 assign (resid 41 and name HA ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.607 at -3.00e+05 assign (resid 41 and name HA ) (resid 72 and name HD# ) 4.0 2.2 1.0 ! A.1873 at -2.52e+05 assign (resid 41 and name HG1 ) (resid 73 and name HB ) 4.0 2.2 1.0 ! A.1461 at 8.41e+05 ! L42 assign (resid 42 and name HA ) (resid 42 and name HG ) 3.0 1.2 0.3 ! A.1915 at 1.17e+06 assign (resid 42 and name HA ) (resid 42 and name HD1# ) 3.0 1.2 0.8 ! A.1927 at 1.25e+06 assign (resid 42 and name HB1 ) (resid 42 and name HD1# ) 3.0 1.2 0.8 ! A.1944 at -3.95e+06 assign (resid 42 and name HB2 ) (resid 42 and name HD1# ) 3.0 1.2 0.8 ! A.1945 at -2.73e+06 assign (resid 42 and name HA ) (resid 42 and name HD2# ) 3.0 1.2 0.8 ! A.986 at 4.32e+06 assign (resid 42 and name HB2 ) (resid 42 and name HD2# ) 3.0 1.2 0.8 ! A.976 at -1.47e+06 assign (resid 42 and name HB1 ) (resid 42 and name HD2# ) 3.0 1.2 0.8 ! A.975 at -2.48e+06 assign (resid 42 and name HA ) (resid 43 and name HB# ) 4.0 2.2 1.0 ! A.1966 at 2.51e+05 assign (resid 42 and name HB1 ) (resid 43 and name HA ) 4.0 2.2 2.0 ! A.1955 at -1.71e+05 assign (resid 42 and name HD2# ) (resid 44 and name HB1 ) 4.0 2.2 2.5 ! A.2005 at 2.03e+05 assign (resid 42 and name HB1 ) (resid 44 and name HG# ) 4.0 2.2 1.0 ! A.1904 at 4.41e+05 assign (resid 42 and name HB1 ) (resid 44 and name HB1 ) 4.0 2.2 1.0 ! A.1911 at -2.84e+05 assign (resid 42 and name HD2# ) (resid 44 and name HG# ) 4.0 2.2 1.5 ! A.1971 at -5.24e+05 assign (resid 42 and name HB2 ) (resid 45 and name HB1 ) 4.0 2.2 1.0 ! A.2003 at -2.63e+05 assign (resid 42 and name HB2 ) (resid 45 and name HB2 ) 4.0 2.2 1.0 ! A.1994 at -3.11e+05 assign (resid 42 and name HD1# ) (resid 45 and name HB1 ) 4.0 2.2 1.5 ! A.2004 at 2.76e+05 assign (resid 42 and name HB1 ) (resid 45 and name HB1 ) 4.0 2.2 2.0 ! A.2002 at -2.49e+05 assign (resid 42 and name HD1# ) (resid 45 and name HB2 ) 4.0 2.2 1.5 ! A.1990 at 3.57e+05 assign (resid 42 and name HD2# ) (resid 45 and name HB2 ) 4.0 2.2 1.5 ! A.1991 at 2.84e+05 assign (resid 42 and name HB1 ) (resid 45 and name HB2 ) 4.0 2.2 2.0 ! A.1993 at -2.34e+05 assign (resid 42 and name HD1# ) (resid 45 and name HG# ) 4.0 2.2 1.5 ! A.1933 at -6.41e+05 assign (resid 42 and name HD2# ) (resid 45 and name HB1 ) 4.0 2.2 2.5 ! A.983 at 2.20e+05 assign (resid 42 and name HD2# ) (resid 45 and name HG# ) 4.0 2.2 1.5 ! A.981 at -4.71e+05 assign (resid 42 and name HB2 ) (resid 45 and name HG# ) 4.0 2.2 1.0 ! A.1892 at 3.49e+05 assign (resid 42 and name HG ) (resid 46 and name HA# ) 4.0 2.2 2.0 ! A.403 at -1.38e+05 assign (resid 42 and name HB2 ) (resid 46 and name HA# ) 4.0 2.2 1.0 ! A.397 at 3.20e+05 assign (resid 42 and name HB1 ) (resid 46 and name HA# ) 4.0 2.2 2.0 ! A.398 at 2.04e+05 assign (resid 42 and name HD1# ) (resid 46 and name HA# ) 4.0 2.2 1.5 ! A.399 at -5.65e+05 assign (resid 42 and name HD2# ) (resid 46 and name HA# ) 4.0 2.2 2.5 ! A.400 at -1.47e+05 assign (resid 42 and name HD1# ) (resid 47 and name HB1 ) 4.0 2.2 1.5 ! A.1932 at -4.63e+05 assign (resid 42 and name HD1# ) (resid 47 and name HB2 ) 4.0 2.2 1.5 ! A.1935 at -4.04e+05 assign (resid 42 and name HD2# ) (resid 47 and name HB1 ) 4.0 2.2 2.5 ! A.984 at -1.85e+05 assign (resid 42 and name HD2# ) (resid 47 and name HB2 ) 4.0 2.2 2.5 ! A.985 at -1.38e+05 assign (resid 42 and name HD2# ) (resid 66 and name HD2# ) 4.0 2.2 3.0 ! A.973 at 2.05e+05 assign (resid 42 and name HD2# ) (resid 67 and name HD1# ) 3.0 1.2 1.3 ! A.2466 at 1.84e+06 assign (resid 42 and name HD2# ) (resid 67 and name HB2 ) 4.0 2.2 1.5 ! A.979 at -3.71e+05 assign (resid 42 and name HD1# ) (resid 67 and name HB1 ) 4.0 2.2 1.5 ! A.2528 at -3.21e+05 assign (resid 42 and name HD2# ) (resid 70 and name HA ) 4.0 2.2 1.5 ! A.556 at -6.13e+05 assign (resid 42 and name HD1# ) (resid 70 and name HA ) 4.0 2.2 2.5 ! A.2556 at -2.00e+05 assign (resid 42 and name HD1# ) (resid 70 and name HB# ) 4.0 2.2 1.5 ! A.1948 at -9.32e+05 assign (resid 42 and name HD1# ) (resid 70 and name HD2 ) 4.0 2.2 1.5 ! A.1934 at -4.17e+05 assign (resid 42 and name HD2# ) (resid 70 and name HB# ) 3.0 1.2 0.8 ! A.980 at -2.70e+06 assign (resid 42 and name HD2# ) (resid 70 and name HD2 ) 3.0 1.2 0.8 ! A.972 at -1.01e+06 assign (resid 42 and name HD2# ) (resid 70 and name HD1 ) 4.0 2.2 1.5 ! A.1393 at -6.99e+05 assign (resid 42 and name HD1# ) (resid 70 and name HD1 ) 4.0 2.2 1.5 ! A.1394 at -3.48e+05 assign (resid 42 and name HD2# ) (resid 72 and name HD# ) 4.0 2.2 1.5 ! A.594 at -4.41e+05 assign (resid 42 and name HG ) (resid 72 and name HD# ) 4.0 2.2 2.0 ! A.596 at -1.85e+05 assign (resid 42 and name HA ) (resid 72 and name HD# ) 4.0 2.2 1.0 ! A.590 at -4.18e+05 assign (resid 42 and name HG ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.1913 at -7.84e+05 assign (resid 42 and name HD1# ) (resid 72 and name HA ) 4.0 2.2 1.5 ! A.1928 at 2.65e+05 assign (resid 42 and name HD1# ) (resid 72 and name HE# ) 4.0 2.2 1.5 ! A.1929 at -4.32e+05 assign (resid 42 and name HD2# ) (resid 72 and name HA ) 3.0 1.2 0.8 ! A.576 at 1.09e+06 assign (resid 42 and name HD2# ) (resid 72 and name HE# ) 3.0 1.2 0.8 ! A.990 at -1.05e+06 assign (resid 42 and name HB2 ) (resid 72 and name HA ) 4.0 2.2 2.0 ! A.1890 at -1.63e+05 assign (resid 42 and name HB2 ) (resid 72 and name HE# ) 4.0 2.2 2.0 ! A.1889 at 2.03e+05 assign (resid 42 and name HB1 ) (resid 72 and name HE# ) 4.0 2.2 2.0 ! A.1899 at 2.04e+05 assign (resid 42 and name HB1 ) (resid 72 and name HA ) 4.0 2.2 1.0 ! A.1901 at -2.61e+05 assign (resid 42 and name HA ) (resid 72 and name HB2 ) 4.0 2.2 1.0 ! A.2630 at -2.87e+05 assign (resid 42 and name HD2# ) (resid 72 and name HB2 ) 4.0 2.2 2.5 ! A.1865 at -2.30e+05 assign (resid 42 and name HG ) (resid 72 and name HA ) 4.0 2.2 1.0 ! A.583 at 3.40e+05 assign (resid 42 and name HA ) (resid 72 and name HA ) 3.0 1.2 0.3 ! A.574 at 4.45e+06 assign (resid 42 and name HA ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.605 at -3.44e+05 ! S43 assign (resid 43 and name HB# ) (resid 44 and name HG# ) 4.0 2.2 1.0 ! A.1964 at -4.40e+05 assign (resid 43 and name HB# ) (resid 71 and name HD# ) 3.0 1.2 0.3 ! A.2620 at 1.22e+06 assign (resid 43 and name HB# ) (resid 71 and name HG1 ) 4.0 2.2 1.0 ! A.2603 at 5.01e+05 assign (resid 43 and name HB# ) (resid 71 and name HG2 ) 4.0 2.2 1.0 ! A.2611 at 7.76e+05 assign (resid 43 and name HB# ) (resid 71 and name HA ) 4.0 2.2 1.0 ! A.568 at 3.38e+05 assign (resid 43 and name HB# ) (resid 71 and name HB1 ) 3.0 1.2 0.3 ! A.1957 at -1.31e+06 assign (resid 43 and name HB# ) (resid 71 and name HB2 ) 4.0 2.2 1.0 ! A.2594 at -8.96e+05 assign (resid 43 and name HB# ) (resid 72 and name HA ) 4.0 2.2 1.0 ! A.1965 at 3.15e+05 assign (resid 43 and name HA ) (resid 72 and name HA ) 4.0 2.2 2.0 ! A.586 at 1.89e+05 assign (resid 43 and name HB# ) (resid 73 and name HG12 ) 4.0 2.2 1.0 ! A.2649 at 9.77e+05 assign (resid 43 and name HA ) (resid 73 and name HG12 ) 4.0 2.2 1.0 ! A.2650 at 6.73e+05 assign (resid 43 and name HB# ) (resid 73 and name HG11 ) 4.0 2.2 1.0 ! A.2656 at 9.69e+05 assign (resid 43 and name HA ) (resid 73 and name HG11 ) 4.0 2.2 1.0 ! A.2657 at 6.97e+05 assign (resid 43 and name HB# ) (resid 73 and name HD1# ) 3.0 1.2 0.8 ! A.1962 at 1.69e+06 assign (resid 43 and name HB# ) (resid 73 and name HB ) 4.0 2.2 1.0 ! A.1460 at -2.96e+05 assign (resid 43 and name HB# ) (resid 73 and name HG2# ) 4.0 2.2 1.5 ! A.1968 at 4.31e+05 assign (resid 43 and name HA ) (resid 73 and name HG2# ) 4.0 2.2 1.5 ! A.388 at 4.55e+05 assign (resid 43 and name HA ) (resid 73 and name HD1# ) 3.0 1.2 0.8 ! A.387 at 1.87e+06 assign (resid 43 and name HA ) (resid 73 and name HB ) 4.0 2.2 1.0 ! A.389 at -2.72e+05 ! E44 assign (resid 44 and name HG# ) (resid 44 and name HA ) 3.0 1.2 0.3 ! A.391 at -4.97e+06 assign (resid 44 and name HB2 ) (resid 45 and name HG# ) 2.5 0.7 0.2 ! A.2823 at -1.98e+07 ! E45 assign (resid 45 and name HA ) (resid 45 and name HG# ) 2.5 0.7 0.2 ! A.1819 at -5.66e+06 assign (resid 45 and name HB1 ) (resid 46 and name HA# ) 4.0 2.2 2.0 ! A.405 at -1.66e+05 assign (resid 45 and name HB2 ) (resid 46 and name HA# ) 4.0 2.2 2.0 ! A.1348 at -1.26e+05 assign (resid 45 and name HA ) (resid 46 and name HA# ) 4.0 2.2 1.0 ! A.401 at -2.53e+05 assign (resid 45 and name HG# ) (resid 46 and name HA# ) 4.0 2.2 2.0 ! A.1434 at 2.55e+05 assign (resid 45 and name HB1 ) (resid 47 and name HB2 ) 4.0 2.2 2.0 ! A.2012 at -1.88e+05 assign (resid 45 and name HG# ) (resid 70 and name HG# ) 4.0 2.2 1.0 ! A.1972 at -4.18e+05 ! G46 assign (resid 46 and name HA# ) (resid 47 and name HA ) 4.0 2.2 1.0 ! A.409 at -3.45e+05 ! D47 assign (resid 47 and name HA ) (resid 48 and name HG# ) 4.0 2.2 1.0 ! A.407 at -3.17e+05 ! E48 assign (resid 48 and name HA ) (resid 48 and name HG# ) 3.0 1.2 0.3 ! A.2025 at -1.58e+06 assign (resid 48 and name HA ) (resid 49 and name HB2 ) 4.0 2.2 2.0 ! A.2038 at 3.33e+05 assign (resid 48 and name HB2 ) (resid 49 and name HD1 ) 4.0 2.2 1.0 ! A.2034 at -6.41e+05 assign (resid 48 and name HB1 ) (resid 49 and name HD1 ) 4.0 2.2 1.0 ! A.2033 at -8.43e+05 assign (resid 48 and name HG# ) (resid 49 and name HD1 ) 4.0 2.2 1.0 ! A.1338 at 5.18e+05 assign (resid 48 and name HA ) (resid 49 and name HD1 ) 2.5 0.7 0.2 ! A.1337 at -7.09e+06 assign (resid 48 and name HG# ) (resid 49 and name HD2 ) 4.0 2.2 1.0 ! A.1333 at 9.74e+05 assign (resid 48 and name HA ) (resid 49 and name HD2 ) 2.5 0.7 0.2 ! A.1335 at -6.39e+06 assign (resid 48 and name HB1 ) (resid 49 and name HD2 ) 3.0 1.2 0.3 ! A.1336 at -1.21e+06 assign (resid 48 and name HB2 ) (resid 49 and name HD2 ) 4.0 2.2 1.0 ! A.1998 at -7.58e+05 assign (resid 48 and name HA ) (resid 49 and name HG2 ) 4.0 2.2 1.0 ! A.2056 at 5.83e+05 assign (resid 48 and name HA ) (resid 49 and name HG1 ) 4.0 2.2 1.0 ! A.2061 at 5.83e+05 ! P49 assign (resid 49 and name HD1 ) (resid 49 and name HB1 ) 4.0 2.2 1.0 ! A.2047 at -8.10e+05 assign (resid 49 and name HD2 ) (resid 49 and name HB1 ) 4.0 2.2 1.0 ! A.2048 at -6.42e+05 assign (resid 49 and name HD2 ) (resid 49 and name HB2 ) 4.0 2.2 1.0 ! A.2039 at -6.33e+05 assign (resid 49 and name HD1 ) (resid 49 and name HB2 ) 4.0 2.2 1.0 ! A.2040 at -4.53e+05 assign (resid 49 and name HA ) (resid 49 and name HD1 ) 4.0 2.2 1.0 ! A.1339 at -4.10e+05 assign (resid 49 and name HA ) (resid 49 and name HD2 ) 4.0 2.2 1.0 ! A.1334 at -4.65e+05 assign (resid 49 and name HA ) (resid 49 and name HG2 ) 4.0 2.2 1.0 ! A.2054 at 9.94e+05 assign (resid 49 and name HA ) (resid 49 and name HG1 ) 4.0 2.2 1.0 ! A.2060 at 8.93e+05 assign (resid 49 and name HA ) (resid 50 and name HG# ) 4.0 2.2 1.0 ! A.2028 at -9.13e+05 assign (resid 49 and name HB1 ) (resid 51 and name HE# ) 4.0 2.2 2.0 ! A.2775 at -1.97e+05 assign (resid 49 and name HB2 ) (resid 51 and name HE# ) 4.0 2.2 1.0 ! A.2037 at -6.18e+05 assign (resid 49 and name HG2 ) (resid 51 and name HE# ) 4.0 2.2 1.0 ! A.2055 at -2.58e+05 assign (resid 49 and name HG1 ) (resid 51 and name HE# ) 4.0 2.2 1.0 ! A.2058 at -3.49e+05 assign (resid 49 and name HD2 ) (resid 51 and name HE# ) 4.0 2.2 2.0 ! A.2754 at 1.62e+05 assign (resid 49 and name HA ) (resid 51 and name HE# ) 4.0 2.2 2.0 ! A.2753 at -1.61e+05 ! Q50 assign (resid 50 and name HA ) (resid 50 and name HG# ) 3.0 1.2 0.3 ! A.1875 at -3.66e+06 assign (resid 50 and name HA ) (resid 51 and name HD# ) 4.0 2.2 1.0 ! A.431 at -7.08e+05 assign (resid 50 and name HA ) (resid 51 and name HA ) 4.0 2.2 2.0 ! A.17 at 2.21e+05 assign (resid 50 and name HA ) (resid 51 and name HE# ) 4.0 2.2 2.0 ! A.418 at -2.32e+05 ! Y51 assign (resid 51 and name HB1 ) (resid 51 and name HD# ) 3.0 1.2 0.3 ! A.426 at 2.94e+06 assign (resid 51 and name HB2 ) (resid 51 and name HD# ) 3.0 1.2 0.3 ! A.1184 at 2.08e+06 assign (resid 51 and name HA ) (resid 51 and name HD# ) 3.0 1.2 0.3 ! A.428 at -1.21e+06 assign (resid 51 and name HE# ) (resid 51 and name HB2 ) 4.0 2.2 1.0 ! A.2094 at 3.59e+05 assign (resid 51 and name HB2 ) (resid 52 and name HA ) 4.0 2.2 1.0 ! A.2096 at -2.91e+05 assign (resid 51 and name HA ) (resid 52 and name HA ) 4.0 2.2 2.0 ! A.16 at 2.38e+05 assign (resid 51 and name HA ) (resid 52 and name HD2# ) 4.0 2.2 2.5 ! A.12 at 1.88e+05 assign (resid 51 and name HA ) (resid 52 and name HG ) 4.0 2.2 1.0 ! A.13 at 2.79e+05 assign (resid 51 and name HA ) (resid 52 and name HB2 ) 4.0 2.2 2.0 ! A.11 at -2.00e+05 assign (resid 51 and name HD# ) (resid 52 and name HA ) 4.0 2.2 2.0 ! A.444 at -1.94e+05 ! L52 assign (resid 52 and name HA ) (resid 52 and name HG ) 4.0 2.2 1.0 ! A.2100 at 8.32e+05 assign (resid 52 and name HA ) (resid 52 and name HD1# ) 4.0 2.2 1.5 ! A.2140 at 6.81e+05 assign (resid 52 and name HB2 ) (resid 52 and name HD1# ) 2.5 0.7 0.7 ! A.2144 at -5.23e+06 assign (resid 52 and name HD2# ) (resid 52 and name HB1 ) 3.0 1.2 0.8 ! A.2160 at -3.85e+06 assign (resid 52 and name HA ) (resid 52 and name HD2# ) 2.5 0.7 0.7 ! A.2112 at 6.33e+06 assign (resid 52 and name HB1 ) (resid 53 and name HA ) 4.0 2.2 1.0 ! A.446 at -2.64e+05 assign (resid 52 and name HB1 ) (resid 54 and name HD1# ) 4.0 2.2 1.5 ! A.2202 at -9.77e+05 assign (resid 52 and name HA ) (resid 54 and name HD1# ) 4.0 2.2 2.5 ! A.2904 at 2.37e+05 assign (resid 52 and name HD1# ) (resid 61 and name HG2# ) 3.0 1.2 1.3 ! A.2151 at 2.82e+06 assign (resid 52 and name HB2 ) (resid 61 and name HG1# ) 4.0 2.2 1.5 ! A.2327 at -3.16e+05 assign (resid 52 and name HD1# ) (resid 63 and name HA ) 4.0 2.2 1.5 ! A.2137 at 8.06e+05 assign (resid 52 and name HD1# ) (resid 63 and name HG2# ) 3.0 1.2 1.3 ! A.2147 at 1.36e+06 assign (resid 52 and name HD1# ) (resid 63 and name HD1# ) 3.0 1.2 1.3 ! A.2148 at 1.43e+06 assign (resid 52 and name HD2# ) (resid 63 and name HG2# ) 4.0 2.2 2.0 ! A.2133 at 5.26e+05 assign (resid 52 and name HD2# ) (resid 63 and name HA ) 4.0 2.2 1.5 ! A.2122 at 2.62e+05 assign (resid 52 and name HD2# ) (resid 63 and name HD1# ) 4.0 2.2 2.0 ! A.2134 at 4.80e+05 assign (resid 52 and name HD1# ) (resid 64 and name HD1 ) 4.0 2.2 1.5 ! A.1314 at -6.29e+05 assign (resid 52 and name HD1# ) (resid 64 and name HD2 ) 4.0 2.2 1.5 ! A.1281 at -7.35e+05 assign (resid 52 and name HD2# ) (resid 64 and name HD2 ) 4.0 2.2 1.5 ! A.1288 at -3.86e+05 assign (resid 52 and name HD2# ) (resid 64 and name HG2 ) 4.0 2.2 2.5 ! A.2428 at 2.30e+05 ! D53 assign (resid 53 and name HA ) (resid 54 and name HD1# ) 4.0 2.2 1.5 ! A.2191 at 3.40e+05 assign (resid 53 and name HA ) (resid 54 and name HD2# ) 4.0 2.2 1.5 ! A.2119 at 4.88e+05 ! L54 assign (resid 54 and name HG ) (resid 54 and name HA ) 4.0 2.2 1.0 ! A.448 at -9.41e+05 assign (resid 54 and name HD2# ) (resid 54 and name HA ) 3.0 1.2 0.8 ! A.452 at -4.05e+06 assign (resid 54 and name HD1# ) (resid 54 and name HA ) 4.0 2.2 1.5 ! A.453 at -8.53e+05 assign (resid 54 and name HB2 ) (resid 54 and name HD1# ) 3.0 1.2 0.8 ! A.2199 at -2.19e+06 assign (resid 54 and name HD1# ) (resid 54 and name HB1 ) 3.0 1.2 0.8 ! A.2215 at -1.37e+06 assign (resid 54 and name HD2# ) (resid 54 and name HB1 ) 3.0 1.2 0.8 ! A.2214 at -1.67e+06 assign (resid 54 and name HD2# ) (resid 54 and name HB2 ) 3.0 1.2 0.8 ! A.2226 at -1.69e+06 assign (resid 54 and name HA ) (resid 55 and name HD2 ) 3.0 1.2 0.3 ! A.65 at 4.59e+06 assign (resid 54 and name HA ) (resid 55 and name HG1 ) 4.0 2.2 1.0 ! A.450 at -4.59e+05 assign (resid 54 and name HA ) (resid 55 and name HG2 ) 4.0 2.2 1.0 ! A.449 at -2.78e+05 assign (resid 54 and name HA ) (resid 55 and name HA ) 4.0 2.2 1.0 ! A.454 at -3.11e+05 assign (resid 54 and name HB1 ) (resid 55 and name HD2 ) 3.0 1.2 0.3 ! A.1295 at 1.04e+06 assign (resid 54 and name HD2# ) (resid 55 and name HD2 ) 3.0 1.2 0.8 ! A.1297 at -1.31e+06 assign (resid 54 and name HD1# ) (resid 55 and name HD2 ) 4.0 2.2 1.5 ! A.1298 at -4.63e+05 assign (resid 54 and name HB1 ) (resid 55 and name HD1 ) 3.0 1.2 0.3 ! A.1309 at 1.21e+06 assign (resid 54 and name HA ) (resid 55 and name HD1 ) 3.0 1.2 0.3 ! A.1301 at 2.82e+06 assign (resid 54 and name HD1# ) (resid 55 and name HD1 ) 4.0 2.2 1.5 ! A.1306 at -4.94e+05 assign (resid 54 and name HD2# ) (resid 55 and name HD1 ) 3.0 1.2 0.8 ! A.1305 at -1.40e+06 assign (resid 54 and name HG ) (resid 55 and name HD2 ) 4.0 2.2 1.0 ! A.2105 at -3.60e+05 assign (resid 54 and name HD2# ) (resid 55 and name HG1 ) 4.0 2.2 2.5 ! A.2244 at 2.26e+05 assign (resid 54 and name HB2 ) (resid 55 and name HD1 ) 4.0 2.2 1.0 ! A.2221 at 9.56e+05 assign (resid 54 and name HD2# ) (resid 55 and name HA ) 4.0 2.2 2.5 ! A.465 at 1.85e+05 assign (resid 54 and name HB1 ) (resid 55 and name HA ) 4.0 2.2 2.0 ! A.464 at -1.84e+05 assign (resid 54 and name HA ) (resid 55 and name HB1 ) 4.0 2.2 2.0 ! A.3011 at 1.46e+05 assign (resid 54 and name HA ) (resid 55 and name HB2 ) 4.0 2.2 2.0 ! A.2238 at 2.72e+05 assign (resid 54 and name HD2# ) (resid 58 and name HA ) 4.0 2.2 2.5 ! A.2275 at -2.11e+05 assign (resid 54 and name HA ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.451 at -6.75e+05 assign (resid 54 and name HG ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.2177 at 3.90e+05 assign (resid 54 and name HD1# ) (resid 58 and name HB# ) 3.0 1.2 1.3 ! A.2197 at 2.34e+06 assign (resid 54 and name HB1 ) (resid 58 and name HB# ) 3.0 1.2 0.8 ! A.2213 at -1.33e+06 assign (resid 54 and name HB2 ) (resid 58 and name HB# ) 3.0 1.2 0.8 ! A.2222 at -1.29e+06 assign (resid 54 and name HD2# ) (resid 58 and name HB# ) 3.0 1.2 1.3 ! A.2132 at 2.38e+06 assign (resid 54 and name HD1# ) (resid 59 and name HA ) 4.0 2.2 2.5 ! A.498 at 1.63e+05 assign (resid 54 and name HD1# ) (resid 61 and name HB ) 3.0 1.2 0.8 ! A.2196 at -2.04e+06 assign (resid 54 and name HD1# ) (resid 61 and name HA ) 4.0 2.2 1.5 ! A.2189 at 7.91e+05 assign (resid 54 and name HD2# ) (resid 61 and name HA ) 4.0 2.2 1.5 ! A.2182 at 4.25e+05 assign (resid 54 and name HG ) (resid 61 and name HG1# ) 4.0 2.2 2.5 ! A.2328 at 2.30e+05 assign (resid 54 and name HD1# ) (resid 61 and name HG1# ) 3.0 1.2 1.3 ! A.2330 at 2.28e+06 assign (resid 54 and name HD2# ) (resid 61 and name HB ) 4.0 2.2 1.5 ! A.2341 at -6.24e+05 assign (resid 54 and name HD2# ) (resid 76 and name HG1# ) 4.0 2.2 2.0 ! A.912 at 3.14e+05 ! P55 assign (resid 55 and name HB2 ) (resid 55 and name HD1 ) 4.0 2.2 1.0 ! A.1304 at 4.02e+05 assign (resid 55 and name HB1 ) (resid 55 and name HD2 ) 4.0 2.2 1.0 ! A.1290 at 6.50e+05 assign (resid 55 and name HA ) (resid 55 and name HD2 ) 4.0 2.2 1.0 ! A.1292 at -4.12e+05 assign (resid 55 and name HB2 ) (resid 55 and name HD2 ) 4.0 2.2 1.0 ! A.1291 at 5.22e+05 assign (resid 55 and name HB1 ) (resid 55 and name HD1 ) 4.0 2.2 1.0 ! A.1303 at 4.59e+05 assign (resid 55 and name HA ) (resid 55 and name HD1 ) 4.0 2.2 1.0 ! A.1300 at -2.81e+05 assign (resid 55 and name HA ) (resid 55 and name HG1 ) 4.0 2.2 1.0 ! A.2241 at 5.54e+05 assign (resid 55 and name HA ) (resid 55 and name HG2 ) 4.0 2.2 1.0 ! A.2251 at 3.97e+05 assign (resid 55 and name HA ) (resid 56 and name HA ) 4.0 2.2 1.0 ! A.463 at 2.76e+05 assign (resid 55 and name HB2 ) (resid 57 and name HG2# ) 4.0 2.2 1.5 ! A.1131 at -2.75e+05 assign (resid 55 and name HG2 ) (resid 58 and name HA ) 4.0 2.2 1.0 ! A.479 at -3.50e+05 assign (resid 55 and name HD2 ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.1296 at -8.84e+05 assign (resid 55 and name HD1 ) (resid 58 and name HB# ) 3.0 1.2 0.8 ! A.1302 at -1.08e+06 assign (resid 55 and name HG1 ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.2245 at 5.15e+05 assign (resid 55 and name HG2 ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.2255 at 7.91e+05 assign (resid 55 and name HB2 ) (resid 58 and name HB# ) 4.0 2.2 1.5 ! A.2236 at -3.36e+05 ! S56 assign (resid 56 and name HA ) (resid 58 and name HB# ) 4.0 2.2 2.5 ! A.1106 at 1.93e+05 ! T57 assign (resid 57 and name HA ) (resid 57 and name HG2# ) 2.5 0.7 0.7 ! A.1129 at 6.53e+06 assign (resid 57 and name HA ) (resid 58 and name HA ) 4.0 2.2 1.0 ! A.2276 at -6.34e+05 assign (resid 57 and name HA ) (resid 58 and name HB# ) 4.0 2.2 2.5 ! A.1107 at 1.77e+05 ! A58 assign (resid 58 and name HA ) (resid 59 and name HG2# ) 4.0 2.2 1.5 ! A.478 at -6.33e+05 assign (resid 58 and name HB# ) (resid 59 and name HB ) 4.0 2.2 2.5 ! A.2277 at 1.98e+05 assign (resid 58 and name HB# ) (resid 59 and name HA ) 4.0 2.2 1.5 ! A.1103 at 3.41e+05 assign (resid 58 and name HA ) (resid 59 and name HA ) 4.0 2.2 2.0 ! A.493 at -3.39e+05 assign (resid 58 and name HB# ) (resid 61 and name HA ) 4.0 2.2 1.5 ! A.515 at 2.79e+05 ! T59 assign (resid 59 and name HA ) (resid 59 and name HG2# ) 2.5 0.7 0.7 ! A.1136 at 5.46e+06 assign (resid 59 and name HB ) (resid 60 and name HB2 ) 4.0 2.2 2.0 ! A.1379 at 3.65e+05 assign (resid 59 and name HB ) (resid 60 and name HB1 ) 4.0 2.2 2.0 ! A.2288 at 2.28e+05 assign (resid 59 and name HG2# ) (resid 60 and name HB1 ) 4.0 2.2 1.5 ! A.2287 at 3.33e+05 assign (resid 59 and name HA ) (resid 60 and name HA ) 4.0 2.2 1.0 ! A.492 at 3.22e+05 assign (resid 59 and name HA ) (resid 88 and name HD1# ) 4.0 2.2 2.5 ! A.497 at 2.13e+05 ! S60 assign (resid 60 and name HB2 ) (resid 61 and name HG1# ) 4.0 2.2 2.5 ! A.2324 at 2.25e+05 assign (resid 60 and name HA ) (resid 61 and name HG1# ) 4.0 2.2 1.5 ! A.2320 at 4.18e+05 assign (resid 60 and name HB2 ) (resid 61 and name HA ) 4.0 2.2 2.0 ! A.517 at 2.28e+05 assign (resid 60 and name HB1 ) (resid 61 and name HA ) 4.0 2.2 2.0 ! A.2294 at 1.96e+05 assign (resid 60 and name HA ) (resid 61 and name HB ) 4.0 2.2 2.0 ! A.508 at -2.21e+05 assign (resid 60 and name HA ) (resid 61 and name HG2# ) 4.0 2.2 1.5 ! A.507 at 3.00e+05 ! V61 assign (resid 61 and name HA ) (resid 61 and name HG2# ) 2.5 0.7 0.7 ! A.2299 at 5.61e+06 assign (resid 61 and name HA ) (resid 61 and name HG1# ) 3.0 1.2 0.8 ! A.2319 at 2.11e+06 assign (resid 61 and name HG2# ) (resid 62 and name HA ) 4.0 2.2 1.5 ! A.2349 at -3.93e+05 assign (resid 61 and name HG1# ) (resid 62 and name HA ) 4.0 2.2 1.5 ! A.2345 at -5.06e+05 assign (resid 61 and name HG2# ) (resid 62 and name HB1 ) 4.0 2.2 1.5 ! A.2303 at -2.62e+05 assign (resid 61 and name HG1# ) (resid 62 and name HB2 ) 4.0 2.2 2.5 ! A.2366 at -1.84e+05 assign (resid 61 and name HA ) (resid 62 and name HB2 ) 4.0 2.2 1.0 ! A.2295 at -3.49e+05 assign (resid 61 and name HA ) (resid 62 and name HA ) 4.0 2.2 1.0 ! A.510 at -3.83e+05 assign (resid 61 and name HA ) (resid 62 and name HB1 ) 4.0 2.2 1.0 ! A.2296 at -4.12e+05 assign (resid 61 and name HG1# ) (resid 62 and name HB1 ) 4.0 2.2 2.5 ! A.2357 at -1.67e+05 assign (resid 61 and name HG2# ) (resid 62 and name HB2 ) 4.0 2.2 1.5 ! A.2362 at -2.76e+05 assign (resid 61 and name HG1# ) (resid 63 and name HG12 ) 3.0 1.2 0.8 ! A.2407 at 1.26e+06 assign (resid 61 and name HG1# ) (resid 63 and name HG11 ) 3.0 1.2 0.8 ! A.2313 at 1.12e+06 assign (resid 61 and name HG2# ) (resid 63 and name HG11 ) 4.0 2.2 1.5 ! A.2400 at 4.71e+05 assign (resid 61 and name HG2# ) (resid 63 and name HG2# ) 4.0 2.2 2.0 ! A.2304 at 2.97e+05 assign (resid 61 and name HG2# ) (resid 63 and name HD1# ) 4.0 2.2 2.0 ! A.2305 at 7.62e+05 assign (resid 61 and name HG2# ) (resid 63 and name HA ) 4.0 2.2 1.5 ! A.2302 at 3.37e+05 assign (resid 61 and name HG1# ) (resid 63 and name HD1# ) 3.0 1.2 1.3 ! A.2311 at 2.76e+06 assign (resid 61 and name HG1# ) (resid 63 and name HG2# ) 4.0 2.2 2.0 ! A.2310 at 2.62e+05 assign (resid 61 and name HG1# ) (resid 63 and name HA ) 4.0 2.2 1.5 ! A.520 at 2.94e+05 assign (resid 61 and name HG2# ) (resid 64 and name HD2 ) 4.0 2.2 2.5 ! A.1289 at -1.84e+05 ! N62 assign (resid 62 and name HA ) (resid 63 and name HD1# ) 4.0 2.2 2.5 ! A.2351 at -2.00e+05 assign (resid 62 and name HA ) (resid 63 and name HG12 ) 4.0 2.2 1.0 ! A.2346 at -2.64e+05 ! I63 assign (resid 63 and name HA ) (resid 63 and name HG12 ) 4.0 2.2 1.0 ! A.2403 at 7.02e+05 assign (resid 63 and name HA ) (resid 63 and name HG11 ) 4.0 2.2 1.0 ! A.2393 at 8.12e+05 assign (resid 63 and name HD1# ) (resid 63 and name HA ) 4.0 2.2 1.5 ! A.518 at 9.30e+05 assign (resid 63 and name HG2# ) (resid 63 and name HA ) 3.0 1.2 0.8 ! A.519 at 2.56e+06 assign (resid 63 and name HD1# ) (resid 63 and name HB ) 3.0 1.2 0.8 ! A.2377 at -2.23e+06 assign (resid 63 and name HD1# ) (resid 64 and name HD1 ) 4.0 2.2 1.5 ! A.1311 at -2.91e+05 assign (resid 63 and name HG11 ) (resid 64 and name HD1 ) 4.0 2.2 2.0 ! A.1313 at -2.05e+05 assign (resid 63 and name HG2# ) (resid 64 and name HD1 ) 4.0 2.2 1.5 ! A.1310 at -9.04e+05 assign (resid 63 and name HA ) (resid 64 and name HD1 ) 3.0 1.2 0.3 ! A.1277 at -3.78e+06 assign (resid 63 and name HG11 ) (resid 64 and name HD2 ) 4.0 2.2 2.0 ! A.1283 at -2.30e+05 assign (resid 63 and name HA ) (resid 64 and name HD2 ) 3.0 1.2 0.3 ! A.1279 at -3.64e+06 assign (resid 63 and name HG2# ) (resid 64 and name HD2 ) 3.0 1.2 0.8 ! A.1284 at -1.58e+06 assign (resid 63 and name HB ) (resid 64 and name HD2 ) 4.0 2.2 1.0 ! A.1287 at 2.75e+05 assign (resid 63 and name HD1# ) (resid 64 and name HD2 ) 4.0 2.2 1.5 ! A.1285 at -2.76e+05 assign (resid 63 and name HA ) (resid 64 and name HG2 ) 4.0 2.2 1.0 ! A.2423 at 4.23e+05 assign (resid 63 and name HA ) (resid 64 and name HG1 ) 4.0 2.2 1.0 ! A.2429 at 2.76e+05 assign (resid 63 and name HG2# ) (resid 64 and name HG2 ) 4.0 2.2 2.5 ! A.2427 at 1.40e+05 assign (resid 63 and name HA ) (resid 64 and name HA ) 4.0 2.2 1.0 ! A.529 at 2.65e+05 assign (resid 63 and name HG2# ) (resid 64 and name HA ) 4.0 2.2 1.5 ! A.534 at 2.85e+05 assign (resid 63 and name HA ) (resid 64 and name HB1 ) 4.0 2.2 1.0 ! A.528 at -3.62e+05 assign (resid 63 and name HA ) (resid 64 and name HB2 ) 4.0 2.2 2.0 ! A.2422 at -1.69e+05 assign (resid 63 and name HG2# ) (resid 64 and name HB1 ) 4.0 2.2 2.5 ! A.2420 at -2.28e+05 assign (resid 63 and name HA ) (resid 66 and name HD1# ) 4.0 2.2 2.5 ! A.2456 at 1.61e+05 assign (resid 63 and name HG2# ) (resid 66 and name HD1# ) 3.0 1.2 1.3 ! A.841 at 2.47e+06 assign (resid 63 and name HD1# ) (resid 66 and name HD1# ) 4.0 2.2 2.0 ! A.842 at 6.88e+05 assign (resid 63 and name HB ) (resid 66 and name HD1# ) 3.0 1.2 0.8 ! A.843 at -1.33e+06 assign (resid 63 and name HG2# ) (resid 66 and name HB2 ) 4.0 2.2 1.5 ! A.2476 at -3.69e+05 assign (resid 63 and name HD1# ) (resid 66 and name HD2# ) 4.0 2.2 2.0 ! A.941 at 5.78e+05 assign (resid 63 and name HG2# ) (resid 66 and name HD2# ) 2.5 0.7 1.2 ! A.940 at 5.17e+06 assign (resid 63 and name HB ) (resid 66 and name HD2# ) 4.0 2.2 1.5 ! A.942 at -5.07e+05 assign (resid 63 and name HG2# ) (resid 66 and name HA ) 4.0 2.2 1.5 ! A.927 at 3.27e+05 assign (resid 63 and name HG11 ) (resid 74 and name HG1# ) 4.0 2.2 1.5 ! A.1274 at 3.02e+05 assign (resid 63 and name HD1# ) (resid 74 and name HG1# ) 3.0 1.2 1.3 ! A.1564 at 2.99e+06 assign (resid 63 and name HD1# ) (resid 74 and name HG2# ) 3.0 1.2 1.3 ! A.2677 at 2.51e+06 assign (resid 63 and name HG2# ) (resid 74 and name HG2# ) 4.0 2.2 2.0 ! A.2678 at 4.48e+05 assign (resid 63 and name HD1# ) (resid 74 and name HA ) 4.0 2.2 2.5 ! A.639 at 2.18e+05 assign (resid 63 and name HD1# ) (resid 76 and name HG2# ) 4.0 2.2 2.0 ! A.2389 at 3.68e+05 ! P64 assign (resid 64 and name HA ) (resid 64 and name HD1 ) 4.0 2.2 1.0 ! A.1278 at -6.20e+05 assign (resid 64 and name HB1 ) (resid 64 and name HD1 ) 3.0 1.2 0.3 ! A.1312 at 1.22e+06 assign (resid 64 and name HB1 ) (resid 64 and name HD2 ) 4.0 1.2 0.3 ! A.1286 at 1.31e+06 assign (resid 64 and name HA ) (resid 64 and name HD2 ) 4.0 2.2 1.0 ! A.1280 at -3.89e+05 assign (resid 64 and name HA ) (resid 64 and name HG2 ) 4.0 2.2 1.0 ! A.1430 at 6.29e+05 assign (resid 64 and name HA ) (resid 64 and name HG1 ) 4.0 2.2 1.0 ! A.1431 at 4.99e+05 assign (resid 64 and name HA ) (resid 65 and name HA ) 4.0 2.2 1.0 ! A.539 at 2.60e+05 assign (resid 64 and name HA ) (resid 65 and name HB2 ) 4.0 2.2 2.0 ! A.2411 at -2.03e+05 assign (resid 64 and name HB2 ) (resid 65 and name HB2 ) 4.0 2.2 1.0 ! A.2421 at 2.65e+05 assign (resid 64 and name HA ) (resid 66 and name HG ) 4.0 2.2 2.0 ! A.2530 at 1.71e+05 assign (resid 64 and name HA ) (resid 66 and name HD1# ) 4.0 2.2 2.5 ! A.533 at 2.13e+05 ! D65 ! L66 assign (resid 66 and name HA ) (resid 66 and name HG ) 4.0 2.2 1.0 ! A.2461 at 6.59e+05 assign (resid 66 and name HA ) (resid 66 and name HD1# ) 4.0 2.2 1.5 ! A.865 at 8.60e+05 assign (resid 66 and name HB1 ) (resid 66 and name HD1# ) 3.0 1.2 0.8 ! A.845 at -4.97e+06 assign (resid 66 and name HD2# ) (resid 66 and name HB2 ) 3.0 1.2 0.8 ! A.2474 at -2.12e+06 assign (resid 66 and name HA ) (resid 66 and name HD2# ) 2.5 0.7 0.7 ! A.944 at 6.68e+06 assign (resid 66 and name HB1 ) (resid 66 and name HD2# ) 3.0 1.2 0.8 ! A.943 at -3.43e+06 assign (resid 66 and name HA ) (resid 67 and name HG ) 4.0 2.2 1.0 ! A.2452 at 3.05e+05 assign (resid 66 and name HA ) (resid 67 and name HD2# ) 4.0 2.2 1.5 ! A.2451 at 2.82e+05 assign (resid 66 and name HB1 ) (resid 68 and name HA ) 4.0 2.2 2.0 ! A.540 at -2.49e+05 assign (resid 66 and name HD1# ) (resid 70 and name HB# ) 4.0 2.2 2.5 ! A.844 at -2.36e+05 assign (resid 66 and name HD2# ) (resid 72 and name HD# ) 4.0 2.2 1.5 ! A.592 at -4.07e+05 assign (resid 66 and name HD1# ) (resid 72 and name HD# ) 4.0 2.2 1.5 ! A.593 at -2.89e+05 assign (resid 66 and name HD1# ) (resid 72 and name HE# ) 4.0 2.2 1.5 ! A.848 at -5.84e+05 assign (resid 66 and name HD2# ) (resid 72 and name HB2 ) 4.0 2.2 1.5 ! A.2629 at -2.61e+05 assign (resid 66 and name HD1# ) (resid 72 and name HB2 ) 4.0 2.2 2.5 ! A.1864 at -2.43e+05 assign (resid 66 and name HB1 ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.2471 at 6.43e+05 assign (resid 66 and name HD2# ) (resid 72 and name HE# ) 3.0 1.2 0.8 ! A.946 at -1.32e+06 assign (resid 66 and name HA ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.2445 at -2.94e+05 assign (resid 66 and name HD1# ) (resid 74 and name HG2# ) 4.0 2.2 2.0 ! A.2453 at 2.96e+05 assign (resid 66 and name HD1# ) (resid 95 and name HB ) 4.0 2.2 1.5 ! A.1357 at 2.86e+05 assign (resid 66 and name HD1# ) (resid 95 and name HG2# ) 3.0 1.2 1.3 ! A.846 at 2.76e+06 assign (resid 66 and name HD2# ) (resid 95 and name HG2# ) 4.0 2.2 2.0 ! A.3004 at 6.52e+05 assign (resid 66 and name HA ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.2450 at 2.94e+05 ! L67 assign (resid 67 and name HG ) (resid 67 and name HA ) 4.0 2.2 1.0 ! A.1671 at -7.71e+05 assign (resid 67 and name HD1# ) (resid 67 and name HA ) 4.0 2.2 1.5 ! A.1675 at -4.54e+05 assign (resid 67 and name HD2# ) (resid 67 and name HA ) 3.0 1.2 0.8 ! A.1676 at -3.78e+06 assign (resid 67 and name HB2 ) (resid 67 and name HD1# ) 3.0 1.2 0.8 ! A.2467 at -1.97e+06 assign (resid 67 and name HB1 ) (resid 67 and name HD1# ) 3.0 1.2 0.8 ! A.2468 at -1.82e+06 assign (resid 67 and name HB2 ) (resid 67 and name HD2# ) 3.0 1.2 0.8 ! A.2499 at -1.50e+06 assign (resid 67 and name HB1 ) (resid 67 and name HD2# ) 3.0 1.2 0.8 ! A.2498 at -2.17e+06 assign (resid 67 and name HA ) (resid 68 and name HD1 ) 3.0 1.2 0.3 ! A.69 at 4.29e+06 assign (resid 67 and name HA ) (resid 68 and name HG# ) 4.0 2.2 1.0 ! A.1672 at -9.67e+05 assign (resid 67 and name HA ) (resid 68 and name HD2 ) 3.0 1.2 0.3 ! A.68 at 3.93e+06 assign (resid 67 and name HB1 ) (resid 68 and name HD1 ) 4.0 2.2 1.0 ! A.1318 at 4.88e+05 assign (resid 67 and name HD2# ) (resid 68 and name HD1 ) 3.0 1.2 0.8 ! A.1321 at -1.19e+06 assign (resid 67 and name HB1 ) (resid 68 and name HD2 ) 4.0 2.2 1.0 ! A.1325 at 8.44e+05 assign (resid 67 and name HD2# ) (resid 68 and name HD2 ) 3.0 1.2 0.8 ! A.1323 at -1.35e+06 assign (resid 67 and name HD1# ) (resid 68 and name HD2 ) 4.0 2.2 1.5 ! A.1324 at -3.91e+05 assign (resid 67 and name HD1# ) (resid 68 and name HD1 ) 4.0 2.2 2.5 ! A.2463 at -2.41e+05 assign (resid 67 and name HB2 ) (resid 68 and name HD2 ) 4.0 2.2 1.0 ! A.1326 at 3.96e+05 assign (resid 67 and name HD2# ) (resid 68 and name HG# ) 4.0 2.2 1.5 ! A.2257 at 4.52e+05 assign (resid 67 and name HG ) (resid 68 and name HD1 ) 4.0 2.2 2.0 ! A.2492 at -2.33e+05 assign (resid 67 and name HG ) (resid 68 and name HD2 ) 4.0 2.2 2.0 ! A.2493 at -1.82e+05 assign (resid 67 and name HB1 ) (resid 68 and name HG# ) 4.0 2.2 2.0 ! A.2527 at -2.26e+05 assign (resid 67 and name HA ) (resid 70 and name HG# ) 4.0 2.2 2.0 ! A.2488 at -2.25e+05 assign (resid 67 and name HB2 ) (resid 70 and name HG# ) 3.0 1.2 0.3 ! A.2510 at -1.03e+06 assign (resid 67 and name HD1# ) (resid 70 and name HD2 ) 4.0 2.2 1.5 ! A.2464 at -4.48e+05 assign (resid 67 and name HD2# ) (resid 70 and name HD1 ) 4.0 2.2 1.5 ! A.2500 at -3.18e+05 assign (resid 67 and name HB2 ) (resid 70 and name HB# ) 4.0 2.2 1.0 ! A.2517 at 2.76e+05 assign (resid 67 and name HB2 ) (resid 70 and name HD2 ) 4.0 2.2 2.0 ! A.2518 at 2.22e+05 assign (resid 67 and name HD1# ) (resid 70 and name HD1 ) 4.0 2.2 1.5 ! A.1395 at -3.11e+05 assign (resid 67 and name HB2 ) (resid 70 and name HD1 ) 4.0 2.2 2.0 ! A.1396 at 1.68e+05 assign (resid 67 and name HB1 ) (resid 70 and name HD1 ) 4.0 2.2 2.0 ! A.1397 at 1.76e+05 assign (resid 67 and name HB1 ) (resid 70 and name HD2 ) 4.0 2.2 2.0 ! A.1405 at 1.92e+05 assign (resid 67 and name HB2 ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.2505 at 2.78e+05 assign (resid 67 and name HB1 ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.619 at 2.69e+05 assign (resid 67 and name HD1# ) (resid 72 and name HE# ) 4.0 2.2 1.5 ! A.616 at -3.19e+05 ! P68 assign (resid 68 and name HD2 ) (resid 68 and name HB1 ) 4.0 2.2 1.0 ! A.2539 at -4.07e+05 assign (resid 68 and name HD1 ) (resid 68 and name HB1 ) 4.0 2.2 1.0 ! A.2540 at -5.70e+05 assign (resid 68 and name HD1 ) (resid 68 and name HB2 ) 4.0 2.2 1.0 ! A.2547 at -6.81e+05 assign (resid 68 and name HD2 ) (resid 68 and name HB2 ) 4.0 2.2 1.0 ! A.2546 at -7.11e+05 assign (resid 68 and name HA ) (resid 68 and name HD2 ) 4.0 2.2 1.0 ! A.1327 at -3.41e+05 assign (resid 68 and name HA ) (resid 68 and name HG# ) 3.0 1.2 0.3 ! A.2247 at 1.44e+06 assign (resid 68 and name HA ) (resid 69 and name HA# ) 4.0 2.2 1.0 ! A.542 at -2.67e+05 assign (resid 68 and name HB1 ) (resid 95 and name HB ) 4.0 2.2 1.0 ! A.2538 at 4.26e+05 assign (resid 68 and name HB2 ) (resid 95 and name HB ) 4.0 2.2 2.0 ! A.2550 at 2.07e+05 assign (resid 68 and name HA ) (resid 95 and name HB ) 3.0 1.2 0.3 ! A.1352 at 3.50e+06 assign (resid 68 and name HG# ) (resid 95 and name HG2# ) 4.0 2.2 2.5 ! A.2256 at 2.24e+05 assign (resid 68 and name HA ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.3000 at 7.65e+05 ! G69 assign (resid 69 and name HA# ) (resid 70 and name HA ) 4.0 2.2 1.0 ! A.557 at 2.74e+05 assign (resid 69 and name HA# ) (resid 70 and name HD2 ) 4.0 2.2 2.0 ! A.548 at 2.29e+05 assign (resid 69 and name HA# ) (resid 70 and name HG# ) 4.0 2.2 2.0 ! A.544 at -2.48e+05 assign (resid 69 and name HA# ) (resid 94 and name HG2# ) 4.0 2.2 1.5 ! A.543 at -6.00e+05 ! R70 assign (resid 70 and name HD2 ) (resid 70 and name HA ) 2.5 0.7 0.2 ! A.553 at 5.01e+06 assign (resid 70 and name HG# ) (resid 70 and name HA ) 3.0 1.2 0.3 ! A.555 at -1.97e+06 assign (resid 70 and name HB# ) (resid 70 and name HD1 ) 3.0 1.2 0.3 ! A.1392 at 1.19e+06 assign (resid 70 and name HA ) (resid 70 and name HD1 ) 3.0 1.2 0.3 ! A.1390 at 2.94e+06 assign (resid 70 and name HB# ) (resid 70 and name HD2 ) 3.0 1.2 0.3 ! A.1401 at 1.09e+06 assign (resid 70 and name HA ) (resid 71 and name HA ) 4.0 2.2 2.0 ! A.571 at -2.06e+05 assign (resid 70 and name HA ) (resid 72 and name HD# ) 4.0 2.2 2.0 ! A.558 at 2.03e+05 assign (resid 70 and name HA ) (resid 72 and name HE# ) 4.0 2.2 2.0 ! A.559 at 1.76e+05 assign (resid 70 and name HB# ) (resid 72 and name HD# ) 4.0 2.2 1.0 ! A.597 at 2.89e+05 assign (resid 70 and name HB# ) (resid 72 and name HE# ) 3.0 1.2 0.3 ! A.604 at 1.35e+06 assign (resid 70 and name HD2 ) (resid 72 and name HE# ) 4.0 2.2 2.0 ! A.612 at 2.35e+05 assign (resid 70 and name HG# ) (resid 72 and name HE# ) 4.0 2.2 1.0 ! A.617 at -9.61e+05 assign (resid 70 and name HA ) (resid 94 and name HG2# ) 4.0 2.2 2.5 ! A.2558 at -1.95e+05 assign (resid 70 and name HA ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.2571 at -2.87e+05 assign (resid 70 and name HB# ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.3002 at -5.38e+05 ! K71 assign (resid 71 and name HA ) (resid 71 and name HD# ) 4.0 2.2 1.0 ! A.2619 at 5.76e+05 assign (resid 71 and name HB2 ) (resid 71 and name HD# ) 3.0 1.2 0.3 ! A.2624 at -2.03e+06 assign (resid 71 and name HA ) (resid 71 and name HG1 ) 3.0 1.2 0.3 ! A.2601 at 1.10e+06 assign (resid 71 and name HE# ) (resid 71 and name HG1 ) 4.0 2.2 1.0 ! A.2606 at -6.72e+05 assign (resid 71 and name HA ) (resid 71 and name HG2 ) 4.0 2.2 1.0 ! A.2610 at 8.37e+05 assign (resid 71 and name HE# ) (resid 71 and name HG2 ) 4.0 2.2 1.0 ! A.2614 at -7.64e+05 assign (resid 71 and name HA ) (resid 71 and name HE# ) 4.0 2.2 2.0 ! A.2586 at -2.15e+05 assign (resid 71 and name HE# ) (resid 71 and name HB1 ) 4.0 2.2 1.0 ! A.1544 at 4.95e+05 assign (resid 71 and name HA ) (resid 72 and name HE# ) 4.0 2.2 2.0 ! A.609 at -1.92e+05 assign (resid 71 and name HA ) (resid 72 and name HD# ) 4.0 2.2 1.0 ! A.566 at -2.73e+05 assign (resid 71 and name HD# ) (resid 73 and name HD1# ) 4.0 2.2 1.5 ! A.2626 at 2.79e+05 assign (resid 71 and name HE# ) (resid 73 and name HD1# ) 4.0 2.2 1.5 ! A.2589 at -6.82e+05 assign (resid 71 and name HE# ) (resid 73 and name HG2# ) 4.0 2.2 1.5 ! A.1471 at -3.83e+05 assign (resid 71 and name HD# ) (resid 92 and name HB2 ) 4.0 2.2 1.0 ! A.2621 at 9.02e+05 assign (resid 71 and name HG1 ) (resid 92 and name HB2 ) 4.0 2.2 1.0 ! A.2604 at 5.82e+05 assign (resid 71 and name HG2 ) (resid 92 and name HB2 ) 4.0 2.2 1.0 ! A.2612 at 6.07e+05 assign (resid 71 and name HG1 ) (resid 92 and name HB1 ) 4.0 2.2 2.0 ! A.2967 at 4.89e+05 assign (resid 71 and name HG2 ) (resid 92 and name HB1 ) 4.0 2.2 1.0 ! A.2968 at 5.11e+05 assign (resid 71 and name HD# ) (resid 92 and name HB1 ) 4.0 2.2 1.0 ! A.2969 at 5.45e+05 assign (resid 71 and name HE# ) (resid 92 and name HB1 ) 3.0 1.2 0.3 ! A.2973 at -1.14e+06 assign (resid 71 and name HE# ) (resid 92 and name HB2 ) 3.0 1.2 0.3 ! A.2862 at -1.11e+06 assign (resid 71 and name HE# ) (resid 92 and name HA ) 4.0 2.2 1.0 ! A.1425 at -2.56e+05 assign (resid 71 and name HD# ) (resid 94 and name HG2# ) 4.0 2.2 1.5 ! A.2623 at 6.31e+05 assign (resid 71 and name HD# ) (resid 94 and name HA ) 4.0 2.2 2.0 ! A.2622 at 2.16e+05 assign (resid 71 and name HB2 ) (resid 94 and name HB ) 4.0 2.2 2.0 ! A.1372 at -2.20e+05 assign (resid 71 and name HA ) (resid 94 and name HB ) 4.0 2.2 1.0 ! A.1370 at 7.93e+05 assign (resid 71 and name HG1 ) (resid 94 and name HA ) 4.0 2.2 1.0 ! A.817 at 4.79e+05 assign (resid 71 and name HG2 ) (resid 94 and name HA ) 4.0 2.2 2.0 ! A.2613 at 2.47e+05 assign (resid 71 and name HA ) (resid 94 and name HG2# ) 3.0 1.2 0.8 ! A.1119 at 1.89e+06 assign (resid 71 and name HB2 ) (resid 94 and name HG2# ) 3.0 1.2 0.8 ! A.1120 at -1.15e+06 assign (resid 71 and name HE# ) (resid 94 and name HG2# ) 3.0 1.2 0.8 ! A.1426 at -1.04e+06 assign (resid 71 and name HE# ) (resid 94 and name HB ) 4.0 2.2 2.0 ! A.1424 at -2.41e+05 assign (resid 71 and name HA ) (resid 94 and name HA ) 2.5 0.7 0.2 ! A.812 at 6.88e+06 assign (resid 71 and name HE# ) (resid 94 and name HA ) 4.0 2.2 2.0 ! A.819 at -1.91e+05 assign (resid 71 and name HB2 ) (resid 94 and name HA ) 4.0 2.2 1.0 ! A.814 at -5.93e+05 assign (resid 71 and name HB1 ) (resid 94 and name HA ) 4.0 2.2 1.0 ! A.1538 at -3.11e+05 ! Y72 assign (resid 72 and name HB2 ) (resid 72 and name HD# ) 3.0 1.2 0.3 ! A.587 at 1.74e+06 assign (resid 72 and name HA ) (resid 72 and name HD# ) 4.0 2.2 1.0 ! A.588 at -6.23e+05 assign (resid 72 and name HE# ) (resid 72 and name HB2 ) 4.0 2.2 1.0 ! A.2632 at 6.68e+05 assign (resid 72 and name HD# ) (resid 72 and name HB1 ) 3.0 1.2 0.3 ! A.1691 at 1.40e+06 assign (resid 72 and name HE# ) (resid 72 and name HA ) 4.0 2.2 1.0 ! A.572 at -5.47e+05 assign (resid 72 and name HA ) (resid 73 and name HG11 ) 4.0 2.2 1.0 ! A.2659 at 4.22e+05 assign (resid 72 and name HB2 ) (resid 73 and name HA ) 4.0 2.2 2.0 ! A.629 at -2.46e+05 assign (resid 72 and name HA ) (resid 73 and name HG2# ) 4.0 2.2 2.5 ! A.582 at 1.86e+05 assign (resid 72 and name HA ) (resid 73 and name HA ) 4.0 2.2 2.0 ! A.585 at 2.26e+05 assign (resid 72 and name HA ) (resid 73 and name HB ) 4.0 2.2 1.0 ! A.578 at -2.77e+05 assign (resid 72 and name HA ) (resid 73 and name HD1# ) 4.0 2.2 2.5 ! A.2628 at 2.48e+05 assign (resid 72 and name HD# ) (resid 74 and name HG2# ) 4.0 2.2 2.5 ! A.595 at -1.81e+05 assign (resid 72 and name HA ) (resid 74 and name HG2# ) 4.0 2.2 2.5 ! A.2671 at 2.00e+05 assign (resid 72 and name HB2 ) (resid 92 and name HA ) 4.0 2.2 1.0 ! A.2954 at -4.11e+05 assign (resid 72 and name HB2 ) (resid 93 and name HB# ) 4.0 2.2 1.0 ! A.2980 at -2.68e+05 assign (resid 72 and name HD# ) (resid 95 and name HG2# ) 3.0 1.2 0.8 ! A.591 at -1.02e+06 assign (resid 72 and name HE# ) (resid 95 and name HB ) 4.0 2.2 2.0 ! A.1353 at -1.42e+05 assign (resid 72 and name HD# ) (resid 95 and name HB ) 4.0 2.2 2.0 ! A.1354 at -1.44e+05 assign (resid 72 and name HE# ) (resid 95 and name HG2# ) 3.0 1.2 0.8 ! A.1157 at -1.62e+06 ! I73 assign (resid 73 and name HA ) (resid 73 and name HG12 ) 4.0 2.2 1.0 ! A.2651 at 7.43e+05 assign (resid 73 and name HA ) (resid 73 and name HG11 ) 4.0 2.2 1.0 ! A.2658 at 9.04e+05 assign (resid 73 and name HD1# ) (resid 73 and name HA ) 3.0 1.2 0.8 ! A.626 at 1.71e+06 assign (resid 73 and name HG2# ) (resid 73 and name HA ) 3.0 1.2 0.8 ! A.625 at 3.94e+06 assign (resid 73 and name HA ) (resid 74 and name HG2# ) 4.0 2.2 1.5 ! A.1173 at 5.70e+05 assign (resid 73 and name HB ) (resid 74 and name HA ) 4.0 2.2 2.0 ! A.642 at -1.81e+05 assign (resid 73 and name HG2# ) (resid 74 and name HA ) 4.0 2.2 1.5 ! A.635 at 4.43e+05 assign (resid 73 and name HG2# ) (resid 75 and name HA ) 4.0 2.2 2.5 ! A.26 at -1.65e+05 assign (resid 73 and name HG12 ) (resid 92 and name HB1 ) 4.0 2.2 1.0 ! A.2653 at 2.96e+05 assign (resid 73 and name HG11 ) (resid 92 and name HB1 ) 4.0 2.2 1.0 ! A.2662 at 4.08e+05 assign (resid 73 and name HA ) (resid 92 and name HB1 ) 3.0 1.2 0.3 ! A.2974 at 1.11e+06 assign (resid 73 and name HD1# ) (resid 92 and name HB1 ) 4.0 2.2 1.5 ! A.2963 at 9.23e+05 assign (resid 73 and name HG2# ) (resid 92 and name HB1 ) 3.0 1.2 0.8 ! A.1469 at 1.22e+06 assign (resid 73 and name HG11 ) (resid 92 and name HB2 ) 4.0 2.2 1.0 ! A.2957 at 3.19e+05 assign (resid 73 and name HA ) (resid 92 and name HB2 ) 3.0 1.2 0.3 ! A.1522 at 1.07e+06 assign (resid 73 and name HD1# ) (resid 92 and name HB2 ) 4.0 2.2 1.5 ! A.1530 at 8.94e+05 assign (resid 73 and name HA ) (resid 92 and name HA ) 2.5 0.7 0.2 ! A.624 at 5.88e+06 assign (resid 73 and name HG2# ) (resid 92 and name HA ) 4.0 2.2 1.5 ! A.1466 at 8.16e+05 assign (resid 73 and name HB ) (resid 92 and name HA ) 4.0 2.2 2.0 ! A.2955 at -2.52e+05 assign (resid 73 and name HD1# ) (resid 92 and name HA ) 4.0 2.2 1.5 ! A.803 at 5.83e+05 assign (resid 73 and name HG11 ) (resid 92 and name HA ) 4.0 2.2 1.0 ! A.804 at 2.75e+05 ! V74 assign (resid 74 and name HA ) (resid 74 and name HG1# ) 3.0 1.2 0.8 ! A.1556 at 3.38e+06 assign (resid 74 and name HA ) (resid 74 and name HG2# ) 3.0 1.2 0.8 ! A.1172 at 3.82e+06 assign (resid 74 and name HB ) (resid 75 and name HA ) 4.0 2.2 2.0 ! A.2684 at 1.54e+05 assign (resid 74 and name HG1# ) (resid 75 and name HA ) 4.0 2.2 1.5 ! A.24 at -5.84e+05 assign (resid 74 and name HA ) (resid 75 and name HA ) 4.0 2.2 2.0 ! A.2666 at -1.67e+05 assign (resid 74 and name HG1# ) (resid 76 and name HG2# ) 2.5 0.7 1.2 ! A.889 at 8.86e+06 assign (resid 74 and name HA ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.2665 at 3.35e+05 assign (resid 74 and name HB ) (resid 91 and name HB ) 4.0 2.2 2.0 ! A.1389 at -1.70e+05 assign (resid 74 and name HG1# ) (resid 91 and name HG2# ) 3.0 1.2 1.3 ! A.1563 at 2.19e+06 assign (resid 74 and name HG1# ) (resid 91 and name HB ) 4.0 2.2 2.5 ! A.2670 at 2.41e+05 assign (resid 74 and name HG2# ) (resid 91 and name HG2# ) 3.0 1.2 1.3 ! A.2680 at 1.78e+06 assign (resid 74 and name HA ) (resid 91 and name HG2# ) 4.0 2.2 1.5 ! A.636 at 2.97e+05 assign (resid 74 and name HB ) (resid 91 and name HG2# ) 3.0 1.2 0.8 ! A.1143 at -3.40e+06 assign (resid 74 and name HG2# ) (resid 92 and name HB1 ) 4.0 2.2 2.5 ! A.2966 at 1.87e+05 assign (resid 74 and name HG2# ) (resid 92 and name HA ) 4.0 2.2 1.5 ! A.1174 at 5.75e+05 assign (resid 74 and name HB ) (resid 92 and name HA ) 4.0 2.2 1.0 ! A.2956 at -2.97e+05 assign (resid 74 and name HG2# ) (resid 93 and name HB# ) 4.0 2.2 1.5 ! A.2983 at 6.86e+05 ! N75 assign (resid 75 and name HA ) (resid 76 and name HG2# ) 4.0 2.2 1.5 ! A.28 at -3.72e+05 assign (resid 75 and name HA ) (resid 77 and name HE# ) 4.0 2.2 2.0 ! A.643 at 2.16e+05 assign (resid 75 and name HB2 ) (resid 77 and name HE# ) 3.0 1.2 0.3 ! A.2082 at 1.33e+06 assign (resid 75 and name HB1 ) (resid 77 and name HE# ) 4.0 2.2 1.0 ! A.2686 at 9.28e+05 assign (resid 75 and name HA ) (resid 87 and name HD2# ) 4.0 2.2 1.5 ! A.25 at -2.69e+05 assign (resid 75 and name HA ) (resid 87 and name HD1# ) 3.0 1.2 0.8 ! A.23 at -1.64e+06 assign (resid 75 and name HB1 ) (resid 87 and name HD2# ) 4.0 2.2 2.5 ! A.1947 at -2.49e+05 assign (resid 75 and name HB1 ) (resid 87 and name HD1# ) 3.0 1.2 0.8 ! A.1000 at -2.52e+06 assign (resid 75 and name HB2 ) (resid 87 and name HD1# ) 3.0 1.2 0.8 ! A.1001 at -1.26e+06 assign (resid 75 and name HA ) (resid 89 and name HD2# ) 4.0 2.2 2.5 ! A.29 at -1.96e+05 assign (resid 75 and name HA ) (resid 89 and name HG ) 4.0 2.2 2.0 ! A.30 at -2.43e+05 assign (resid 75 and name HA ) (resid 90 and name HA ) 3.0 1.2 0.3 ! A.21 at -4.43e+06 assign (resid 75 and name HA ) (resid 90 and name HB# ) 4.0 2.2 1.0 ! A.20 at -7.31e+05 assign (resid 75 and name HB1 ) (resid 90 and name HA ) 4.0 2.2 1.0 ! A.2687 at -2.93e+05 assign (resid 75 and name HA ) (resid 91 and name HG2# ) 4.0 2.2 2.5 ! A.27 at -1.91e+05 ! V76 assign (resid 76 and name HA ) (resid 76 and name HG2# ) 3.0 1.2 0.8 ! A.880 at 3.46e+06 assign (resid 76 and name HG1# ) (resid 76 and name HA ) 3.0 1.2 0.8 ! A.645 at 3.84e+06 assign (resid 76 and name HA ) (resid 77 and name HD# ) 4.0 2.2 1.0 ! A.673 at -3.68e+05 assign (resid 76 and name HA ) (resid 77 and name HA ) 4.0 2.2 1.0 ! A.667 at 3.24e+05 assign (resid 76 and name HA ) (resid 77 and name HE# ) 4.0 2.2 2.0 ! A.650 at -1.56e+05 assign (resid 76 and name HG1# ) (resid 77 and name HA ) 4.0 2.2 1.5 ! A.900 at 3.71e+05 assign (resid 76 and name HG1# ) (resid 77 and name HD# ) 4.0 2.2 2.5 ! A.894 at -2.19e+05 assign (resid 76 and name HG1# ) (resid 78 and name HA ) 4.0 2.2 1.5 ! A.901 at 2.59e+05 assign (resid 76 and name HA ) (resid 87 and name HD1# ) 4.0 2.2 2.5 ! A.655 at 1.95e+05 assign (resid 76 and name HG1# ) (resid 87 and name HD1# ) 4.0 2.2 2.0 ! A.918 at 2.81e+05 assign (resid 76 and name HG1# ) (resid 88 and name HG11 ) 3.0 1.2 0.8 ! A.2207 at 1.08e+06 assign (resid 76 and name HG2# ) (resid 88 and name HG11 ) 4.0 2.2 1.5 ! A.2208 at 4.69e+05 assign (resid 76 and name HB ) (resid 88 and name HG11 ) 4.0 2.2 1.0 ! A.2200 at -5.97e+05 assign (resid 76 and name HB ) (resid 88 and name HG12 ) 4.0 2.2 1.0 ! A.2930 at -8.24e+05 assign (resid 76 and name HG1# ) (resid 88 and name HG12 ) 3.0 1.2 0.8 ! A.909 at 1.41e+06 assign (resid 76 and name HG2# ) (resid 88 and name HD1# ) 4.0 2.2 2.0 ! A.888 at 4.16e+05 assign (resid 76 and name HA ) (resid 88 and name HD1# ) 4.0 2.2 2.5 ! A.653 at 1.74e+05 assign (resid 76 and name HG1# ) (resid 88 and name HB ) 4.0 2.2 1.5 ! A.2899 at -4.03e+05 assign (resid 76 and name HG1# ) (resid 88 and name HD1# ) 3.0 1.2 1.3 ! A.913 at 2.86e+06 assign (resid 76 and name HG1# ) (resid 88 and name HG2# ) 4.0 2.2 2.0 ! A.917 at 5.49e+05 assign (resid 76 and name HB ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.1044 at -5.18e+05 assign (resid 76 and name HG2# ) (resid 89 and name HG ) 4.0 2.2 1.5 ! A.1920 at 4.40e+05 assign (resid 76 and name HG1# ) (resid 89 and name HD2# ) 4.0 2.2 2.0 ! A.2927 at 5.55e+05 assign (resid 76 and name HG2# ) (resid 89 and name HD2# ) 3.0 1.2 1.3 ! A.2926 at 3.04e+06 assign (resid 76 and name HB ) (resid 89 and name HB2 ) 4.0 2.2 1.0 ! A.2935 at 7.99e+05 assign (resid 76 and name HG1# ) (resid 89 and name HB2 ) 4.0 2.2 1.5 ! A.2937 at -3.10e+05 assign (resid 76 and name HG2# ) (resid 89 and name HB2 ) 4.0 2.2 1.5 ! A.2938 at -7.97e+05 assign (resid 76 and name HG1# ) (resid 89 and name HB1 ) 4.0 2.2 1.5 ! A.2944 at -4.63e+05 assign (resid 76 and name HG2# ) (resid 89 and name HB1 ) 3.0 1.2 0.8 ! A.2943 at -1.16e+06 assign (resid 76 and name HG2# ) (resid 89 and name HD1# ) 4.0 2.2 2.0 ! A.2135 at 9.81e+05 assign (resid 76 and name HG1# ) (resid 89 and name HD1# ) 4.0 2.2 2.0 ! A.2136 at 3.89e+05 assign (resid 76 and name HG2# ) (resid 89 and name HA ) 4.0 2.2 1.5 ! A.780 at 3.09e+05 assign (resid 76 and name HG2# ) (resid 90 and name HA ) 4.0 2.2 1.5 ! A.879 at 2.65e+05 assign (resid 76 and name HG2# ) (resid 90 and name HB# ) 4.0 2.2 2.5 ! A.882 at 2.03e+05 assign (resid 76 and name HG2# ) (resid 91 and name HG2# ) 4.0 2.2 2.0 ! A.1155 at 4.81e+05 ! Y77 assign (resid 77 and name HB2 ) (resid 77 and name HD# ) 3.0 1.2 0.3 ! A.675 at 1.92e+06 assign (resid 77 and name HB1 ) (resid 77 and name HD# ) 3.0 1.2 0.3 ! A.676 at 1.75e+06 assign (resid 77 and name HA ) (resid 77 and name HD# ) 3.0 1.2 0.3 ! A.670 at -1.18e+06 assign (resid 77 and name HE# ) (resid 77 and name HB2 ) 4.0 2.2 1.0 ! A.2722 at 4.49e+05 assign (resid 77 and name HE# ) (resid 77 and name HB1 ) 4.0 2.2 1.0 ! A.2737 at 3.18e+05 assign (resid 77 and name HE# ) (resid 77 and name HA ) 4.0 2.2 1.0 ! A.656 at -3.64e+05 assign (resid 77 and name HB1 ) (resid 78 and name HA ) 4.0 2.2 1.0 ! A.2739 at -3.06e+05 assign (resid 77 and name HA ) (resid 78 and name HG2 ) 4.0 2.2 2.0 ! A.664 at -1.97e+05 assign (resid 77 and name HB2 ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.2731 at -4.12e+05 assign (resid 77 and name HB2 ) (resid 79 and name HG12 ) 4.0 2.2 2.0 ! A.2735 at -1.43e+05 assign (resid 77 and name HB1 ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.2740 at -3.15e+05 assign (resid 77 and name HB2 ) (resid 85 and name HB# ) 4.0 2.2 1.0 ! A.2855 at -3.56e+05 assign (resid 77 and name HB1 ) (resid 85 and name HB# ) 4.0 2.2 1.0 ! A.2854 at -5.05e+05 assign (resid 77 and name HD# ) (resid 85 and name HB# ) 4.0 2.2 1.0 ! A.2850 at -6.59e+05 assign (resid 77 and name HD# ) (resid 85 and name HA ) 4.0 2.2 2.0 ! A.2748 at -2.29e+05 assign (resid 77 and name HB2 ) (resid 85 and name HG1 ) 4.0 2.2 1.0 ! A.2729 at 2.78e+05 assign (resid 77 and name HB1 ) (resid 85 and name HG1 ) 4.0 2.2 1.0 ! A.2746 at 3.03e+05 assign (resid 77 and name HB1 ) (resid 85 and name HG2 ) 4.0 2.2 1.0 ! A.2747 at 3.03e+05 assign (resid 77 and name HA ) (resid 85 and name HB# ) 4.0 2.2 1.0 ! A.666 at 2.68e+05 assign (resid 77 and name HB2 ) (resid 85 and name HA ) 4.0 2.2 2.0 ! A.742 at -1.60e+05 assign (resid 77 and name HB1 ) (resid 85 and name HA ) 4.0 2.2 1.0 ! A.741 at -2.79e+05 assign (resid 77 and name HD# ) (resid 86 and name HA ) 4.0 2.2 1.0 ! A.671 at -4.57e+05 assign (resid 77 and name HE# ) (resid 86 and name HA ) 4.0 2.2 2.0 ! A.747 at -2.26e+05 assign (resid 77 and name HA ) (resid 86 and name HB2 ) 4.0 2.2 2.0 ! A.2717 at 1.79e+05 assign (resid 77 and name HD# ) (resid 87 and name HB2 ) 4.0 2.2 1.0 ! A.680 at 3.97e+05 assign (resid 77 and name HD# ) (resid 87 and name HA ) 3.0 1.2 0.3 ! A.754 at -1.29e+06 assign (resid 77 and name HD# ) (resid 87 and name HD1# ) 4.0 2.2 1.5 ! A.677 at -7.65e+05 assign (resid 77 and name HD# ) (resid 87 and name HD2# ) 4.0 2.2 2.5 ! A.1210 at -2.26e+05 assign (resid 77 and name HE# ) (resid 87 and name HG ) 4.0 2.2 1.0 ! A.2879 at -3.62e+05 assign (resid 77 and name HE# ) (resid 87 and name HD2# ) 4.0 2.2 1.5 ! A.1937 at -4.90e+05 assign (resid 77 and name HA ) (resid 87 and name HD1# ) 4.0 2.2 1.5 ! A.1004 at 9.34e+05 assign (resid 77 and name HE# ) (resid 87 and name HD1# ) 3.0 1.2 0.8 ! A.1007 at -1.64e+06 assign (resid 77 and name HA ) (resid 87 and name HB1 ) 4.0 2.2 2.0 ! A.2882 at -2.46e+05 assign (resid 77 and name HE# ) (resid 87 and name HB1 ) 4.0 2.2 1.0 ! A.2507 at 3.32e+05 assign (resid 77 and name HA ) (resid 87 and name HB2 ) 4.0 2.2 1.0 ! A.2889 at -2.73e+05 assign (resid 77 and name HE# ) (resid 87 and name HB2 ) 4.0 2.2 1.0 ! A.1900 at 6.49e+05 assign (resid 77 and name HD# ) (resid 87 and name HB1 ) 4.0 2.2 2.0 ! A.2504 at 2.07e+05 assign (resid 77 and name HB2 ) (resid 87 and name HA ) 4.0 2.2 2.0 ! A.2727 at -2.19e+05 assign (resid 77 and name HE# ) (resid 87 and name HA ) 4.0 2.2 1.0 ! A.1188 at -5.23e+05 assign (resid 77 and name HA ) (resid 87 and name HA ) 3.0 1.2 0.3 ! A.762 at 3.59e+06 assign (resid 77 and name HB1 ) (resid 87 and name HA ) 4.0 2.2 1.0 ! A.763 at -3.03e+05 assign (resid 77 and name HA ) (resid 88 and name HG11 ) 4.0 2.2 1.0 ! A.665 at 3.90e+05 assign (resid 77 and name HA ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.1212 at 5.10e+05 assign (resid 77 and name HA ) (resid 88 and name HG12 ) 4.0 2.2 1.0 ! A.2720 at 4.99e+05 assign (resid 77 and name HA ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.662 at 2.96e+05 ! Q78 assign (resid 78 and name HA ) (resid 78 and name HG1 ) 4.0 2.2 1.0 ! A.1876 at -7.19e+05 assign (resid 78 and name HA ) (resid 78 and name HG2 ) 4.0 2.2 1.0 ! A.1839 at -5.23e+05 assign (resid 78 and name HA ) (resid 79 and name HG11 ) 4.0 2.2 2.0 ! A.2755 at 1.85e+05 assign (resid 78 and name HA ) (resid 79 and name HD1# ) 4.0 2.2 1.5 ! A.692 at 3.04e+05 assign (resid 78 and name HA ) (resid 79 and name HG12 ) 4.0 2.2 1.0 ! A.697 at 2.89e+05 assign (resid 78 and name HG2 ) (resid 86 and name HB1 ) 4.0 2.2 1.0 ! A.2860 at -4.93e+05 assign (resid 78 and name HG2 ) (resid 86 and name HB2 ) 4.0 2.2 1.0 ! A.2861 at -5.39e+05 assign (resid 78 and name HG1 ) (resid 86 and name HB1 ) 4.0 2.2 1.0 ! A.2762 at -2.83e+05 assign (resid 78 and name HG1 ) (resid 86 and name HB2 ) 4.0 2.2 1.0 ! A.2759 at -2.60e+05 assign (resid 78 and name HB1 ) (resid 88 and name HG12 ) 4.0 2.2 1.0 ! A.2772 at 3.21e+05 assign (resid 78 and name HB1 ) (resid 88 and name HG2# ) 3.0 1.2 0.8 ! A.2770 at 1.14e+06 assign (resid 78 and name HB2 ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.2050 at 5.58e+05 assign (resid 78 and name HB1 ) (resid 88 and name HD1# ) 3.0 1.2 0.8 ! A.1043 at 1.09e+06 assign (resid 78 and name HG2 ) (resid 88 and name HG2# ) 3.0 1.2 0.8 ! A.1476 at -1.49e+06 assign (resid 78 and name HA ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.2909 at 4.83e+05 assign (resid 78 and name HG1 ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.1881 at -4.55e+05 assign (resid 78 and name HG2 ) (resid 88 and name HD1# ) 4.0 2.2 1.5 ! A.2766 at -3.05e+05 assign (resid 78 and name HA ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.690 at 2.96e+05 ! I79 assign (resid 79 and name HA ) (resid 79 and name HG11 ) 4.0 2.2 1.0 ! A.2663 at 9.49e+05 assign (resid 79 and name HA ) (resid 79 and name HG12 ) 3.0 1.2 0.3 ! A.2796 at 1.14e+06 assign (resid 79 and name HG2# ) (resid 79 and name HA ) 3.0 1.2 0.8 ! A.699 at 4.51e+06 assign (resid 79 and name HD1# ) (resid 79 and name HA ) 3.0 1.2 0.8 ! A.700 at 2.66e+06 assign (resid 79 and name HD1# ) (resid 79 and name HB ) 3.0 1.2 0.8 ! A.2786 at -1.85e+06 assign (resid 79 and name HG2# ) (resid 80 and name HB2 ) 4.0 2.2 2.5 ! A.2814 at 1.57e+05 assign (resid 79 and name HG2# ) (resid 80 and name HA ) 4.0 2.2 1.5 ! A.711 at 4.25e+05 assign (resid 79 and name HG2# ) (resid 81 and name HA ) 4.0 2.2 1.5 ! A.2822 at 2.67e+05 assign (resid 79 and name HG2# ) (resid 83 and name HA1 ) 3.0 1.2 0.8 ! A.722 at -1.57e+06 assign (resid 79 and name HG2# ) (resid 83 and name HA2 ) 3.0 1.2 0.8 ! A.727 at -2.13e+06 assign (resid 79 and name HD1# ) (resid 83 and name HA2 ) 4.0 2.2 2.5 ! A.1347 at -2.00e+05 assign (resid 79 and name HG2# ) (resid 84 and name HB# ) 4.0 2.2 1.5 ! A.837 at 2.55e+05 assign (resid 79 and name HG2# ) (resid 84 and name HA ) 4.0 2.2 1.5 ! A.729 at 2.76e+05 assign (resid 79 and name HG12 ) (resid 85 and name HB# ) 4.0 2.2 1.0 ! A.2856 at 2.64e+05 assign (resid 79 and name HA ) (resid 85 and name HB# ) 4.0 2.2 1.0 ! A.2851 at 4.65e+05 assign (resid 79 and name HG2# ) (resid 85 and name HB# ) 4.0 2.2 1.5 ! A.2853 at 3.08e+05 assign (resid 79 and name HD1# ) (resid 85 and name HB# ) 4.0 2.2 1.5 ! A.2852 at 7.93e+05 assign (resid 79 and name HG11 ) (resid 85 and name HA ) 4.0 2.2 1.0 ! A.2803 at 3.22e+05 assign (resid 79 and name HG11 ) (resid 85 and name HG2 ) 4.0 2.2 1.0 ! A.2810 at -2.63e+05 assign (resid 79 and name HG12 ) (resid 85 and name HA ) 4.0 2.2 1.0 ! A.2798 at 3.83e+05 assign (resid 79 and name HA ) (resid 85 and name HA ) 3.0 1.2 0.3 ! A.706 at 4.60e+06 assign (resid 79 and name HA ) (resid 85 and name HG2 ) 4.0 2.2 1.0 ! A.701 at -4.92e+05 assign (resid 79 and name HG2# ) (resid 85 and name HA ) 4.0 2.2 1.5 ! A.827 at 6.42e+05 assign (resid 79 and name HG2# ) (resid 85 and name HG1 ) 4.0 2.2 1.5 ! A.835 at -2.90e+05 assign (resid 79 and name HG2# ) (resid 85 and name HG2 ) 4.0 2.2 1.5 ! A.834 at -6.33e+05 assign (resid 79 and name HB ) (resid 85 and name HA ) 4.0 2.2 2.0 ! A.743 at -1.89e+05 assign (resid 79 and name HD1# ) (resid 85 and name HA ) 4.0 2.2 1.5 ! A.3013 at 9.07e+05 assign (resid 79 and name HG11 ) (resid 85 and name HG1 ) 4.0 2.2 1.0 ! A.2761 at -2.53e+05 assign (resid 79 and name HD1# ) (resid 85 and name HG1 ) 4.0 2.2 1.5 ! A.1799 at -5.39e+05 assign (resid 79 and name HD1# ) (resid 85 and name HG2 ) 4.0 2.2 1.5 ! A.1642 at -6.19e+05 ! S80 assign (resid 80 and name HB2 ) (resid 81 and name HB# ) 4.0 2.2 2.0 ! A.2828 at 1.98e+05 assign (resid 80 and name HB2 ) (resid 81 and name HG# ) 4.0 2.2 2.0 ! A.2816 at -2.33e+05 assign (resid 80 and name HA ) (resid 81 and name HA ) 4.0 2.2 1.0 ! A.718 at 3.27e+05 assign (resid 80 and name HA ) (resid 81 and name HG# ) 4.0 2.2 1.0 ! A.712 at -3.82e+05 assign (resid 80 and name HA ) (resid 81 and name HB# ) 4.0 2.2 1.0 ! A.2811 at 2.91e+05 assign (resid 80 and name HB2 ) (resid 84 and name HB# ) 4.0 2.2 1.0 ! A.1452 at 5.32e+05 assign (resid 80 and name HB1 ) (resid 84 and name HB# ) 3.0 1.2 0.3 ! A.2819 at 1.02e+06 assign (resid 80 and name HB2 ) (resid 84 and name HG2 ) 4.0 2.2 2.0 ! A.2817 at -1.52e+05 assign (resid 80 and name HB1 ) (resid 84 and name HG1 ) 4.0 2.2 2.0 ! A.2820 at -2.00e+05 ! E81 assign (resid 81 and name HG# ) (resid 81 and name HA ) 3.0 1.2 0.3 ! A.715 at -2.34e+06 assign (resid 81 and name HB# ) (resid 82 and name HB1 ) 4.0 2.2 2.0 ! A.2836 at -1.88e+05 ! D82 assign (resid 82 and name HB2 ) (resid 84 and name HB# ) 4.0 2.2 1.0 ! A.2833 at -2.69e+05 ! G83 ! E84 assign (resid 84 and name HA ) (resid 84 and name HG2 ) 3.0 1.2 0.3 ! A.2841 at -1.15e+06 assign (resid 84 and name HA ) (resid 85 and name HA ) 4.0 2.2 1.0 ! A.730 at 3.20e+05 assign (resid 84 and name HA ) (resid 85 and name HG1 ) 4.0 2.2 1.0 ! A.733 at -3.48e+05 ! Q85 assign (resid 85 and name HG2 ) (resid 85 and name HA ) 3.0 1.2 0.3 ! A.734 at -1.53e+06 assign (resid 85 and name HA ) (resid 85 and name HG1 ) 4.0 2.2 1.0 ! A.2847 at -7.74e+05 assign (resid 85 and name HB# ) (resid 86 and name HA ) 4.0 2.2 1.0 ! A.748 at 3.45e+05 assign (resid 85 and name HA ) (resid 86 and name HB2 ) 4.0 2.2 2.0 ! A.745 at 1.89e+05 assign (resid 85 and name HA ) (resid 86 and name HA ) 4.0 2.2 1.0 ! A.2846 at 2.87e+05 ! S86 assign (resid 86 and name HA ) (resid 87 and name HB1 ) 4.0 2.2 2.0 ! A.2883 at -1.89e+05 assign (resid 86 and name HA ) (resid 87 and name HB2 ) 4.0 2.2 2.0 ! A.751 at -1.76e+05 assign (resid 86 and name HB2 ) (resid 87 and name HA ) 4.0 2.2 2.0 ! A.765 at 2.43e+05 assign (resid 86 and name HB1 ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.2858 at 7.05e+05 assign (resid 86 and name HB2 ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.1516 at 9.31e+05 assign (resid 86 and name HA ) (resid 88 and name HG2# ) 4.0 2.2 1.5 ! A.752 at 2.87e+05 ! L87 assign (resid 87 and name HA ) (resid 87 and name HG ) 4.0 2.2 1.0 ! A.2194 at 6.25e+05 assign (resid 87 and name HA ) (resid 87 and name HD2# ) 4.0 2.2 1.5 ! A.2877 at 7.73e+05 assign (resid 87 and name HB1 ) (resid 87 and name HD2# ) 3.0 1.2 0.8 ! A.1946 at -3.32e+06 assign (resid 87 and name HA ) (resid 87 and name HD1# ) 3.0 1.2 0.8 ! A.994 at 4.41e+06 assign (resid 87 and name HB2 ) (resid 87 and name HD1# ) 3.0 1.2 0.8 ! A.997 at -2.64e+06 assign (resid 87 and name HB1 ) (resid 87 and name HD1# ) 3.0 1.2 0.8 ! A.999 at -1.59e+06 assign (resid 87 and name HD2# ) (resid 87 and name HB2 ) 3.0 1.2 0.8 ! A.1908 at -3.70e+06 assign (resid 87 and name HD2# ) (resid 88 and name HA ) 4.0 2.2 2.5 ! A.1953 at 1.99e+05 assign (resid 87 and name HD1# ) (resid 88 and name HB ) 4.0 2.2 2.5 ! A.2875 at -1.37e+05 assign (resid 87 and name HD1# ) (resid 88 and name HG2# ) 4.0 2.2 2.0 ! A.998 at 2.80e+05 assign (resid 87 and name HA ) (resid 88 and name HA ) 4.0 2.2 1.0 ! A.773 at 2.76e+05 assign (resid 87 and name HD1# ) (resid 88 and name HA ) 4.0 2.2 2.5 ! A.767 at 2.36e+05 assign (resid 87 and name HA ) (resid 88 and name HG2# ) 4.0 2.2 2.5 ! A.761 at 2.46e+05 assign (resid 87 and name HD2# ) (resid 89 and name HA ) 4.0 2.2 2.5 ! A.2914 at 1.94e+05 assign (resid 87 and name HD1# ) (resid 89 and name HA ) 4.0 2.2 2.5 ! A.781 at 2.13e+05 assign (resid 87 and name HG ) (resid 90 and name HB# ) 4.0 2.2 1.0 ! A.2193 at 3.74e+05 assign (resid 87 and name HD2# ) (resid 90 and name HB# ) 3.0 1.2 0.8 ! A.1936 at 3.12e+06 assign (resid 87 and name HD2# ) (resid 90 and name HA ) 4.0 2.2 1.5 ! A.1931 at 3.87e+05 assign (resid 87 and name HD1# ) (resid 90 and name HB# ) 3.0 1.2 0.8 ! A.1519 at 1.76e+06 assign (resid 87 and name HD1# ) (resid 90 and name HA ) 4.0 2.2 1.5 ! A.1005 at 8.07e+05 ! I88 assign (resid 88 and name HA ) (resid 88 and name HG11 ) 4.0 2.2 1.0 ! A.2190 at 5.59e+05 assign (resid 88 and name HG2# ) (resid 88 and name HA ) 2.5 0.7 0.7 ! A.769 at 6.19e+06 assign (resid 88 and name HG12 ) (resid 88 and name HA ) 4.0 2.2 1.0 ! A.772 at 5.66e+05 assign (resid 88 and name HD1# ) (resid 88 and name HA ) 4.0 2.2 1.5 ! A.766 at 1.02e+06 assign (resid 88 and name HD1# ) (resid 88 and name HB ) 3.0 1.2 0.8 ! A.2896 at -2.77e+06 assign (resid 88 and name HD1# ) (resid 89 and name HB1 ) 4.0 2.2 1.5 ! A.2945 at -2.66e+05 assign (resid 88 and name HD1# ) (resid 89 and name HB2 ) 4.0 2.2 1.5 ! A.1041 at -3.26e+05 ! L89 assign (resid 89 and name HA ) (resid 89 and name HG ) 3.0 1.2 0.3 ! A.1916 at 1.04e+06 assign (resid 89 and name HA ) (resid 89 and name HD2# ) 4.0 2.2 1.5 ! A.2916 at 6.09e+05 assign (resid 89 and name HB1 ) (resid 89 and name HD2# ) 3.0 1.2 0.8 ! A.2928 at -2.08e+06 assign (resid 89 and name HA ) (resid 89 and name HD1# ) 3.0 1.2 0.8 ! A.2117 at 4.62e+06 assign (resid 89 and name HG ) (resid 90 and name HA ) 4.0 2.2 1.0 ! A.792 at 4.14e+05 assign (resid 89 and name HD2# ) (resid 90 and name HA ) 4.0 2.2 1.5 ! A.791 at 3.45e+05 assign (resid 89 and name HD1# ) (resid 90 and name HA ) 4.0 2.2 1.5 ! A.2124 at 4.57e+05 assign (resid 89 and name HD2# ) (resid 91 and name HB ) 3.0 1.2 0.8 ! A.1384 at 1.08e+06 assign (resid 89 and name HD1# ) (resid 91 and name HB ) 3.0 1.2 0.8 ! A.1385 at 1.84e+06 assign (resid 89 and name HG ) (resid 91 and name HB ) 4.0 2.2 1.0 ! A.1383 at 6.37e+05 assign (resid 89 and name HG ) (resid 91 and name HG2# ) 4.0 2.2 1.5 ! A.1921 at 7.65e+05 assign (resid 89 and name HD2# ) (resid 91 and name HG2# ) 3.0 1.2 1.3 ! A.2931 at 3.08e+06 assign (resid 89 and name HD1# ) (resid 91 and name HA ) 4.0 2.2 1.5 ! A.2123 at 2.94e+05 assign (resid 89 and name HG ) (resid 91 and name HA ) 4.0 2.2 2.0 ! A.802 at 2.29e+05 assign (resid 89 and name HD2# ) (resid 91 and name HA ) 4.0 2.2 2.5 ! A.800 at 2.01e+05 ! S90 assign (resid 90 and name HA ) (resid 91 and name HB ) 4.0 2.2 1.0 ! A.1388 at 2.68e+05 assign (resid 90 and name HB# ) (resid 91 and name HA ) 4.0 2.2 1.0 ! A.2867 at 3.11e+05 ! T91 assign (resid 91 and name HA ) (resid 91 and name HG2# ) 3.0 1.2 0.8 ! A.1144 at 1.39e+06 assign (resid 91 and name HG2# ) (resid 92 and name HA ) 3.0 1.2 0.8 ! A.787 at 1.10e+06 assign (resid 91 and name HG2# ) (resid 92 and name HB1 ) 4.0 2.2 2.5 ! A.1148 at 2.47e+05 assign (resid 91 and name HA ) (resid 92 and name HB1 ) 4.0 2.2 1.0 ! A.798 at 5.60e+05 assign (resid 91 and name HA ) (resid 92 and name HA ) 4.0 2.2 1.0 ! A.487 at 5.45e+05 assign (resid 91 and name HG2# ) (resid 93 and name HB# ) 4.0 2.2 1.5 ! A.2982 at 3.43e+05 assign (resid 91 and name HG2# ) (resid 93 and name HG2 ) 4.0 2.2 1.5 ! A.1156 at -3.68e+05 ! S92 assign (resid 92 and name HB2 ) (resid 93 and name HA ) 4.0 2.2 1.0 ! A.811 at 2.68e+05 assign (resid 92 and name HB2 ) (resid 94 and name HG2# ) 4.0 2.2 2.5 ! A.1118 at 2.45e+05 ! Q93 assign (resid 93 and name HG2 ) (resid 93 and name HA ) 3.0 1.2 0.3 ! A.807 at -1.23e+06 assign (resid 93 and name HA ) (resid 93 and name HG1 ) 4.0 2.2 1.0 ! A.2975 at -3.83e+05 assign (resid 93 and name HA ) (resid 94 and name HB ) 4.0 2.2 1.0 ! A.1371 at 3.47e+05 assign (resid 93 and name HA ) (resid 94 and name HG2# ) 4.0 2.2 1.5 ! A.1115 at 4.47e+05 assign (resid 93 and name HA ) (resid 94 and name HA ) 4.0 2.2 1.0 ! A.2993 at 3.08e+05 ! T94 assign (resid 94 and name HA ) (resid 94 and name HG2# ) 3.0 1.2 0.8 ! A.1114 at 3.43e+06 assign (resid 94 and name HA ) (resid 95 and name HG2# ) 4.0 2.2 1.5 ! A.1161 at 3.30e+05 assign (resid 94 and name HA ) (resid 95 and name HA ) 4.0 2.2 2.0 ! A.2994 at 2.49e+05 ! T95 assign (resid 95 and name HA ) (resid 95 and name HG2# ) 3.0 1.2 0.8 ! A.1160 at 4.10e+06 !@ END_XPLR_NOE_FILE !