Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
10714 | 1q6a RC | 5824 | cing | 1-original | 8 | XPLOR/CNS | distance | NOE | simple |
! pck2xplr.nawk Table; Input File: n15_unambig.PCK ! Date: Wed Aug 6 07:54:06 CDT 2003 ! Path: /home/vakon/NMR_data/KaiA/Th180C/Structure/analysis/noe ! !@ BEGIN_XPLR_PCK_SUM ! LBL File-Name All Intra Seq. Short Long ! A n15_unambig.PCK 591 189 247 124 31 ! Total 591 189 247 124 31 !@ END_XPLR_PCK_SUM !@ BEGIN_XPLR_NOE_FILE ! SEGID a ! ! A1 ! M2 ! A3 ! R4 ! M5 ! S6 ! P7 ! A8 assign (resid 8 and name HA ) (resid 11 and name HN ) 4.0 2.2 2.0 ! A.467 at 2.18e+07 ! D9 ! K10 assign (resid 10 and name HG# ) (resid 11 and name HN ) 4.0 2.2 2.5 ! A.464 at 1.80e+07 assign (resid 10 and name HA ) (resid 13 and name HN ) 4.0 2.2 1.0 ! A.535 at 5.84e+07 ! R11 assign (resid 11 and name HG# ) (resid 11 and name HN ) 4.0 2.2 1.5 ! A.463 at 5.17e+07 assign (resid 11 and name HB# ) (resid 11 and name HN ) 2.5 0.7 0.9 ! A.462 at 1.83e+08 assign (resid 11 and name HD# ) (resid 11 and name HN ) 4.0 2.2 2.5 ! A.465 at 1.75e+07 ! K12 assign (resid 12 and name HB# ) (resid 12 and name HN ) 3.0 1.2 1.0 ! A.630 at 1.07e+08 assign (resid 12 and name HB# ) (resid 13 and name HN ) 3.0 1.2 1.0 ! A.541 at 1.52e+08 assign (resid 12 and name HG2 ) (resid 13 and name HN ) 4.0 2.2 1.0 ! A.544 at 2.58e+07 assign (resid 12 and name HN ) (resid 13 and name HD* ) 4.0 2.2 1.5 ! A.625 at 3.27e+07 assign (resid 12 and name HA ) (resid 14 and name HN ) 4.0 2.2 2.0 ! A.422 at 2.13e+07 ! L13 assign (resid 13 and name HG ) (resid 13 and name HN ) 2.5 0.7 0.4 ! A.543 at 2.27e+08 assign (resid 13 and name HD* ) (resid 13 and name HN ) 4.0 2.2 1.5 ! A.545 at 5.18e+07 assign (resid 13 and name HB2 ) (resid 13 and name HN ) 3.0 1.2 0.5 ! A.542 at 1.91e+08 (widened1) assign (resid 13 and name HN ) (resid 14 and name HN ) 3.0 1.2 0.5 ! A.537 at 9.32e+07 assign (resid 13 and name HA ) (resid 14 and name HN ) 4.0 2.2 1.0 ! A.421 at 3.24e+07 assign (resid 13 and name HD* ) (resid 49 and name HN ) 4.0 2.2 2.5 ! A.643 at 1.71e+07 ! L14 assign (resid 14 and name HD2# ) (resid 14 and name HN ) 3.0 1.2 1.0 ! A.419 at 8.32e+07 assign (resid 14 and name HG ) (resid 14 and name HN ) 2.5 0.7 0.4 ! A.420 at 2.28e+08 assign (resid 14 and name HB1 ) (resid 14 and name HN ) 3.0 1.2 0.5 ! A.427 at 1.12e+08 assign (resid 14 and name HN ) (resid 15 and name HB2 ) 4.0 2.2 2.0 ! A.425 at 1.92e+07 assign (resid 14 and name HN ) (resid 15 and name HN ) 3.0 1.2 0.5 ! A.424 at 1.04e+08 assign (resid 14 and name HA ) (resid 16 and name HN ) 4.0 2.2 1.0 ! A.362 at 2.59e+07 assign (resid 14 and name HN ) (resid 16 and name HN ) 4.0 2.2 1.0 ! A.371 at 3.03e+07 assign (resid 14 and name HA ) (resid 17 and name HN ) 4.0 2.2 1.0 ! A.111 at 4.59e+07 assign (resid 14 and name HD1# ) (resid 55 and name HE22 ) 4.0 2.2 1.5 ! A.243 at -2.38e+07 assign (resid 14 and name HD1# ) (resid 55 and name HE21 ) 4.0 2.2 1.5 ! A.241 at -2.31e+07 ! D15 assign (resid 15 and name HB2 ) (resid 15 and name HN ) 2.5 0.7 0.4 ! A.473 at 1.95e+08 assign (resid 15 and name HB1 ) (resid 16 and name HN ) 3.0 1.2 0.5 ! A.364 at 1.06e+08 assign (resid 15 and name HB2 ) (resid 16 and name HN ) 3.0 1.2 0.5 ! A.363 at 1.16e+08 assign (resid 15 and name HA ) (resid 17 and name HN ) 4.0 2.2 2.0 ! A.109 at 1.79e+07 ! E16 assign (resid 16 and name HB# ) (resid 16 and name HN ) 2.5 0.7 0.9 ! A.366 at 2.95e+08 assign (resid 16 and name HG# ) (resid 16 and name HN ) 3.0 1.2 1.0 ! A.365 at 1.01e+08 assign (resid 16 and name HN ) (resid 17 and name HG ) 4.0 2.2 1.0 ! A.367 at 4.96e+07 assign (resid 16 and name HN ) (resid 17 and name HN ) 3.0 1.2 0.5 ! A.370 at 1.53e+08 assign (resid 16 and name HB# ) (resid 17 and name HN ) 3.0 1.2 1.0 ! A.113 at 8.83e+07 assign (resid 16 and name HN ) (resid 18 and name HN ) 4.0 2.2 1.0 ! A.369 at 3.50e+07 assign (resid 16 and name HN ) (resid 20 and name HD1# ) 4.0 2.2 1.5 ! A.368 at 3.45e+07 ! L17 assign (resid 17 and name HB2 ) (resid 17 and name HN ) 3.0 1.2 0.5 ! A.114 at 1.03e+08 assign (resid 17 and name HB1 ) (resid 17 and name HN ) 4.0 2.2 1.0 ! A.116 at 6.38e+07 assign (resid 17 and name HG ) (resid 17 and name HN ) 3.0 1.2 0.5 ! A.115 at 1.49e+08 assign (resid 17 and name HD1# ) (resid 17 and name HN ) 4.0 2.2 1.5 ! A.118 at 5.43e+07 assign (resid 17 and name HN ) (resid 18 and name HN ) 3.0 1.2 0.5 ! A.326 at 1.47e+08 assign (resid 17 and name HB1 ) (resid 18 and name HN ) 4.0 2.2 1.0 ! A.318 at 4.47e+07 assign (resid 17 and name HD1# ) (resid 18 and name HN ) 4.0 2.2 1.5 ! A.328 at 2.46e+07 assign (resid 17 and name HN ) (resid 20 and name HD1# ) 4.0 2.2 1.5 ! A.117 at 3.75e+07 assign (resid 17 and name HD1# ) (resid 46 and name HN ) 4.0 2.2 1.5 ! A.126 at 2.93e+07 ! R18 assign (resid 18 and name HB# ) (resid 18 and name HN ) 2.5 0.7 0.9 ! A.317 at 2.83e+08 assign (resid 18 and name HD# ) (resid 18 and name HN ) 4.0 2.2 1.5 ! A.316 at 2.90e+07 assign (resid 18 and name HG# ) (resid 18 and name HN ) 3.0 1.2 1.0 ! A.320 at 8.38e+07 assign (resid 18 and name HN ) (resid 19 and name HN ) 3.0 1.2 0.5 ! A.325 at 1.05e+08 assign (resid 18 and name HB# ) (resid 19 and name HN ) 3.0 1.2 1.0 ! A.837 at 1.67e+08 assign (resid 18 and name HG# ) (resid 19 and name HN ) 4.0 2.2 2.5 ! A.838 at 2.05e+07 assign (resid 18 and name HA ) (resid 22 and name HN ) 4.0 2.2 1.0 ! A.789 at 4.44e+07 ! S19 assign (resid 19 and name HB# ) (resid 19 and name HN ) 2.5 0.7 0.9 ! A.835 at 4.06e+08 assign (resid 19 and name HA ) (resid 20 and name HN ) 4.0 2.2 1.0 ! A.143 at 5.40e+07 assign (resid 19 and name HN ) (resid 20 and name HN ) 3.0 1.2 0.5 ! A.150 at 9.89e+07 assign (resid 19 and name HB# ) (resid 20 and name HN ) 3.0 1.2 1.0 ! A.142 at 1.78e+08 assign (resid 19 and name HA ) (resid 21 and name HN ) 4.0 2.2 2.0 ! A.21 at 1.56e+07 assign (resid 19 and name HA ) (resid 22 and name HN ) 4.0 2.2 1.0 ! A.786 at 6.40e+07 ! I20 assign (resid 20 and name HD1# ) (resid 20 and name HN ) 3.0 1.2 1.0 ! A.147 at 9.86e+07 assign (resid 20 and name HG12 ) (resid 20 and name HN ) 3.0 1.2 0.5 ! A.146 at 1.37e+08 assign (resid 20 and name HN ) (resid 21 and name HN ) 3.0 1.2 0.5 ! A.148 at 8.62e+07 assign (resid 20 and name HG2# ) (resid 21 and name HN ) 4.0 2.2 1.5 ! A.17 at 4.89e+07 assign (resid 20 and name HB ) (resid 21 and name HN ) 3.0 1.2 0.5 ! A.15 at 1.28e+08 assign (resid 20 and name HA ) (resid 21 and name HN ) 4.0 2.2 1.0 ! A.19 at 3.50e+07 assign (resid 20 and name HN ) (resid 22 and name HN ) 4.0 2.2 2.0 ! A.790 at 1.96e+07 assign (resid 20 and name HN ) (resid 42 and name HD# ) 4.0 2.2 1.0 ! A.149 at 2.86e+07 assign (resid 20 and name HD1# ) (resid 42 and name HN ) 4.0 2.2 2.5 ! A.342 at 2.21e+07 assign (resid 20 and name HG2# ) (resid 42 and name HN ) 3.0 1.2 1.0 ! A.339 at 1.01e+08 ! Y21 assign (resid 21 and name HD# ) (resid 21 and name HN ) 4.0 2.2 1.0 ! A.23 at 3.72e+07 assign (resid 21 and name HB2 ) (resid 21 and name HN ) 3.0 1.2 0.5 ! A.14 at 1.36e+08 assign (resid 21 and name HB1 ) (resid 21 and name HN ) 3.0 1.2 0.5 ! A.13 at 1.18e+08 assign (resid 21 and name HN ) (resid 22 and name HN ) 3.0 1.2 0.5 ! A.26 at 9.29e+07 assign (resid 21 and name HD1 ) (resid 22 and name HN ) 4.0 2.2 1.0 ! A.787 at 2.53e+07 assign (resid 21 and name HB2 ) (resid 22 and name HN ) 3.0 1.2 0.5 ! A.784 at 7.66e+07 assign (resid 21 and name HB1 ) (resid 22 and name HN ) 3.0 1.2 0.5 ! A.783 at 7.72e+07 assign (resid 21 and name HA ) (resid 24 and name HN ) 3.0 1.2 0.5 ! A.497 at 7.87e+07 assign (resid 21 and name HN ) (resid 42 and name HD# ) 4.0 2.2 1.0 ! A.24 at 5.19e+07 assign (resid 21 and name HN ) (resid 42 and name HE# ) 4.0 2.2 1.0 ! A.25 at 6.13e+07 assign (resid 21 and name HE# ) (resid 60 and name HN ) 4.0 2.2 2.0 ! A.680 at 2.03e+07 assign (resid 21 and name HN ) (resid 63 and name HD2# ) 4.0 2.2 1.5 ! A.80 at 6.30e+07 ! R22 assign (resid 22 and name HB2 ) (resid 22 and name HN ) 2.5 0.7 0.4 ! A.779 at 2.09e+08 assign (resid 22 and name HG2 ) (resid 22 and name HN ) 4.0 2.2 1.0 ! A.780 at 7.13e+07 (widened1) assign (resid 22 and name HB1 ) (resid 22 and name HN ) 2.5 0.7 0.4 ! A.778 at 2.18e+08 assign (resid 22 and name HN ) (resid 23 and name HN ) 3.0 1.2 0.5 ! A.788 at 9.30e+07 assign (resid 22 and name HD# ) (resid 23 and name HN ) 4.0 2.2 1.5 ! A.223 at 3.98e+07 assign (resid 22 and name HB1 ) (resid 23 and name HN ) 3.0 1.2 0.5 ! A.214 at 1.44e+08 assign (resid 22 and name HB2 ) (resid 23 and name HN ) 4.0 2.2 1.0 ! A.215 at 1.07e+08 (widened1) assign (resid 22 and name HA ) (resid 23 and name HN ) 3.0 1.2 0.5 ! A.209 at 7.77e+07 assign (resid 22 and name HB1 ) (resid 24 and name HN ) 4.0 2.2 1.0 ! A.500 at 2.35e+07 assign (resid 22 and name HA ) (resid 26 and name HN ) 4.0 2.2 1.0 ! A.706 at 2.75e+07 ! T23 assign (resid 23 and name HG2# ) (resid 23 and name HN ) 3.0 1.2 1.0 ! A.218 at 1.14e+08 assign (resid 23 and name HB ) (resid 23 and name HN ) 2.5 0.7 0.4 ! A.207 at 2.59e+08 assign (resid 23 and name HN ) (resid 24 and name HN ) 3.0 1.2 0.5 ! A.509 at 9.70e+07 assign (resid 23 and name HG2# ) (resid 24 and name HN ) 3.0 1.2 1.0 ! A.503 at 6.59e+07 assign (resid 23 and name HA ) (resid 24 and name HN ) 4.0 2.2 1.0 ! A.498 at 6.14e+07 assign (resid 23 and name HB ) (resid 24 and name HN ) 3.0 1.2 0.5 ! A.499 at 9.09e+07 assign (resid 23 and name HN ) (resid 24 and name HG11 ) 4.0 2.2 1.0 ! A.216 at 3.38e+07 assign (resid 23 and name HN ) (resid 24 and name HG12 ) 4.0 2.2 1.0 ! A.219 at 2.76e+07 assign (resid 23 and name HA ) (resid 26 and name HN ) 3.0 1.2 0.5 ! A.705 at 6.89e+07 assign (resid 23 and name HG2# ) (resid 26 and name HN ) 4.0 2.2 2.5 ! A.711 at 1.79e+07 assign (resid 23 and name HG2# ) (resid 27 and name HN ) 4.0 2.2 1.5 ! A.793 at 2.37e+07 assign (resid 23 and name HA ) (resid 27 and name HN ) 4.0 2.2 1.0 ! A.798 at 3.23e+07 ! I24 assign (resid 24 and name HG11 ) (resid 24 and name HN ) 3.0 1.2 0.5 ! A.501 at 1.64e+08 assign (resid 24 and name HB ) (resid 24 and name HN ) 3.0 1.2 0.5 ! A.502 at 1.72e+08 assign (resid 24 and name HG12 ) (resid 24 and name HN ) 3.0 1.2 0.5 ! A.505 at 1.68e+08 assign (resid 24 and name HG2# ) (resid 24 and name HN ) 3.0 1.2 1.0 ! A.506 at 9.17e+07 assign (resid 24 and name HN ) (resid 25 and name HN ) 3.0 1.2 0.5 ! A.510 at 9.51e+07 assign (resid 24 and name HG12 ) (resid 25 and name HN ) 3.0 1.2 0.5 ! A.746 at 9.09e+07 assign (resid 24 and name HB ) (resid 25 and name HN ) 3.0 1.2 0.5 ! A.744 at 1.63e+08 assign (resid 24 and name HG2# ) (resid 28 and name HN ) 4.0 2.2 2.5 ! A.521 at 1.83e+07 ! V25 assign (resid 25 and name HG2# ) (resid 25 and name HN ) 2.5 0.7 0.9 ! A.747 at 2.99e+08 assign (resid 25 and name HB ) (resid 25 and name HN ) 2.5 0.7 0.4 ! A.743 at 3.12e+08 assign (resid 25 and name HG1# ) (resid 25 and name HN ) 3.0 1.2 1.0 ! A.749 at 1.00e+08 assign (resid 25 and name HA ) (resid 26 and name HN ) 4.0 2.2 1.0 ! A.707 at 5.96e+07 assign (resid 25 and name HG1# ) (resid 26 and name HN ) 3.0 1.2 1.0 ! A.702 at 8.50e+07 assign (resid 25 and name HG2# ) (resid 26 and name HN ) 3.0 1.2 1.0 ! A.710 at 6.89e+07 assign (resid 25 and name HN ) (resid 63 and name HD2# ) 4.0 2.2 1.5 ! A.745 at 6.12e+07 ! L26 assign (resid 26 and name HB1 ) (resid 26 and name HN ) 3.0 1.2 0.5 ! A.708 at 1.59e+08 assign (resid 26 and name HB1 ) (resid 27 and name HN ) 4.0 2.2 1.0 ! A.801 at 6.32e+07 assign (resid 26 and name HA ) (resid 27 and name HN ) 4.0 2.2 1.0 ! A.799 at 6.08e+07 assign (resid 26 and name HN ) (resid 28 and name HN ) 3.0 1.2 0.5 ! A.515 at 8.58e+07 assign (resid 26 and name HN ) (resid 67 and name HZ ) 4.0 2.2 2.0 ! A.712 at 1.42e+07 ! E27 assign (resid 27 and name HB2 ) (resid 27 and name HN ) 2.5 0.7 0.4 ! A.794 at 2.39e+08 assign (resid 27 and name HG1 ) (resid 27 and name HN ) 3.0 1.2 0.5 ! A.795 at 1.15e+08 assign (resid 27 and name HB1 ) (resid 27 and name HN ) 3.0 1.2 0.5 ! A.803 at 1.10e+08 assign (resid 27 and name HB2 ) (resid 28 and name HN ) 4.0 2.2 1.0 ! A.518 at 3.70e+07 assign (resid 27 and name HA ) (resid 28 and name HN ) 4.0 2.2 1.0 ! A.513 at 5.35e+07 assign (resid 27 and name HN ) (resid 28 and name HB2 ) 4.0 2.2 1.0 ! A.797 at 3.60e+07 assign (resid 27 and name HN ) (resid 35 and name HG1# ) 4.0 2.2 2.5 ! A.792 at 1.93e+07 ! Y28 assign (resid 28 and name HD# ) (resid 28 and name HN ) 4.0 2.2 1.0 ! A.514 at 6.89e+07 (widened) assign (resid 28 and name HB1 ) (resid 28 and name HN ) 3.0 1.2 0.5 ! A.517 at 1.60e+08 assign (resid 28 and name HB2 ) (resid 28 and name HN ) 2.5 0.7 0.4 ! A.511 at 1.99e+08 assign (resid 28 and name HN ) (resid 29 and name HN ) 4.0 2.2 1.0 ! A.180 at -6.15e+07 assign (resid 28 and name HD# ) (resid 29 and name HN ) 4.0 2.2 1.0 ! A.178 at -4.60e+07 assign (resid 28 and name HB1 ) (resid 29 and name HN ) 3.0 1.2 0.5 ! A.174 at -7.28e+07 assign (resid 28 and name HA ) (resid 30 and name HN ) 4.0 2.2 1.0 ! A.667 at 2.73e+07 assign (resid 28 and name HN ) (resid 35 and name HG2# ) 4.0 2.2 2.5 ! A.520 at 2.11e+07 assign (resid 28 and name HN ) (resid 35 and name HG1# ) 4.0 2.2 1.5 ! A.519 at 3.19e+07 ! F29 assign (resid 29 and name HB2 ) (resid 29 and name HN ) 3.0 1.2 0.5 ! A.175 at -1.34e+08 assign (resid 29 and name HD# ) (resid 29 and name HN ) 3.0 1.2 0.5 ! A.179 at -9.01e+07 assign (resid 29 and name HN ) (resid 30 and name HN ) 3.0 1.2 0.5 ! A.181 at -9.27e+07 assign (resid 29 and name HB1 ) (resid 30 and name HN ) 4.0 2.2 1.0 ! A.668 at 3.02e+07 assign (resid 29 and name HA ) (resid 30 and name HN ) 3.0 1.2 0.5 ! A.665 at 6.79e+07 ! N30 assign (resid 30 and name HB1 ) (resid 30 and name HD21 ) 4.0 2.2 1.0 ! A.251 at -2.91e+07 assign (resid 30 and name HB1 ) (resid 30 and name HD22 ) 4.0 2.2 1.0 ! A.244 at -3.74e+07 assign (resid 30 and name HB2 ) (resid 30 and name HD22 ) 4.0 2.2 1.0 ! A.245 at -3.99e+07 assign (resid 30 and name HB2 ) (resid 30 and name HD21 ) 4.0 2.2 1.0 ! A.250 at -4.48e+07 assign (resid 30 and name HB2 ) (resid 30 and name HN ) 3.0 1.2 0.5 ! A.656 at 1.58e+08 assign (resid 30 and name HB1 ) (resid 30 and name HN ) 3.0 1.2 0.5 ! A.657 at 1.31e+08 assign (resid 30 and name HD21 ) (resid 33 and name HB# ) 4.0 2.2 2.5 ! A.249 at -2.17e+07 assign (resid 30 and name HD22 ) (resid 33 and name HB# ) 4.0 2.2 2.5 ! A.246 at -2.08e+07 ! T31 ! D32 assign (resid 32 and name HB2 ) (resid 32 and name HN ) 4.0 2.2 2.0 ! A.418 at 1.83e+07 ! A33 assign (resid 33 and name HB# ) (resid 33 and name HN ) 3.0 1.2 1.0 ! A.841 at 1.45e+08 assign (resid 32 and name HA ) (resid 33 and name HN ) 3.0 1.2 0.5 ! A.842 at 4.74e+07 assign (resid 32 and name HB2 ) (resid 33 and name HN ) 4.0 2.2 2.0 ! A.843 at 1.80e+07 assign (resid 32 and name HB1 ) (resid 33 and name HN ) 4.0 2.2 2.0 ! A.844 at 1.67e+07 ! K34 assign (resid 34 and name HG1 ) (resid 35 and name HN ) 4.0 2.2 1.0 ! A.660 at 6.07e+07 ! V35 assign (resid 35 and name HB ) (resid 35 and name HN ) 3.0 1.2 0.5 ! A.669 at 7.64e+07 assign (resid 35 and name HG1# ) (resid 35 and name HN ) 4.0 2.2 1.5 ! A.659 at 4.45e+07 assign (resid 35 and name HG2# ) (resid 35 and name HN ) 3.0 1.2 1.0 ! A.658 at 6.51e+07 assign (resid 35 and name HG1# ) (resid 38 and name HN ) 4.0 2.2 2.5 ! A.314 at 1.82e+07 assign (resid 35 and name HA ) (resid 38 and name HN ) 3.0 1.2 0.5 ! A.304 at 7.74e+07 assign (resid 35 and name HA ) (resid 39 and name HN ) 4.0 2.2 1.0 ! A.409 at 2.87e+07 ! N36 assign (resid 36 and name HA ) (resid 39 and name HN ) 4.0 2.2 1.0 ! A.406 at 6.34e+07 ! E37 assign (resid 37 and name HB# ) (resid 37 and name HN ) 4.0 2.2 1.5 ! A.468 at 4.17e+07 assign (resid 37 and name HG# ) (resid 37 and name HN ) 4.0 2.2 1.5 ! A.469 at 2.57e+07 assign (resid 37 and name HG# ) (resid 38 and name HN ) 4.0 2.2 1.5 ! A.309 at 5.21e+07 assign (resid 37 and name HA ) (resid 38 and name HN ) 3.0 1.2 0.5 ! A.303 at 6.68e+07 assign (resid 37 and name HN ) (resid 38 and name HN ) 3.0 1.2 0.5 ! A.301 at 6.44e+07 ! R38 assign (resid 38 and name HD2 ) (resid 38 and name HN ) 4.0 2.2 2.0 ! A.307 at 1.73e+07 assign (resid 38 and name HD1 ) (resid 38 and name HN ) 4.0 2.2 2.0 ! A.306 at 1.73e+07 assign (resid 38 and name HG# ) (resid 38 and name HN ) 2.5 0.7 0.4 ! A.311 at 2.96e+08 (renamed) assign (resid 38 and name HB2 ) (resid 38 and name HN ) 2.5 0.7 0.4 ! A.310 at 2.51e+08 assign (resid 38 and name HA ) (resid 39 and name HN ) 4.0 2.2 1.0 ! A.407 at 3.20e+07 assign (resid 38 and name HB2 ) (resid 39 and name HN ) 3.0 1.2 0.5 ! A.416 at 8.55e+07 assign (resid 38 and name HN ) (resid 39 and name HN ) 3.0 1.2 0.5 ! A.410 at 1.18e+08 assign (resid 38 and name HN ) (resid 39 and name HA ) 4.0 2.2 2.0 ! A.305 at 1.81e+07 assign (resid 38 and name HN ) (resid 40 and name HN ) 4.0 2.2 1.0 ! A.482 at 2.98e+07 assign (resid 38 and name HN ) (resid 41 and name HN ) 4.0 2.2 1.0 ! A.300 at 4.36e+07 assign (resid 38 and name HA ) (resid 42 and name HN ) 4.0 2.2 1.0 ! A.331 at 3.13e+07 ! I39 assign (resid 39 and name HB ) (resid 39 and name HN ) 2.5 0.7 0.4 ! A.415 at 3.42e+08 assign (resid 39 and name HN ) (resid 40 and name HN ) 3.0 1.2 0.5 ! A.412 at 1.24e+08 assign (resid 39 and name HN ) (resid 40 and name HB1 ) 4.0 2.2 2.0 ! A.405 at 1.74e+07 assign (resid 39 and name HG2# ) (resid 40 and name HN ) 3.0 1.2 1.0 ! A.478 at 1.03e+08 assign (resid 39 and name HA ) (resid 40 and name HN ) 4.0 2.2 1.0 ! A.470 at 4.95e+07 assign (resid 39 and name HB ) (resid 40 and name HN ) 2.5 0.7 0.4 ! A.476 at 2.42e+08 assign (resid 39 and name HN ) (resid 41 and name HN ) 4.0 2.2 1.0 ! A.594 at 6.12e+07 ! D40 assign (resid 40 and name HB1 ) (resid 40 and name HN ) 2.5 0.7 0.4 ! A.472 at 4.73e+08 assign (resid 40 and name HB1 ) (resid 41 and name HN ) 3.0 1.2 0.5 ! A.585 at 1.62e+08 assign (resid 40 and name HN ) (resid 41 and name HN ) 2.5 0.7 0.4 ! A.595 at 2.10e+08 assign (resid 40 and name HN ) (resid 41 and name HB2 ) 4.0 2.2 1.0 ! A.474 at 5.83e+07 assign (resid 40 and name HN ) (resid 42 and name HN ) 4.0 2.2 1.0 ! A.337 at 2.67e+07 assign (resid 40 and name HA ) (resid 43 and name HN ) 4.0 2.2 1.0 ! A.51 at 5.10e+07 assign (resid 40 and name HA ) (resid 44 and name HN ) 4.0 2.2 1.0 ! A.185 at 4.50e+07 ! E41 assign (resid 41 and name HB2 ) (resid 41 and name HN ) 2.5 0.7 0.4 ! A.583 at 4.47e+08 assign (resid 41 and name HN ) (resid 42 and name HN ) 2.5 0.7 0.4 ! A.593 at 1.86e+08 assign (resid 41 and name HN ) (resid 42 and name HB1 ) 4.0 2.2 1.0 ! A.586 at 2.92e+07 assign (resid 41 and name HB2 ) (resid 42 and name HN ) 3.0 1.2 0.5 ! A.336 at 1.67e+08 assign (resid 41 and name HA ) (resid 42 and name HN ) 3.0 1.2 0.5 ! A.332 at 7.08e+07 assign (resid 41 and name HB2 ) (resid 45 and name HN ) 4.0 2.2 2.0 ! A.556 at 1.98e+07 ! F42 assign (resid 42 and name HB2 ) (resid 42 and name HN ) 3.0 1.2 0.5 ! A.335 at 1.63e+08 assign (resid 42 and name HB1 ) (resid 42 and name HN ) 3.0 1.2 0.5 ! A.334 at 1.60e+08 assign (resid 42 and name HD# ) (resid 42 and name HN ) 4.0 2.2 1.0 ! A.330 at 6.53e+07 (widened) assign (resid 42 and name HN ) (resid 43 and name HN ) 3.0 1.2 0.5 ! A.340 at 1.26e+08 assign (resid 42 and name HB2 ) (resid 43 and name HN ) 3.0 1.2 0.5 ! A.49 at 8.09e+07 assign (resid 42 and name HA ) (resid 43 and name HN ) 4.0 2.2 1.0 ! A.50 at 4.63e+07 assign (resid 42 and name HD# ) (resid 43 and name HN ) 4.0 2.2 1.0 ! A.52 at 5.78e+07 assign (resid 42 and name HN ) (resid 44 and name HN ) 3.0 1.2 0.5 ! A.194 at 9.59e+07 assign (resid 42 and name HA ) (resid 45 and name HN ) 4.0 2.2 1.0 ! A.559 at 3.30e+07 assign (resid 42 and name HN ) (resid 45 and name HB2 ) 4.0 2.2 2.0 ! A.343 at 1.63e+07 ! V43 assign (resid 43 and name HG1# ) (resid 43 and name HN ) 3.0 1.2 1.0 ! A.46 at 1.44e+08 assign (resid 43 and name HG2# ) (resid 43 and name HN ) 2.5 0.7 0.9 ! A.47 at 1.96e+08 assign (resid 43 and name HB ) (resid 43 and name HN ) 3.0 1.2 0.5 ! A.48 at 1.70e+08 assign (resid 43 and name HN ) (resid 44 and name HN ) 3.0 1.2 0.5 ! A.53 at 1.04e+08 assign (resid 43 and name HG1# ) (resid 44 and name HN ) 3.0 1.2 1.0 ! A.191 at 8.07e+07 assign (resid 43 and name HB ) (resid 44 and name HN ) 3.0 1.2 0.5 ! A.187 at 1.19e+08 assign (resid 43 and name HA ) (resid 44 and name HN ) 4.0 2.2 1.0 ! A.182 at 4.91e+07 assign (resid 43 and name HG2# ) (resid 44 and name HN ) 3.0 1.2 1.0 ! A.190 at 9.90e+07 assign (resid 43 and name HA ) (resid 45 and name HN ) 4.0 2.2 2.0 ! A.558 at 1.54e+07 assign (resid 43 and name HA ) (resid 46 and name HN ) 4.0 2.2 1.0 ! A.121 at 5.29e+07 assign (resid 43 and name HA ) (resid 47 and name HN ) 4.0 2.2 2.0 ! A.71 at 1.74e+07 assign (resid 43 and name HG2# ) (resid 95 and name HN ) 4.0 2.2 1.5 ! A.153 at 5.32e+07 assign (resid 43 and name HG1# ) (resid 95 and name HN ) 3.0 1.2 1.0 ! A.154 at 8.00e+07 ! S44 assign (resid 44 and name HN ) (resid 45 and name HN ) 3.0 1.2 0.5 ! A.561 at 1.34e+08 assign (resid 44 and name HN ) (resid 45 and name HB2 ) 4.0 2.2 2.0 ! A.189 at 2.00e+07 assign (resid 44 and name HN ) (resid 45 and name HG1 ) 4.0 2.2 1.0 ! A.188 at 2.38e+07 (renamed) assign (resid 44 and name HN ) (resid 46 and name HN ) 4.0 2.2 2.0 ! A.129 at 1.68e+07 ! K45 assign (resid 45 and name HE# ) (resid 45 and name HN ) 4.0 2.2 2.5 ! A.557 at 1.89e+07 assign (resid 45 and name HB2 ) (resid 45 and name HN ) 2.5 0.7 0.4 ! A.552 at 1.95e+08 assign (resid 45 and name HG2 ) (resid 45 and name HN ) 3.0 1.2 0.5 ! A.554 at 1.03e+08 assign (resid 45 and name HG1 ) (resid 45 and name HN ) 2.5 0.7 0.4 ! A.553 at 2.36e+08 assign (resid 45 and name HB1 ) (resid 46 and name HN ) 3.0 1.2 0.5 ! A.123 at 8.33e+07 assign (resid 45 and name HA ) (resid 46 and name HN ) 4.0 2.2 1.0 ! A.119 at 6.14e+07 assign (resid 45 and name HB2 ) (resid 46 and name HN ) 3.0 1.2 0.5 ! A.122 at 8.45e+07 assign (resid 45 and name HN ) (resid 46 and name HN ) 3.0 1.2 0.5 ! A.128 at 1.31e+08 assign (resid 45 and name HG2 ) (resid 46 and name HN ) 4.0 2.2 1.0 ! A.124 at 4.18e+07 assign (resid 45 and name HN ) (resid 46 and name HB# ) 4.0 2.2 1.5 ! A.555 at 4.21e+07 assign (resid 45 and name HN ) (resid 47 and name HN ) 4.0 2.2 2.0 ! A.76 at 1.43e+07 ! A46 assign (resid 46 and name HB# ) (resid 46 and name HN ) 2.5 0.7 0.9 ! A.125 at 2.83e+08 assign (resid 46 and name HB# ) (resid 47 and name HN ) 3.0 1.2 1.0 ! A.74 at 1.20e+08 assign (resid 46 and name HA ) (resid 47 and name HN ) 4.0 2.2 1.0 ! A.70 at 2.95e+07 assign (resid 46 and name HA ) (resid 49 and name HN ) 4.0 2.2 1.0 ! A.637 at 2.62e+07 assign (resid 46 and name HA ) (resid 51 and name HN ) 4.0 2.2 2.0 ! A.234 at 1.83e+07 assign (resid 46 and name HB# ) (resid 51 and name HN ) 4.0 2.2 1.5 ! A.238 at 3.47e+07 assign (resid 46 and name HN ) (resid 95 and name HD1# ) 4.0 2.2 1.5 ! A.127 at 3.75e+07 ! F47 assign (resid 47 and name HB# ) (resid 47 and name HN ) 3.0 1.2 1.0 ! A.73 at 1.59e+08 assign (resid 47 and name HD# ) (resid 47 and name HN ) 4.0 2.2 1.0 ! A.67 at 3.00e+07 assign (resid 47 and name HD# ) (resid 48 and name HN ) 4.0 2.2 1.0 ! A.444 at 2.63e+07 assign (resid 47 and name HB# ) (resid 48 and name HN ) 3.0 1.2 1.0 ! A.442 at 6.51e+07 assign (resid 47 and name HN ) (resid 48 and name HN ) 3.0 1.2 0.5 ! A.449 at 7.17e+07 assign (resid 47 and name HN ) (resid 48 and name HB# ) 4.0 2.2 1.5 ! A.72 at 2.78e+07 assign (resid 47 and name HN ) (resid 49 and name HN ) 4.0 2.2 2.0 ! A.642 at 2.25e+07 assign (resid 47 and name HN ) (resid 95 and name HD1# ) 4.0 2.2 1.5 ! A.75 at 5.86e+07 ! F48 assign (resid 48 and name HD# ) (resid 48 and name HN ) 4.0 2.2 2.0 ! A.445 at 1.83e+07 assign (resid 48 and name HB# ) (resid 48 and name HN ) 2.5 0.7 0.9 ! A.441 at 2.18e+08 assign (resid 48 and name HN ) (resid 49 and name HN ) 3.0 1.2 0.5 ! A.448 at 8.90e+07 assign (resid 48 and name HB# ) (resid 49 and name HN ) 3.0 1.2 1.0 ! A.636 at 1.05e+08 assign (resid 48 and name HN ) (resid 50 and name HN ) 4.0 2.2 1.0 ! A.696 at 2.87e+07 ! A49 assign (resid 49 and name HB# ) (resid 49 and name HN ) 2.5 0.7 0.9 ! A.635 at 2.56e+08 assign (resid 49 and name HN ) (resid 50 and name HA ) 4.0 2.2 2.0 ! A.639 at 1.92e+07 assign (resid 49 and name HN ) (resid 50 and name HN ) 3.0 1.2 0.5 ! A.640 at 8.92e+07 assign (resid 49 and name HN ) (resid 51 and name HN ) 4.0 2.2 2.0 ! A.236 at 2.07e+07 ! D50 assign (resid 50 and name HB2 ) (resid 50 and name HN ) 4.0 2.2 1.0 ! A.700 at 5.34e+07 assign (resid 50 and name HB1 ) (resid 50 and name HN ) 4.0 2.2 1.0 ! A.699 at 4.66e+07 assign (resid 50 and name HN ) (resid 51 and name HB ) 4.0 2.2 2.0 ! A.714 at 1.57e+07 assign (resid 50 and name HN ) (resid 51 and name HN ) 4.0 2.2 1.0 ! A.713 at 6.24e+07 assign (resid 50 and name HA ) (resid 51 and name HN ) 4.0 2.2 1.0 ! A.229 at 5.12e+07 ! I51 assign (resid 51 and name HD1# ) (resid 51 and name HN ) 4.0 2.2 1.5 ! A.237 at 3.82e+07 assign (resid 51 and name HG11 ) (resid 51 and name HN ) 3.0 1.2 0.5 ! A.225 at 1.19e+08 assign (resid 51 and name HB ) (resid 51 and name HN ) 3.0 1.2 0.5 ! A.224 at 8.44e+07 assign (resid 51 and name HG2# ) (resid 51 and name HN ) 3.0 1.2 1.0 ! A.227 at 7.18e+07 assign (resid 51 and name HG12 ) (resid 51 and name HN ) 4.0 2.2 1.0 ! A.226 at 4.76e+07 assign (resid 51 and name HD1# ) (resid 52 and name HN ) 4.0 2.2 1.5 ! A.329 at 2.52e+07 assign (resid 51 and name HA ) (resid 52 and name HN ) 2.5 0.7 0.4 ! A.323 at 2.55e+08 assign (resid 51 and name HG2# ) (resid 52 and name HN ) 3.0 1.2 1.0 ! A.319 at 1.25e+08 assign (resid 51 and name HN ) (resid 52 and name HN ) 4.0 2.2 1.0 ! A.324 at 2.80e+07 assign (resid 51 and name HN ) (resid 52 and name HA ) 4.0 2.2 1.0 ! A.233 at 3.88e+07 assign (resid 51 and name HG2# ) (resid 55 and name HN ) 4.0 2.2 1.5 ! A.580 at 4.70e+07 assign (resid 51 and name HD1# ) (resid 56 and name HN ) 4.0 2.2 1.5 ! A.565 at 3.02e+07 ! S52 assign (resid 52 and name HB2 ) (resid 52 and name HN ) 4.0 2.2 1.0 ! A.322 at 5.32e+07 assign (resid 52 and name HB2 ) (resid 53 and name HN ) 4.0 2.2 1.0 ! A.30 at 3.44e+07 assign (resid 52 and name HB1 ) (resid 53 and name HN ) 4.0 2.2 1.0 ! A.28 at 4.41e+07 assign (resid 52 and name HA ) (resid 53 and name HN ) 2.5 0.7 0.4 ! A.29 at 3.45e+08 assign (resid 52 and name HA ) (resid 55 and name HN ) 4.0 2.2 1.0 ! A.592 at 1.41e+08 (widened) assign (resid 52 and name HB1 ) (resid 55 and name HN ) 3.0 1.2 0.5 ! A.590 at 1.31e+08 ! V53 assign (resid 53 and name HG2# ) (resid 53 and name HN ) 3.0 1.2 1.0 ! A.33 at 9.98e+07 assign (resid 53 and name HG1# ) (resid 53 and name HN ) 4.0 2.2 1.5 ! A.34 at 5.15e+07 assign (resid 53 and name HA ) (resid 56 and name HN ) 4.0 2.2 1.0 ! A.587 at 2.55e+07 ! S54 assign (resid 54 and name HA ) (resid 56 and name HN ) 4.0 2.2 1.0 ! A.575 at 3.94e+07 ! Q55 assign (resid 55 and name HB1 ) (resid 55 and name HN ) 3.0 1.2 0.5 ! A.582 at 1.09e+08 assign (resid 55 and name HB2 ) (resid 55 and name HN ) 2.5 0.7 0.4 ! A.584 at 2.65e+08 assign (resid 55 and name HB1 ) (resid 56 and name HN ) 4.0 2.2 1.0 ! A.570 at 5.92e+07 assign (resid 55 and name HA ) (resid 56 and name HN ) 4.0 2.2 1.0 ! A.576 at 5.63e+07 assign (resid 55 and name HB2 ) (resid 56 and name HN ) 3.0 1.2 0.5 ! A.572 at 7.83e+07 assign (resid 55 and name HN ) (resid 57 and name HB2 ) 4.0 2.2 1.0 ! A.581 at 3.75e+07 assign (resid 55 and name HA ) (resid 58 and name HN ) 3.0 1.2 0.5 ! A.735 at 8.75e+07 assign (resid 55 and name HA ) (resid 59 and name HN ) 4.0 2.2 1.0 ! A.600 at 2.31e+07 ! V56 assign (resid 56 and name HG1# ) (resid 56 and name HN ) 3.0 1.2 1.0 ! A.563 at 1.38e+08 assign (resid 56 and name HB ) (resid 56 and name HN ) 2.5 0.7 0.4 ! A.571 at 2.48e+08 assign (resid 56 and name HG2# ) (resid 56 and name HN ) 2.5 0.7 0.9 ! A.566 at 3.02e+08 assign (resid 56 and name HN ) (resid 57 and name HG ) 4.0 2.2 1.0 ! A.568 at 3.38e+07 assign (resid 56 and name HN ) (resid 57 and name HB2 ) 4.0 2.2 1.0 ! A.569 at 4.46e+07 assign (resid 56 and name HN ) (resid 57 and name HN ) 3.0 1.2 0.5 ! A.578 at 1.55e+08 assign (resid 56 and name HB ) (resid 57 and name HN ) 3.0 1.2 0.5 ! A.459 at 9.06e+07 assign (resid 56 and name HG2# ) (resid 57 and name HN ) 4.0 2.2 1.5 ! A.456 at 5.01e+07 assign (resid 56 and name HA ) (resid 57 and name HN ) 4.0 2.2 1.0 ! A.460 at 2.93e+07 assign (resid 56 and name HA ) (resid 58 and name HN ) 4.0 2.2 2.0 ! A.733 at 1.76e+07 assign (resid 56 and name HA ) (resid 59 and name HN ) 3.0 1.2 0.5 ! A.603 at 7.41e+07 assign (resid 56 and name HA ) (resid 60 and name HN ) 4.0 2.2 1.0 ! A.676 at 3.68e+07 ! L57 assign (resid 57 and name HD2# ) (resid 57 and name HN ) 3.0 1.2 1.0 ! A.477 at 6.82e+07 assign (resid 57 and name HB2 ) (resid 57 and name HN ) 3.0 1.2 0.5 ! A.458 at 1.09e+08 assign (resid 57 and name HB1 ) (resid 57 and name HN ) 3.0 1.2 0.5 ! A.457 at 1.38e+08 assign (resid 57 and name HN ) (resid 58 and name HN ) 3.0 1.2 0.5 ! A.454 at 9.21e+07 assign (resid 57 and name HD2# ) (resid 58 and name HN ) 3.0 1.2 1.0 ! A.730 at 7.61e+07 assign (resid 57 and name HB2 ) (resid 58 and name HN ) 3.0 1.2 0.5 ! A.727 at 1.32e+08 assign (resid 57 and name HB1 ) (resid 58 and name HN ) 3.0 1.2 0.5 ! A.728 at 1.01e+08 assign (resid 57 and name HN ) (resid 59 and name HN ) 4.0 2.2 1.0 ! A.597 at 3.42e+07 assign (resid 57 and name HA ) (resid 60 and name HN ) 4.0 2.2 1.0 ! A.678 at 4.22e+07 assign (resid 57 and name HN ) (resid 60 and name HN ) 4.0 2.2 1.0 ! A.683 at 3.17e+07 ! E58 assign (resid 58 and name HG1 ) (resid 58 and name HN ) 3.0 1.2 0.5 ! A.732 at 1.49e+08 assign (resid 58 and name HN ) (resid 59 and name HN ) 3.0 1.2 0.5 ! A.599 at 1.52e+08 assign (resid 58 and name HA ) (resid 59 and name HN ) 4.0 2.2 1.0 ! A.601 at 5.97e+07 assign (resid 58 and name HG1 ) (resid 59 and name HN ) 4.0 2.2 1.0 ! A.606 at 2.82e+07 assign (resid 58 and name HB2 ) (resid 59 and name HN ) 3.0 1.2 0.5 ! A.607 at 1.27e+08 assign (resid 58 and name HN ) (resid 59 and name HG12 ) 4.0 2.2 2.0 ! A.729 at 2.28e+07 assign (resid 58 and name HN ) (resid 60 and name HN ) 3.0 1.2 0.5 ! A.737 at 9.63e+07 assign (resid 58 and name HA ) (resid 61 and name HN ) 3.0 1.2 0.5 ! A.98 at 7.09e+07 assign (resid 58 and name HN ) (resid 61 and name HG2# ) 4.0 2.2 2.5 ! A.731 at 2.25e+07 assign (resid 58 and name HA ) (resid 62 and name HN ) 4.0 2.2 1.0 ! A.429 at 4.04e+07 ! I59 assign (resid 59 and name HG12 ) (resid 59 and name HN ) 3.0 1.2 0.5 ! A.610 at 1.22e+08 assign (resid 59 and name HG2# ) (resid 59 and name HN ) 3.0 1.2 1.0 ! A.609 at 1.78e+08 assign (resid 59 and name HB ) (resid 59 and name HN ) 2.5 0.7 0.4 ! A.608 at 3.09e+08 assign (resid 59 and name HG12 ) (resid 60 and name HN ) 4.0 2.2 1.0 ! A.673 at 2.48e+07 assign (resid 59 and name HN ) (resid 60 and name HN ) 3.0 1.2 0.5 ! A.681 at 7.98e+07 assign (resid 59 and name HB ) (resid 60 and name HN ) 3.0 1.2 0.5 ! A.672 at 1.02e+08 assign (resid 59 and name HA ) (resid 60 and name HN ) 4.0 2.2 1.0 ! A.677 at 3.68e+07 assign (resid 59 and name HN ) (resid 60 and name HB2 ) 4.0 2.2 2.0 ! A.605 at 2.03e+07 assign (resid 59 and name HN ) (resid 60 and name HB1 ) 4.0 2.2 2.0 ! A.604 at 2.01e+07 assign (resid 59 and name HN ) (resid 61 and name HN ) 4.0 2.2 2.0 ! A.598 at 1.74e+07 assign (resid 59 and name HG2# ) (resid 61 and name HN ) 4.0 2.2 1.5 ! A.107 at 2.43e+07 assign (resid 59 and name HB ) (resid 61 and name HN ) 4.0 2.2 2.0 ! A.103 at 1.81e+07 assign (resid 59 and name HA ) (resid 62 and name HN ) 4.0 2.2 1.0 ! A.430 at 3.80e+07 assign (resid 59 and name HG2# ) (resid 62 and name HN ) 4.0 2.2 2.5 ! A.438 at 2.26e+07 assign (resid 59 and name HA ) (resid 63 and name HN ) 4.0 2.2 1.0 ! A.530 at 2.76e+07 ! H60 assign (resid 60 and name HB1 ) (resid 60 and name HN ) 3.0 1.2 0.5 ! A.675 at 1.24e+08 assign (resid 60 and name HB2 ) (resid 60 and name HN ) 3.0 1.2 0.5 ! A.670 at 1.32e+08 assign (resid 60 and name HN ) (resid 61 and name HN ) 3.0 1.2 0.5 ! A.682 at 7.78e+07 assign (resid 60 and name HB1 ) (resid 61 and name HN ) 3.0 1.2 0.5 ! A.101 at 8.44e+07 assign (resid 60 and name HB2 ) (resid 61 and name HN ) 3.0 1.2 0.5 ! A.105 at 6.82e+07 assign (resid 60 and name HD2 ) (resid 61 and name HN ) 4.0 2.2 1.0 ! A.93 at 3.03e+07 assign (resid 60 and name HA ) (resid 61 and name HN ) 4.0 2.2 1.0 ! A.97 at 5.15e+07 assign (resid 60 and name HB2 ) (resid 63 and name HN ) 4.0 2.2 2.0 ! A.528 at 1.65e+07 assign (resid 60 and name HB2 ) (resid 88 and name HN ) 4.0 2.2 2.0 ! A.278 at 1.71e+07 assign (resid 60 and name HE1 ) (resid 88 and name HN ) 4.0 2.2 2.0 ! A.275 at 2.16e+07 ! V61 assign (resid 61 and name HG2# ) (resid 61 and name HN ) 2.5 0.7 0.9 ! A.106 at 2.30e+08 assign (resid 61 and name HB ) (resid 61 and name HN ) 2.5 0.7 0.4 ! A.104 at 2.38e+08 assign (resid 61 and name HG1# ) (resid 61 and name HN ) 3.0 1.2 1.0 ! A.100 at 1.01e+08 assign (resid 61 and name HG2# ) (resid 62 and name HN ) 3.0 1.2 1.0 ! A.436 at 6.99e+07 assign (resid 61 and name HG1# ) (resid 62 and name HN ) 3.0 1.2 1.0 ! A.437 at 8.33e+07 assign (resid 61 and name HN ) (resid 62 and name HN ) 3.0 1.2 0.5 ! A.440 at 1.32e+08 assign (resid 61 and name HA ) (resid 62 and name HN ) 4.0 2.2 1.0 ! A.431 at 4.75e+07 assign (resid 61 and name HA ) (resid 63 and name HN ) 4.0 2.2 1.0 ! A.529 at 2.41e+07 assign (resid 61 and name HA ) (resid 64 and name HN ) 4.0 2.2 1.0 ! A.82 at 6.05e+07 assign (resid 61 and name HA ) (resid 65 and name HN ) 4.0 2.2 1.0 ! A.351 at 2.50e+07 ! E62 assign (resid 62 and name HG1 ) (resid 62 and name HN ) 4.0 2.2 1.0 ! A.433 at 1.05e+08 (widened1) assign (resid 62 and name HG1 ) (resid 63 and name HN ) 4.0 2.2 1.0 ! A.523 at 2.61e+07 assign (resid 62 and name HB1 ) (resid 63 and name HN ) 2.5 0.7 0.4 ! A.524 at 1.96e+08 assign (resid 62 and name HN ) (resid 63 and name HN ) 2.5 0.7 0.4 ! A.532 at 2.02e+08 assign (resid 62 and name HN ) (resid 63 and name HB# ) 4.0 2.2 1.5 ! A.435 at 2.80e+07 assign (resid 62 and name HN ) (resid 64 and name HN ) 4.0 2.2 1.0 ! A.87 at 2.35e+07 assign (resid 62 and name HA ) (resid 65 and name HN ) 3.0 1.2 0.5 ! A.352 at 1.13e+08 assign (resid 62 and name HN ) (resid 65 and name HB2 ) 4.0 2.2 2.0 ! A.432 at 1.66e+07 ! L63 assign (resid 63 and name HG ) (resid 63 and name HN ) 4.0 2.2 1.0 ! A.527 at 4.20e+07 assign (resid 63 and name HB# ) (resid 63 and name HN ) 2.5 0.7 0.9 ! A.525 at 4.19e+08 assign (resid 63 and name HN ) (resid 64 and name HN ) 2.5 0.7 0.4 ! A.533 at 1.88e+08 assign (resid 63 and name HG ) (resid 64 and name HN ) 4.0 2.2 1.0 ! A.89 at 3.47e+07 assign (resid 63 and name HD2# ) (resid 64 and name HN ) 4.0 2.2 1.5 ! A.85 at 3.67e+07 assign (resid 63 and name HB# ) (resid 65 and name HN ) 4.0 2.2 2.5 ! A.358 at 2.03e+07 assign (resid 63 and name HN ) (resid 65 and name HN ) 3.0 1.2 0.5 ! A.531 at 6.99e+07 assign (resid 63 and name HD1# ) (resid 67 and name HN ) 4.0 2.2 1.5 ! A.139 at 3.14e+07 ! M64 assign (resid 64 and name HG1 ) (resid 64 and name HN ) 3.0 1.2 0.5 ! A.83 at 7.53e+07 assign (resid 64 and name HB2 ) (resid 64 and name HN ) 3.0 1.2 0.5 ! A.84 at 1.16e+08 assign (resid 64 and name HN ) (resid 65 and name HN ) 3.0 1.2 0.5 ! A.354 at 1.40e+08 assign (resid 64 and name HB1 ) (resid 65 and name HN ) 4.0 2.2 1.0 ! A.356 at 3.71e+07 assign (resid 64 and name HB2 ) (resid 65 and name HN ) 3.0 1.2 0.5 ! A.355 at 7.37e+07 assign (resid 64 and name HB1 ) (resid 66 and name HN ) 4.0 2.2 2.0 ! A.814 at 1.47e+07 assign (resid 64 and name HN ) (resid 81 and name HD1# ) 4.0 2.2 2.5 ! A.91 at 1.54e+07 ! D65 assign (resid 65 and name HB1 ) (resid 65 and name HN ) 2.5 0.7 0.4 ! A.350 at 3.65e+08 assign (resid 65 and name HB2 ) (resid 66 and name HN ) 3.0 1.2 0.5 ! A.805 at 1.41e+08 assign (resid 65 and name HN ) (resid 66 and name HN ) 3.0 1.2 0.5 ! A.810 at 1.25e+08 ! T66 assign (resid 66 and name HB ) (resid 66 and name HN ) 2.5 0.7 0.4 ! A.808 at 1.92e+08 assign (resid 66 and name HG2# ) (resid 66 and name HN ) 3.0 1.2 1.0 ! A.806 at 9.52e+07 assign (resid 66 and name HN ) (resid 67 and name HN ) 3.0 1.2 0.5 ! A.131 at 1.20e+08 assign (resid 66 and name HG2# ) (resid 67 and name HN ) 4.0 2.2 1.5 ! A.137 at 6.07e+07 assign (resid 66 and name HB ) (resid 67 and name HN ) 3.0 1.2 0.5 ! A.133 at 1.63e+08 assign (resid 66 and name HA ) (resid 69 and name HN ) 3.0 1.2 0.5 ! A.644 at 8.61e+07 assign (resid 66 and name HN ) (resid 69 and name HG1 ) 4.0 2.2 2.0 ! A.815 at 1.48e+07 ! F67 assign (resid 67 and name HD# ) (resid 67 and name HN ) 4.0 2.2 1.0 ! A.130 at 4.33e+07 assign (resid 67 and name HB2 ) (resid 67 and name HN ) 3.0 1.2 0.5 ! A.135 at 1.71e+08 assign (resid 67 and name HB1 ) (resid 67 and name HN ) 3.0 1.2 0.5 ! A.136 at 1.27e+08 assign (resid 67 and name HN ) (resid 81 and name HD1# ) 4.0 2.2 1.5 ! A.138 at 2.90e+07 ! S68 ! K69 assign (resid 69 and name HB# ) (resid 69 and name HN ) 3.0 1.2 1.0 ! A.645 at 9.72e+07 assign (resid 69 and name HG1 ) (resid 69 and name HN ) 4.0 2.2 1.0 ! A.646 at 5.60e+07 assign (resid 69 and name HG2 ) (resid 69 and name HN ) 4.0 2.2 2.0 ! A.647 at 2.20e+07 ! Q70 assign (resid 70 and name HG1 ) (resid 70 and name HN ) 4.0 2.2 1.0 ! A.633 at 2.73e+07 assign (resid 70 and name HB# ) (resid 70 and name HN ) 3.0 1.2 1.0 ! A.634 at 1.31e+08 assign (resid 70 and name HB# ) (resid 71 and name HN ) 4.0 2.2 1.5 ! A.400 at 4.88e+07 assign (resid 70 and name HN ) (resid 71 and name HN ) 4.0 2.2 2.0 ! A.399 at 1.68e+07 assign (resid 70 and name HE22 ) (resid 74 and name HG1 ) 4.0 2.2 2.0 ! A.253 at -1.97e+07 ! L71 assign (resid 71 and name HD2# ) (resid 71 and name HN ) 4.0 2.2 1.5 ! A.401 at 5.53e+07 assign (resid 71 and name HB2 ) (resid 71 and name HN ) 3.0 1.2 0.5 ! A.398 at 1.18e+08 assign (resid 71 and name HB1 ) (resid 71 and name HN ) 4.0 2.2 1.0 ! A.397 at 4.47e+07 assign (resid 71 and name HN ) (resid 72 and name HN ) 4.0 2.2 1.0 ! A.170 at 2.63e+07 assign (resid 71 and name HD2# ) (resid 72 and name HN ) 4.0 2.2 1.5 ! A.169 at 2.63e+07 assign (resid 71 and name HB1 ) (resid 72 and name HN ) 4.0 2.2 1.0 ! A.168 at 5.58e+07 assign (resid 71 and name HA ) (resid 72 and name HN ) 4.0 2.2 1.0 ! A.165 at 4.92e+07 assign (resid 71 and name HN ) (resid 74 and name HG1 ) 4.0 2.2 2.0 ! A.402 at 2.03e+07 assign (resid 71 and name HG ) (resid 80 and name HN ) 4.0 2.2 2.0 ! A.689 at 1.99e+07 assign (resid 71 and name HG ) (resid 81 and name HN ) 3.0 1.2 0.5 ! A.650 at 1.12e+08 ! K72 assign (resid 72 and name HG1 ) (resid 72 and name HN ) 4.0 2.2 1.0 ! A.167 at 6.27e+07 assign (resid 72 and name HB# ) (resid 72 and name HN ) 3.0 1.2 1.0 ! A.166 at 1.80e+08 assign (resid 72 and name HN ) (resid 73 and name HN ) 4.0 2.2 1.0 ! A.551 at 3.66e+07 ! L73 assign (resid 73 and name HB2 ) (resid 73 and name HN ) 2.5 0.7 0.4 ! A.548 at 1.87e+08 assign (resid 73 and name HB1 ) (resid 73 and name HN ) 3.0 1.2 0.5 ! A.547 at 1.16e+08 assign (resid 73 and name HN ) (resid 74 and name HG2 ) 4.0 2.2 1.0 ! A.549 at 2.78e+07 ! E74 assign (resid 74 and name HB2 ) (resid 74 and name HN ) 3.0 1.2 0.5 ! A.763 at 7.76e+07 assign (resid 74 and name HB1 ) (resid 74 and name HN ) 4.0 2.2 1.0 ! A.762 at 4.47e+07 assign (resid 74 and name HG1 ) (resid 74 and name HN ) 4.0 2.2 1.0 ! A.761 at 5.22e+07 ! G75 assign (resid 75 and name HA1 ) (resid 76 and name HN ) 4.0 2.2 1.0 ! A.461 at 4.10e+07 ! R76 assign (resid 76 and name HD# ) (resid 76 and name HN ) 4.0 2.2 2.5 ! A.471 at 2.10e+07 ! S77 ! E78 assign (resid 78 and name HA ) (resid 79 and name HN ) 4.0 2.2 1.0 ! A.345 at 4.90e+07 ! D79 assign (resid 79 and name HB2 ) (resid 79 and name HN ) 4.0 2.2 1.0 ! A.344 at 5.81e+07 assign (resid 79 and name HN ) (resid 80 and name HN ) 4.0 2.2 2.0 ! A.694 at 1.86e+07 assign (resid 79 and name HA ) (resid 80 and name HN ) 3.0 1.2 0.5 ! A.684 at 6.46e+07 assign (resid 79 and name HB2 ) (resid 80 and name HN ) 4.0 2.2 1.0 ! A.686 at 3.74e+07 ! I80 assign (resid 80 and name HG11 ) (resid 80 and name HN ) 4.0 2.2 1.0 ! A.690 at 3.69e+07 assign (resid 80 and name HG12 ) (resid 80 and name HN ) 4.0 2.2 1.0 ! A.691 at 6.96e+07 (widened1) assign (resid 80 and name HB ) (resid 80 and name HN ) 3.0 1.2 0.5 ! A.688 at 1.34e+08 assign (resid 80 and name HG2# ) (resid 80 and name HN ) 3.0 1.2 1.0 ! A.692 at 1.63e+08 assign (resid 80 and name HA ) (resid 81 and name HN ) 4.0 2.2 1.0 ! A.651 at 4.28e+07 assign (resid 80 and name HG2# ) (resid 81 and name HN ) 4.0 2.2 1.5 ! A.649 at 3.87e+07 assign (resid 80 and name HN ) (resid 81 and name HN ) 4.0 2.2 1.0 ! A.693 at 5.55e+07 assign (resid 80 and name HG12 ) (resid 83 and name HN ) 4.0 2.2 1.0 ! A.618 at 4.02e+07 ! L81 assign (resid 81 and name HD1# ) (resid 81 and name HN ) 4.0 2.2 1.5 ! A.648 at 4.97e+07 ! L82 assign (resid 82 and name HB# ) (resid 82 and name HN ) 3.0 1.2 1.0 ! A.611 at 1.49e+08 assign (resid 82 and name HD2# ) (resid 83 and name HN ) 4.0 2.2 1.5 ! A.619 at 3.67e+07 assign (resid 82 and name HB# ) (resid 83 and name HN ) 4.0 2.2 1.5 ! A.617 at 5.74e+07 assign (resid 82 and name HD1# ) (resid 83 and name HN ) 4.0 2.2 1.5 ! A.620 at 2.44e+07 ! D83 assign (resid 83 and name HB2 ) (resid 83 and name HN ) 3.0 1.2 0.5 ! A.616 at 7.03e+07 assign (resid 83 and name HB1 ) (resid 83 and name HN ) 3.0 1.2 0.5 ! A.615 at 9.01e+07 assign (resid 83 and name HB2 ) (resid 86 and name HN ) 4.0 2.2 2.0 ! A.770 at 1.69e+07 ! Y84 assign (resid 84 and name HB2 ) (resid 85 and name HN ) 4.0 2.2 2.0 ! A.404 at 2.24e+07 assign (resid 84 and name HA ) (resid 86 and name HN ) 4.0 2.2 1.0 ! A.768 at 2.53e+07 assign (resid 84 and name HD# ) (resid 87 and name HN ) 4.0 2.2 2.0 ! A.267 at 2.05e+07 assign (resid 84 and name HA ) (resid 87 and name HN ) 3.0 1.2 0.5 ! A.265 at 7.35e+07 ! R85 assign (resid 85 and name HG# ) (resid 86 and name HN ) 4.0 2.2 1.5 ! A.773 at 2.82e+07 assign (resid 85 and name HN ) (resid 86 and name HN ) 4.0 2.2 1.0 ! A.765 at 4.04e+07 ! L86 assign (resid 86 and name HD1# ) (resid 86 and name HN ) 4.0 2.2 1.5 ! A.774 at 4.76e+07 assign (resid 86 and name HD2# ) (resid 86 and name HN ) 4.0 2.2 1.5 ! A.775 at 4.76e+07 assign (resid 86 and name HG ) (resid 86 and name HN ) 2.5 0.7 0.4 ! A.772 at 1.99e+08 assign (resid 86 and name HB2 ) (resid 86 and name HN ) 3.0 1.2 0.5 ! A.771 at 1.15e+08 assign (resid 86 and name HN ) (resid 87 and name HN ) 3.0 1.2 0.5 ! A.764 at 6.98e+07 assign (resid 86 and name HD1# ) (resid 87 and name HN ) 4.0 2.2 2.5 ! A.270 at 2.25e+07 assign (resid 86 and name HB1 ) (resid 87 and name HN ) 3.0 1.2 0.5 ! A.260 at 7.45e+07 assign (resid 86 and name HB2 ) (resid 87 and name HN ) 4.0 2.2 1.0 ! A.261 at 6.19e+07 assign (resid 86 and name HN ) (resid 89 and name HD1# ) 4.0 2.2 1.5 ! A.777 at 2.57e+07 assign (resid 86 and name HA ) (resid 90 and name HN ) 4.0 2.2 1.0 ! A.628 at 2.99e+07 ! T87 assign (resid 87 and name HB ) (resid 87 and name HN ) 3.0 1.2 0.5 ! A.263 at 1.43e+08 assign (resid 87 and name HG2# ) (resid 87 and name HN ) 4.0 2.2 1.5 ! A.272 at 4.78e+07 assign (resid 87 and name HN ) (resid 88 and name HN ) 4.0 2.2 1.0 ! A.274 at 6.30e+07 assign (resid 87 and name HA ) (resid 88 and name HN ) 4.0 2.2 2.0 ! A.279 at 1.51e+07 assign (resid 87 and name HN ) (resid 88 and name HB2 ) 4.0 2.2 1.0 ! A.271 at 2.47e+07 ! L88 assign (resid 88 and name HB1 ) (resid 88 and name HN ) 3.0 1.2 0.5 ! A.281 at 9.06e+07 assign (resid 88 and name HB2 ) (resid 88 and name HN ) 3.0 1.2 0.5 ! A.282 at 9.55e+07 assign (resid 88 and name HD1# ) (resid 88 and name HN ) 4.0 2.2 1.5 ! A.284 at 3.48e+07 assign (resid 88 and name HG ) (resid 88 and name HN ) 4.0 2.2 1.0 ! A.283 at 2.68e+07 assign (resid 88 and name HN ) (resid 89 and name HN ) 4.0 2.2 1.0 ! A.276 at 4.25e+07 assign (resid 88 and name HB1 ) (resid 89 and name HN ) 4.0 2.2 1.0 ! A.717 at 5.01e+07 assign (resid 88 and name HB2 ) (resid 89 and name HN ) 4.0 2.2 1.0 ! A.719 at 4.33e+07 assign (resid 88 and name HG ) (resid 89 and name HN ) 4.0 2.2 1.0 ! A.718 at 2.37e+07 assign (resid 88 and name HD1# ) (resid 89 and name HN ) 4.0 2.2 1.5 ! A.722 at 2.67e+07 assign (resid 88 and name HA ) (resid 91 and name HN ) 4.0 2.2 1.0 ! A.384 at 3.69e+07 ! I89 assign (resid 89 and name HG11 ) (resid 89 and name HN ) 2.5 0.7 0.4 ! A.716 at 1.90e+08 assign (resid 89 and name HG12 ) (resid 89 and name HN ) 3.0 1.2 0.5 ! A.721 at 7.11e+07 assign (resid 89 and name HB ) (resid 90 and name HN ) 3.0 1.2 0.5 ! A.624 at 9.69e+07 assign (resid 89 and name HG2# ) (resid 90 and name HN ) 3.0 1.2 1.0 ! A.626 at 9.67e+07 assign (resid 89 and name HA ) (resid 90 and name HN ) 4.0 2.2 2.0 ! A.627 at 2.08e+07 assign (resid 89 and name HA ) (resid 91 and name HN ) 4.0 2.2 2.0 ! A.395 at 1.70e+07 assign (resid 89 and name HA ) (resid 92 and name HN ) 4.0 2.2 2.0 ! A.57 at 1.95e+07 assign (resid 89 and name HA ) (resid 93 and name HN ) 4.0 2.2 2.0 ! A.6 at -2.10e+07 ! D90 assign (resid 90 and name HB# ) (resid 90 and name HN ) 2.5 0.7 0.9 ! A.623 at 1.85e+08 assign (resid 90 and name HN ) (resid 91 and name HN ) 3.0 1.2 0.5 ! A.629 at 8.05e+07 assign (resid 90 and name HB# ) (resid 91 and name HN ) 3.0 1.2 1.0 ! A.387 at 7.68e+07 assign (resid 90 and name HA ) (resid 91 and name HN ) 4.0 2.2 1.0 ! A.385 at 2.85e+07 assign (resid 90 and name HA ) (resid 93 and name HN ) 4.0 2.2 1.0 ! A.7 at -2.77e+07 ! V91 assign (resid 91 and name HG2# ) (resid 91 and name HN ) 3.0 1.2 1.0 ! A.389 at 1.72e+08 assign (resid 91 and name HG1# ) (resid 91 and name HN ) 3.0 1.2 1.0 ! A.390 at 1.00e+08 assign (resid 91 and name HB ) (resid 91 and name HN ) 3.0 1.2 0.5 ! A.388 at 1.50e+08 assign (resid 91 and name HN ) (resid 92 and name HN ) 3.0 1.2 0.5 ! A.391 at 7.99e+07 assign (resid 91 and name HB ) (resid 92 and name HN ) 4.0 2.2 1.0 ! A.59 at 5.89e+07 assign (resid 91 and name HA ) (resid 92 and name HN ) 4.0 2.2 1.0 ! A.56 at 2.32e+07 assign (resid 91 and name HG1# ) (resid 92 and name HN ) 3.0 1.2 1.0 ! A.64 at 1.52e+08 assign (resid 91 and name HA ) (resid 94 and name HN ) 4.0 2.2 1.0 ! A.817 at 4.34e+07 assign (resid 91 and name HA ) (resid 95 and name HN ) 4.0 2.2 1.0 ! A.158 at 2.76e+07 ! I92 assign (resid 92 and name HG11 ) (resid 92 and name HN ) 3.0 1.2 0.5 ! A.61 at 6.98e+07 assign (resid 92 and name HG12 ) (resid 92 and name HN ) 4.0 2.2 1.0 ! A.63 at 5.43e+07 assign (resid 92 and name HG2# ) (resid 92 and name HN ) 3.0 1.2 1.0 ! A.65 at 1.15e+08 assign (resid 92 and name HB ) (resid 92 and name HN ) 3.0 1.2 0.5 ! A.60 at 7.92e+07 assign (resid 92 and name HN ) (resid 93 and name HB# ) 4.0 2.2 1.5 ! A.62 at 2.68e+07 assign (resid 92 and name HG11 ) (resid 93 and name HN ) 4.0 2.2 1.0 ! A.5 at -3.54e+07 assign (resid 92 and name HN ) (resid 93 and name HN ) 3.0 1.2 0.5 ! A.3 at -6.77e+07 assign (resid 92 and name HG2# ) (resid 93 and name HN ) 3.0 1.2 1.0 ! A.11 at -7.11e+07 assign (resid 92 and name HG12 ) (resid 93 and name HN ) 4.0 2.2 1.0 ! A.10 at -3.14e+07 assign (resid 92 and name HB ) (resid 93 and name HN ) 4.0 2.2 1.0 ! A.8 at -5.53e+07 assign (resid 92 and name HG2# ) (resid 94 and name HN ) 4.0 2.2 2.5 ! A.821 at 2.25e+07 assign (resid 92 and name HA ) (resid 95 and name HN ) 3.0 1.2 0.5 ! A.160 at 6.41e+07 assign (resid 92 and name HA ) (resid 96 and name HN ) 4.0 2.2 1.0 ! A.39 at 3.74e+07 ! A93 assign (resid 93 and name HB# ) (resid 93 and name HN ) 2.5 0.7 0.9 ! A.4 at -2.47e+08 assign (resid 93 and name HB# ) (resid 94 and name HN ) 3.0 1.2 1.0 ! A.822 at 1.68e+08 assign (resid 93 and name HN ) (resid 94 and name HN ) 3.0 1.2 0.5 ! A.820 at 1.23e+08 assign (resid 93 and name HN ) (resid 95 and name HN ) 4.0 2.2 2.0 ! A.78 at -1.55e+07 assign (resid 93 and name HN ) (resid 96 and name HB2 ) 4.0 2.2 2.0 ! A.12 at -1.36e+07 ! H94 assign (resid 94 and name HB# ) (resid 94 and name HN ) 2.5 0.7 0.9 ! A.816 at 1.81e+08 assign (resid 94 and name HA ) (resid 95 and name HN ) 4.0 2.2 1.0 ! A.161 at 3.92e+07 assign (resid 94 and name HB# ) (resid 95 and name HN ) 3.0 1.2 1.0 ! A.157 at 6.92e+07 assign (resid 94 and name HN ) (resid 95 and name HN ) 3.0 1.2 0.5 ! A.162 at 1.18e+08 assign (resid 94 and name HA ) (resid 96 and name HN ) 4.0 2.2 1.0 ! A.42 at 2.39e+07 assign (resid 94 and name HA ) (resid 97 and name HN ) 4.0 2.2 2.0 ! A.494 at 1.94e+07 assign (resid 94 and name HA ) (resid 98 and name HN ) 4.0 2.2 2.0 ! A.292 at 2.16e+07 ! L95 assign (resid 95 and name HB1 ) (resid 95 and name HN ) 3.0 1.2 0.5 ! A.155 at 1.44e+08 assign (resid 95 and name HD2# ) (resid 95 and name HN ) 3.0 1.2 1.0 ! A.152 at 9.34e+07 assign (resid 95 and name HB2 ) (resid 95 and name HN ) 3.0 1.2 0.5 ! A.156 at 1.64e+08 assign (resid 95 and name HN ) (resid 96 and name HN ) 3.0 1.2 0.5 ! A.151 at 9.80e+07 assign (resid 95 and name HB1 ) (resid 96 and name HN ) 3.0 1.2 0.5 ! A.38 at 8.92e+07 assign (resid 95 and name HD1# ) (resid 98 and name HN ) 4.0 2.2 1.5 ! A.297 at 3.12e+07 assign (resid 95 and name HD1# ) (resid 99 and name HN ) 4.0 2.2 1.5 ! A.754 at 4.05e+07 ! C96 assign (resid 96 and name HB1 ) (resid 96 and name HN ) 3.0 1.2 0.5 ! A.36 at 1.89e+08 (widened1) assign (resid 96 and name HB1 ) (resid 97 and name HN ) 4.0 2.2 2.0 ! A.492 at 2.17e+07 assign (resid 96 and name HN ) (resid 97 and name HN ) 4.0 2.2 1.0 ! A.485 at 4.33e+07 assign (resid 96 and name HB2 ) (resid 97 and name HN ) 4.0 2.2 1.0 ! A.493 at 2.86e+07 assign (resid 96 and name HN ) (resid 98 and name HN ) 4.0 2.2 2.0 ! A.290 at 1.87e+07 assign (resid 96 and name HA ) (resid 99 and name HN ) 2.5 0.7 0.4 ! A.759 at 4.18e+08 ! E97 assign (resid 97 and name HB2 ) (resid 97 and name HN ) 3.0 1.2 0.5 ! A.489 at 6.82e+07 assign (resid 97 and name HG1 ) (resid 97 and name HN ) 4.0 2.2 1.0 ! A.490 at 2.75e+07 assign (resid 97 and name HB1 ) (resid 97 and name HN ) 4.0 2.2 1.0 ! A.488 at 5.56e+07 assign (resid 97 and name HG2 ) (resid 97 and name HN ) 4.0 2.2 1.0 ! A.491 at 3.22e+07 assign (resid 97 and name HN ) (resid 98 and name HN ) 3.0 1.2 0.5 ! A.495 at 6.62e+07 assign (resid 97 and name HG1 ) (resid 98 and name HN ) 4.0 2.2 2.0 ! A.296 at 1.96e+07 assign (resid 97 and name HG2 ) (resid 98 and name HN ) 4.0 2.2 1.0 ! A.295 at 3.29e+07 assign (resid 97 and name HA ) (resid 98 and name HN ) 4.0 2.2 1.0 ! A.293 at 3.48e+07 assign (resid 97 and name HA ) (resid 100 and name HN ) 4.0 2.2 1.0 ! A.378 at 4.41e+07 ! M98 assign (resid 98 and name HG1 ) (resid 98 and name HN ) 3.0 1.2 0.5 ! A.294 at 9.51e+07 assign (resid 98 and name HB2 ) (resid 98 and name HN ) 3.0 1.2 0.5 ! A.289 at 1.23e+08 assign (resid 98 and name HB1 ) (resid 98 and name HN ) 2.5 0.7 0.4 ! A.288 at 1.85e+08 assign (resid 98 and name HN ) (resid 99 and name HN ) 3.0 1.2 0.5 ! A.291 at 1.62e+08 assign (resid 98 and name HA ) (resid 99 and name HN ) 4.0 2.2 1.0 ! A.751 at 4.70e+07 assign (resid 98 and name HN ) (resid 100 and name HN ) 4.0 2.2 1.0 ! A.298 at 2.84e+07 assign (resid 98 and name HA ) (resid 101 and name HN ) 4.0 2.2 1.0 ! A.826 at 3.25e+07 assign (resid 98 and name HA ) (resid 102 and name HN ) 4.0 2.2 2.0 ! A.200 at 1.95e+07 ! Y99 assign (resid 99 and name HB2 ) (resid 99 and name HN ) 3.0 1.2 0.5 ! A.752 at 9.32e+07 assign (resid 99 and name HB1 ) (resid 99 and name HN ) 4.0 2.2 1.0 ! A.753 at 5.87e+07 assign (resid 99 and name HA ) (resid 100 and name HN ) 4.0 2.2 1.0 ! A.379 at 2.63e+07 assign (resid 99 and name HN ) (resid 100 and name HN ) 4.0 2.2 1.0 ! A.381 at 6.39e+07 assign (resid 99 and name HN ) (resid 100 and name HB2 ) 4.0 2.2 1.0 ! A.755 at 3.14e+07 assign (resid 99 and name HB1 ) (resid 102 and name HN ) 4.0 2.2 2.0 ! A.201 at 1.47e+07 ! R100 assign (resid 100 and name HG# ) (resid 100 and name HN ) 3.0 1.2 1.0 ! A.377 at 1.13e+08 assign (resid 100 and name HB1 ) (resid 100 and name HN ) 3.0 1.2 0.5 ! A.376 at 7.79e+07 assign (resid 100 and name HN ) (resid 101 and name HN ) 4.0 2.2 1.0 ! A.382 at 5.29e+07 assign (resid 100 and name HG# ) (resid 101 and name HN ) 4.0 2.2 1.5 ! A.831 at 5.10e+07 assign (resid 100 and name HA ) (resid 101 and name HN ) 4.0 2.2 1.0 ! A.827 at 3.22e+07 assign (resid 100 and name HA ) (resid 102 and name HN ) 4.0 2.2 2.0 ! A.202 at 1.96e+07 ! R101 assign (resid 101 and name HD2 ) (resid 101 and name HN ) 4.0 2.2 1.0 ! A.828 at 3.92e+07 assign (resid 101 and name HG2 ) (resid 101 and name HN ) 3.0 1.2 0.5 ! A.830 at 1.21e+08 assign (resid 101 and name HG1 ) (resid 101 and name HN ) 2.5 0.7 0.4 ! A.829 at 1.94e+08 assign (resid 101 and name HN ) (resid 102 and name HN ) 4.0 2.2 1.0 ! A.832 at 5.83e+07 assign (resid 101 and name HB2 ) (resid 102 and name HN ) 3.0 1.2 0.5 ! A.203 at 8.80e+07 assign (resid 101 and name HA ) (resid 102 and name HN ) 4.0 2.2 1.0 ! A.198 at 6.11e+07 ! S102 assign (resid 102 and name HB# ) (resid 102 and name HN ) 2.5 0.7 0.9 ! A.197 at 1.97e+08 assign (resid 102 and name HN ) (resid 103 and name HN ) 3.0 1.2 0.5 ! A.195 at 1.69e+08 assign (resid 102 and name HN ) (resid 103 and name HG12 ) 3.0 1.2 0.5 ! A.205 at 6.58e+07 ! I103 assign (resid 103 and name HG2# ) (resid 103 and name HN ) 3.0 1.2 1.0 ! A.855 at 9.83e+07 assign (resid 103 and name HG12 ) (resid 103 and name HN ) 3.0 1.2 0.5 ! A.852 at 1.68e+08 assign (resid 101 and name HN ) (resid 103 and name HN) 4.0 2.2 2.0 ! A.851 at 2.08e+07 assign (resid 103 and name HB ) (resid 103 and name HN ) 2.5 0.7 0.4 ! A.849 at 2.29e+08 assign (resid 100 and name HA ) (resid 103 and name HN ) 4.0 2.2 2.0 ! A.846 at 1.99e+07 assign (resid 102 and name HN ) (resid 103 and name HN ) 3.0 1.2 0.5 ! A.850 at 1.23e+08 ! P104 assign (resid 104 and name HB1 ) (resid 105 and name HN ) 4.0 2.2 1.0 ! A.346 at 2.77e+07 assign (resid 104 and name HB2 ) (resid 105 and name HN ) 4.0 2.2 1.0 ! A.347 at 2.78e+07 ! R105 assign (resid 105 and name HB1 ) (resid 105 and name HN ) 4.0 2.2 1.0 ! A.348 at 4.58e+07 assign (resid 105 and name HB2 ) (resid 105 and name HN ) 3.0 1.2 0.5 ! A.349 at 6.81e+07 assign (resid 105 and name HA ) (resid 107 and name HN ) 3.0 1.2 0.5 ! A.259 at -1.00e+08 ! E106 assign (resid 106 and name HB2 ) (resid 107 and name HN ) 4.0 2.2 2.0 ! A.257 at -1.92e+07 assign (resid 106 and name HA ) (resid 107 and name HN ) 3.0 1.2 0.5 ! A.254 at -1.78e+08 assign (resid 106 and name HB1 ) (resid 107 and name HN ) 4.0 2.2 1.0 ! A.256 at -5.09e+07 ! V107 assign (resid 107 and name HG1# ) (resid 107 and name HN ) 4.0 2.2 1.5 ! A.258 at -3.16e+07 ! SEGID b ! ! A1 ! M2 ! A3 ! R4 ! M5 ! S6 ! P7 ! A8 assign (resid 208 and name HA ) (resid 211 and name HN ) 4.0 2.2 2.0 ! A.467 at 2.18e+07 ! D9 ! K10 assign (resid 210 and name HG# ) (resid 211 and name HN ) 4.0 2.2 2.5 ! A.464 at 1.80e+07 assign (resid 210 and name HA ) (resid 213 and name HN ) 4.0 2.2 1.0 ! A.535 at 5.84e+07 ! R11 assign (resid 211 and name HG# ) (resid 211 and name HN ) 4.0 2.2 1.5 ! A.463 at 5.17e+07 assign (resid 211 and name HB# ) (resid 211 and name HN ) 2.5 0.7 0.9 ! A.462 at 1.83e+08 assign (resid 211 and name HD# ) (resid 211 and name HN ) 4.0 2.2 2.5 ! A.465 at 1.75e+07 ! K12 assign (resid 212 and name HB# ) (resid 212 and name HN ) 3.0 1.2 1.0 ! A.630 at 1.07e+08 assign (resid 212 and name HB# ) (resid 213 and name HN ) 3.0 1.2 1.0 ! A.541 at 1.52e+08 assign (resid 212 and name HG2 ) (resid 213 and name HN ) 4.0 2.2 1.0 ! A.544 at 2.58e+07 assign (resid 212 and name HN ) (resid 213 and name HD* ) 4.0 2.2 1.5 ! A.625 at 3.27e+07 assign (resid 212 and name HA ) (resid 214 and name HN ) 4.0 2.2 2.0 ! A.422 at 2.13e+07 ! L13 assign (resid 213 and name HG ) (resid 213 and name HN ) 2.5 0.7 0.4 ! A.543 at 2.27e+08 assign (resid 213 and name HD* ) (resid 213 and name HN ) 4.0 2.2 1.5 ! A.545 at 5.18e+07 assign (resid 213 and name HB2 ) (resid 213 and name HN ) 3.0 1.2 0.5 ! A.542 at 1.91e+08 (widened1) assign (resid 213 and name HN ) (resid 214 and name HN ) 3.0 1.2 0.5 ! A.537 at 9.32e+07 assign (resid 213 and name HA ) (resid 214 and name HN ) 4.0 2.2 1.0 ! A.421 at 3.24e+07 assign (resid 213 and name HD* ) (resid 249 and name HN ) 4.0 2.2 2.5 ! A.643 at 1.71e+07 ! L14 assign (resid 214 and name HD2# ) (resid 214 and name HN ) 3.0 1.2 1.0 ! A.419 at 8.32e+07 assign (resid 214 and name HG ) (resid 214 and name HN ) 2.5 0.7 0.4 ! A.420 at 2.28e+08 assign (resid 214 and name HB1 ) (resid 214 and name HN ) 3.0 1.2 0.5 ! A.427 at 1.12e+08 assign (resid 214 and name HN ) (resid 215 and name HB2 ) 4.0 2.2 2.0 ! A.425 at 1.92e+07 assign (resid 214 and name HN ) (resid 215 and name HN ) 3.0 1.2 0.5 ! A.424 at 1.04e+08 assign (resid 214 and name HA ) (resid 216 and name HN ) 4.0 2.2 1.0 ! A.362 at 2.59e+07 assign (resid 214 and name HN ) (resid 216 and name HN ) 4.0 2.2 1.0 ! A.371 at 3.03e+07 assign (resid 214 and name HA ) (resid 217 and name HN ) 4.0 2.2 1.0 ! A.111 at 4.59e+07 assign (resid 214 and name HD1# ) (resid 255 and name HE22 ) 4.0 2.2 1.5 ! A.243 at -2.38e+07 assign (resid 214 and name HD1# ) (resid 255 and name HE21 ) 4.0 2.2 1.5 ! A.241 at -2.31e+07 ! D15 assign (resid 215 and name HB2 ) (resid 215 and name HN ) 2.5 0.7 0.4 ! A.473 at 1.95e+08 assign (resid 215 and name HB1 ) (resid 216 and name HN ) 3.0 1.2 0.5 ! A.364 at 1.06e+08 assign (resid 215 and name HB2 ) (resid 216 and name HN ) 3.0 1.2 0.5 ! A.363 at 1.16e+08 assign (resid 215 and name HA ) (resid 217 and name HN ) 4.0 2.2 2.0 ! A.109 at 1.79e+07 ! E16 assign (resid 216 and name HB# ) (resid 216 and name HN ) 2.5 0.7 0.9 ! A.366 at 2.95e+08 assign (resid 216 and name HG# ) (resid 216 and name HN ) 3.0 1.2 1.0 ! A.365 at 1.01e+08 assign (resid 216 and name HN ) (resid 217 and name HG ) 4.0 2.2 1.0 ! A.367 at 4.96e+07 assign (resid 216 and name HN ) (resid 217 and name HN ) 3.0 1.2 0.5 ! A.370 at 1.53e+08 assign (resid 216 and name HB# ) (resid 217 and name HN ) 3.0 1.2 1.0 ! A.113 at 8.83e+07 assign (resid 216 and name HN ) (resid 218 and name HN ) 4.0 2.2 1.0 ! A.369 at 3.50e+07 assign (resid 216 and name HN ) (resid 220 and name HD1# ) 4.0 2.2 1.5 ! A.368 at 3.45e+07 ! L17 assign (resid 217 and name HB2 ) (resid 217 and name HN ) 3.0 1.2 0.5 ! A.114 at 1.03e+08 assign (resid 217 and name HB1 ) (resid 217 and name HN ) 4.0 2.2 1.0 ! A.116 at 6.38e+07 assign (resid 217 and name HG ) (resid 217 and name HN ) 3.0 1.2 0.5 ! A.115 at 1.49e+08 assign (resid 217 and name HD1# ) (resid 217 and name HN ) 4.0 2.2 1.5 ! A.118 at 5.43e+07 assign (resid 217 and name HN ) (resid 218 and name HN ) 3.0 1.2 0.5 ! A.326 at 1.47e+08 assign (resid 217 and name HB1 ) (resid 218 and name HN ) 4.0 2.2 1.0 ! A.318 at 4.47e+07 assign (resid 217 and name HD1# ) (resid 218 and name HN ) 4.0 2.2 1.5 ! A.328 at 2.46e+07 assign (resid 217 and name HN ) (resid 220 and name HD1# ) 4.0 2.2 1.5 ! A.117 at 3.75e+07 assign (resid 217 and name HD1# ) (resid 246 and name HN ) 4.0 2.2 1.5 ! A.126 at 2.93e+07 ! R18 assign (resid 218 and name HB# ) (resid 218 and name HN ) 2.5 0.7 0.9 ! A.317 at 2.83e+08 assign (resid 218 and name HD# ) (resid 218 and name HN ) 4.0 2.2 1.5 ! A.316 at 2.90e+07 assign (resid 218 and name HG# ) (resid 218 and name HN ) 3.0 1.2 1.0 ! A.320 at 8.38e+07 assign (resid 218 and name HN ) (resid 219 and name HN ) 3.0 1.2 0.5 ! A.325 at 1.05e+08 assign (resid 218 and name HB# ) (resid 219 and name HN ) 3.0 1.2 1.0 ! A.837 at 1.67e+08 assign (resid 218 and name HG# ) (resid 219 and name HN ) 4.0 2.2 2.5 ! A.838 at 2.05e+07 assign (resid 218 and name HA ) (resid 222 and name HN ) 4.0 2.2 1.0 ! A.789 at 4.44e+07 ! S19 assign (resid 219 and name HB# ) (resid 219 and name HN ) 2.5 0.7 0.9 ! A.835 at 4.06e+08 assign (resid 219 and name HA ) (resid 220 and name HN ) 4.0 2.2 1.0 ! A.143 at 5.40e+07 assign (resid 219 and name HN ) (resid 220 and name HN ) 3.0 1.2 0.5 ! A.150 at 9.89e+07 assign (resid 219 and name HB# ) (resid 220 and name HN ) 3.0 1.2 1.0 ! A.142 at 1.78e+08 assign (resid 219 and name HA ) (resid 221 and name HN ) 4.0 2.2 2.0 ! A.21 at 1.56e+07 assign (resid 219 and name HA ) (resid 222 and name HN ) 4.0 2.2 1.0 ! A.786 at 6.40e+07 ! I20 assign (resid 220 and name HD1# ) (resid 220 and name HN ) 3.0 1.2 1.0 ! A.147 at 9.86e+07 assign (resid 220 and name HG12 ) (resid 220 and name HN ) 3.0 1.2 0.5 ! A.146 at 1.37e+08 assign (resid 220 and name HN ) (resid 221 and name HN ) 3.0 1.2 0.5 ! A.148 at 8.62e+07 assign (resid 220 and name HG2# ) (resid 221 and name HN ) 4.0 2.2 1.5 ! A.17 at 4.89e+07 assign (resid 220 and name HB ) (resid 221 and name HN ) 3.0 1.2 0.5 ! A.15 at 1.28e+08 assign (resid 220 and name HA ) (resid 221 and name HN ) 4.0 2.2 1.0 ! A.19 at 3.50e+07 assign (resid 220 and name HN ) (resid 222 and name HN ) 4.0 2.2 2.0 ! A.790 at 1.96e+07 assign (resid 220 and name HN ) (resid 242 and name HD# ) 4.0 2.2 1.0 ! A.149 at 2.86e+07 assign (resid 220 and name HD1# ) (resid 242 and name HN ) 4.0 2.2 2.5 ! A.342 at 2.21e+07 assign (resid 220 and name HG2# ) (resid 242 and name HN ) 3.0 1.2 1.0 ! A.339 at 1.01e+08 ! Y21 assign (resid 221 and name HD# ) (resid 221 and name HN ) 4.0 2.2 1.0 ! A.23 at 3.72e+07 assign (resid 221 and name HB2 ) (resid 221 and name HN ) 3.0 1.2 0.5 ! A.14 at 1.36e+08 assign (resid 221 and name HB1 ) (resid 221 and name HN ) 3.0 1.2 0.5 ! A.13 at 1.18e+08 assign (resid 221 and name HN ) (resid 222 and name HN ) 3.0 1.2 0.5 ! A.26 at 9.29e+07 assign (resid 221 and name HD1 ) (resid 222 and name HN ) 4.0 2.2 1.0 ! A.787 at 2.53e+07 assign (resid 221 and name HB2 ) (resid 222 and name HN ) 3.0 1.2 0.5 ! A.784 at 7.66e+07 assign (resid 221 and name HB1 ) (resid 222 and name HN ) 3.0 1.2 0.5 ! A.783 at 7.72e+07 assign (resid 221 and name HA ) (resid 224 and name HN ) 3.0 1.2 0.5 ! A.497 at 7.87e+07 assign (resid 221 and name HN ) (resid 242 and name HD# ) 4.0 2.2 1.0 ! A.24 at 5.19e+07 assign (resid 221 and name HN ) (resid 242 and name HE# ) 4.0 2.2 1.0 ! A.25 at 6.13e+07 assign (resid 221 and name HE# ) (resid 260 and name HN ) 4.0 2.2 2.0 ! A.680 at 2.03e+07 assign (resid 221 and name HN ) (resid 263 and name HD2# ) 4.0 2.2 1.5 ! A.80 at 6.30e+07 ! R22 assign (resid 222 and name HB2 ) (resid 222 and name HN ) 2.5 0.7 0.4 ! A.779 at 2.09e+08 assign (resid 222 and name HG2 ) (resid 222 and name HN ) 4.0 2.2 1.0 ! A.780 at 7.13e+07 (widened1) assign (resid 222 and name HB1 ) (resid 222 and name HN ) 2.5 0.7 0.4 ! A.778 at 2.18e+08 assign (resid 222 and name HN ) (resid 223 and name HN ) 3.0 1.2 0.5 ! A.788 at 9.30e+07 assign (resid 222 and name HD# ) (resid 223 and name HN ) 4.0 2.2 1.5 ! A.223 at 3.98e+07 assign (resid 222 and name HB1 ) (resid 223 and name HN ) 3.0 1.2 0.5 ! A.214 at 1.44e+08 assign (resid 222 and name HB2 ) (resid 223 and name HN ) 4.0 2.2 1.0 ! A.215 at 1.07e+08 assign (resid 222 and name HA ) (resid 223 and name HN ) 3.0 1.2 0.5 ! A.209 at 7.77e+07 assign (resid 222 and name HB1 ) (resid 224 and name HN ) 4.0 2.2 1.0 ! A.500 at 2.35e+07 assign (resid 222 and name HA ) (resid 226 and name HN ) 4.0 2.2 1.0 ! A.706 at 2.75e+07 ! T23 assign (resid 223 and name HG2# ) (resid 223 and name HN ) 3.0 1.2 1.0 ! A.218 at 1.14e+08 assign (resid 223 and name HB ) (resid 223 and name HN ) 2.5 0.7 0.4 ! A.207 at 2.59e+08 assign (resid 223 and name HN ) (resid 224 and name HN ) 3.0 1.2 0.5 ! A.509 at 9.70e+07 assign (resid 223 and name HG2# ) (resid 224 and name HN ) 3.0 1.2 1.0 ! A.503 at 6.59e+07 assign (resid 223 and name HA ) (resid 224 and name HN ) 4.0 2.2 1.0 ! A.498 at 6.14e+07 assign (resid 223 and name HB ) (resid 224 and name HN ) 3.0 1.2 0.5 ! A.499 at 9.09e+07 assign (resid 223 and name HN ) (resid 224 and name HG11 ) 4.0 2.2 1.0 ! A.216 at 3.38e+07 assign (resid 223 and name HN ) (resid 224 and name HG12 ) 4.0 2.2 1.0 ! A.219 at 2.76e+07 assign (resid 223 and name HA ) (resid 226 and name HN ) 3.0 1.2 0.5 ! A.705 at 6.89e+07 assign (resid 223 and name HG2# ) (resid 226 and name HN ) 4.0 2.2 2.5 ! A.711 at 1.79e+07 assign (resid 223 and name HG2# ) (resid 227 and name HN ) 4.0 2.2 1.5 ! A.793 at 2.37e+07 assign (resid 223 and name HA ) (resid 227 and name HN ) 4.0 2.2 1.0 ! A.798 at 3.23e+07 ! I24 assign (resid 224 and name HG11 ) (resid 224 and name HN ) 3.0 1.2 0.5 ! A.501 at 1.64e+08 assign (resid 224 and name HB ) (resid 224 and name HN ) 3.0 1.2 0.5 ! A.502 at 1.72e+08 assign (resid 224 and name HG12 ) (resid 224 and name HN ) 3.0 1.2 0.5 ! A.505 at 1.68e+08 assign (resid 224 and name HG2# ) (resid 224 and name HN ) 3.0 1.2 1.0 ! A.506 at 9.17e+07 assign (resid 224 and name HN ) (resid 225 and name HN ) 3.0 1.2 0.5 ! A.510 at 9.51e+07 assign (resid 224 and name HG12 ) (resid 225 and name HN ) 3.0 1.2 0.5 ! A.746 at 9.09e+07 assign (resid 224 and name HB ) (resid 225 and name HN ) 3.0 1.2 0.5 ! A.744 at 1.63e+08 assign (resid 224 and name HG2# ) (resid 228 and name HN ) 4.0 2.2 2.5 ! A.521 at 1.83e+07 ! V25 assign (resid 225 and name HG2# ) (resid 225 and name HN ) 2.5 0.7 0.9 ! A.747 at 2.99e+08 assign (resid 225 and name HB ) (resid 225 and name HN ) 2.5 0.7 0.4 ! A.743 at 3.12e+08 assign (resid 225 and name HG1# ) (resid 225 and name HN ) 3.0 1.2 1.0 ! A.749 at 1.00e+08 assign (resid 225 and name HA ) (resid 226 and name HN ) 4.0 2.2 1.0 ! A.707 at 5.96e+07 assign (resid 225 and name HG1# ) (resid 226 and name HN ) 3.0 1.2 1.0 ! A.702 at 8.50e+07 assign (resid 225 and name HG2# ) (resid 226 and name HN ) 3.0 1.2 1.0 ! A.710 at 6.89e+07 assign (resid 225 and name HN ) (resid 263 and name HD2# ) 4.0 2.2 1.5 ! A.745 at 6.12e+07 ! L26 assign (resid 226 and name HB1 ) (resid 226 and name HN ) 3.0 1.2 0.5 ! A.708 at 1.59e+08 assign (resid 226 and name HB1 ) (resid 227 and name HN ) 4.0 2.2 1.0 ! A.801 at 6.32e+07 assign (resid 226 and name HA ) (resid 227 and name HN ) 4.0 2.2 1.0 ! A.799 at 6.08e+07 assign (resid 226 and name HN ) (resid 228 and name HN ) 3.0 1.2 0.5 ! A.515 at 8.58e+07 assign (resid 226 and name HN ) (resid 267 and name HZ ) 4.0 2.2 2.0 ! A.712 at 1.42e+07 ! E27 assign (resid 227 and name HB2 ) (resid 227 and name HN ) 2.5 0.7 0.4 ! A.794 at 2.39e+08 assign (resid 227 and name HG1 ) (resid 227 and name HN ) 3.0 1.2 0.5 ! A.795 at 1.15e+08 assign (resid 227 and name HB1 ) (resid 227 and name HN ) 3.0 1.2 0.5 ! A.803 at 1.10e+08 assign (resid 227 and name HB2 ) (resid 228 and name HN ) 4.0 2.2 1.0 ! A.518 at 3.70e+07 assign (resid 227 and name HA ) (resid 228 and name HN ) 4.0 2.2 1.0 ! A.513 at 5.35e+07 assign (resid 227 and name HN ) (resid 228 and name HB2 ) 4.0 2.2 1.0 ! A.797 at 3.60e+07 assign (resid 227 and name HN ) (resid 235 and name HG1# ) 4.0 2.2 2.5 ! A.792 at 1.93e+07 ! Y28 assign (resid 228 and name HD# ) (resid 228 and name HN ) 4.0 2.2 1.0 ! A.514 at 6.89e+07 assign (resid 228 and name HB1 ) (resid 228 and name HN ) 3.0 1.2 0.5 ! A.517 at 1.60e+08 assign (resid 228 and name HB2 ) (resid 228 and name HN ) 2.5 0.7 0.4 ! A.511 at 1.99e+08 assign (resid 228 and name HN ) (resid 229 and name HN ) 4.0 2.2 1.0 ! A.180 at -6.15e+07 assign (resid 228 and name HD# ) (resid 229 and name HN ) 4.0 2.2 1.0 ! A.178 at -4.60e+07 assign (resid 228 and name HB1 ) (resid 229 and name HN ) 3.0 1.2 0.5 ! A.174 at -7.28e+07 assign (resid 228 and name HA ) (resid 230 and name HN ) 4.0 2.2 1.0 ! A.667 at 2.73e+07 assign (resid 228 and name HN ) (resid 235 and name HG2# ) 4.0 2.2 2.5 ! A.520 at 2.11e+07 assign (resid 228 and name HN ) (resid 235 and name HG1# ) 4.0 2.2 1.5 ! A.519 at 3.19e+07 ! F29 assign (resid 229 and name HB2 ) (resid 229 and name HN ) 3.0 1.2 0.5 ! A.175 at -1.34e+08 assign (resid 229 and name HD# ) (resid 229 and name HN ) 3.0 1.2 0.5 ! A.179 at -9.01e+07 assign (resid 229 and name HN ) (resid 230 and name HN ) 3.0 1.2 0.5 ! A.181 at -9.27e+07 assign (resid 229 and name HB1 ) (resid 230 and name HN ) 4.0 2.2 1.0 ! A.668 at 3.02e+07 assign (resid 229 and name HA ) (resid 230 and name HN ) 3.0 1.2 0.5 ! A.665 at 6.79e+07 ! N30 assign (resid 230 and name HB1 ) (resid 230 and name HD21 ) 4.0 2.2 1.0 ! A.251 at -2.91e+07 assign (resid 230 and name HB1 ) (resid 230 and name HD22 ) 4.0 2.2 1.0 ! A.244 at -3.74e+07 assign (resid 230 and name HB2 ) (resid 230 and name HD22 ) 4.0 2.2 1.0 ! A.245 at -3.99e+07 assign (resid 230 and name HB2 ) (resid 230 and name HD21 ) 4.0 2.2 1.0 ! A.250 at -4.48e+07 assign (resid 230 and name HB2 ) (resid 230 and name HN ) 3.0 1.2 0.5 ! A.656 at 1.58e+08 assign (resid 230 and name HB1 ) (resid 230 and name HN ) 3.0 1.2 0.5 ! A.657 at 1.31e+08 assign (resid 230 and name HD21 ) (resid 233 and name HB# ) 4.0 2.2 2.5 ! A.249 at -2.17e+07 assign (resid 230 and name HD22 ) (resid 233 and name HB# ) 4.0 2.2 2.5 ! A.246 at -2.08e+07 ! T31 ! D32 assign (resid 232 and name HB2 ) (resid 232 and name HN ) 4.0 2.2 2.0 ! A.418 at 1.83e+07 ! A33 assign (resid 233 and name HB# ) (resid 233 and name HN ) 3.0 1.2 1.0 ! A.841 at 1.45e+08 assign (resid 232 and name HA ) (resid 233 and name HN ) 3.0 1.2 0.5 ! A.842 at 4.74e+07 assign (resid 232 and name HB2 ) (resid 233 and name HN ) 4.0 2.2 2.0 ! A.843 at 1.80e+07 assign (resid 232 and name HB1 ) (resid 233 and name HN ) 4.0 2.2 2.0 ! A.844 at 1.67e+07 ! K34 assign (resid 234 and name HG1 ) (resid 235 and name HN ) 4.0 2.2 1.0 ! A.660 at 6.07e+07 ! V35 assign (resid 235 and name HB ) (resid 235 and name HN ) 3.0 1.2 0.5 ! A.669 at 7.64e+07 assign (resid 235 and name HG1# ) (resid 235 and name HN ) 4.0 2.2 1.5 ! A.659 at 4.45e+07 assign (resid 235 and name HG2# ) (resid 235 and name HN ) 3.0 1.2 1.0 ! A.658 at 6.51e+07 assign (resid 235 and name HG1# ) (resid 238 and name HN ) 4.0 2.2 2.5 ! A.314 at 1.82e+07 assign (resid 235 and name HA ) (resid 238 and name HN ) 3.0 1.2 0.5 ! A.304 at 7.74e+07 assign (resid 235 and name HA ) (resid 239 and name HN ) 4.0 2.2 1.0 ! A.409 at 2.87e+07 ! N36 assign (resid 236 and name HA ) (resid 239 and name HN ) 4.0 2.2 1.0 ! A.406 at 6.34e+07 ! E37 assign (resid 237 and name HB# ) (resid 237 and name HN ) 4.0 2.2 1.5 ! A.468 at 4.17e+07 assign (resid 237 and name HG# ) (resid 237 and name HN ) 4.0 2.2 1.5 ! A.469 at 2.57e+07 assign (resid 237 and name HG# ) (resid 238 and name HN ) 4.0 2.2 1.5 ! A.309 at 5.21e+07 assign (resid 237 and name HA ) (resid 238 and name HN ) 3.0 1.2 0.5 ! A.303 at 6.68e+07 assign (resid 237 and name HN ) (resid 238 and name HN ) 3.0 1.2 0.5 ! A.301 at 6.44e+07 ! R38 assign (resid 238 and name HD2 ) (resid 238 and name HN ) 4.0 2.2 2.0 ! A.307 at 1.73e+07 assign (resid 238 and name HD1 ) (resid 238 and name HN ) 4.0 2.2 2.0 ! A.306 at 1.73e+07 assign (resid 238 and name HG# ) (resid 238 and name HN ) 2.5 0.7 0.4 ! A.311 at 2.96e+08 assign (resid 238 and name HB2 ) (resid 238 and name HN ) 2.5 0.7 0.4 ! A.310 at 2.51e+08 assign (resid 238 and name HA ) (resid 239 and name HN ) 4.0 2.2 1.0 ! A.407 at 3.20e+07 assign (resid 238 and name HB2 ) (resid 239 and name HN ) 3.0 1.2 0.5 ! A.416 at 8.55e+07 assign (resid 238 and name HN ) (resid 239 and name HN ) 3.0 1.2 0.5 ! A.410 at 1.18e+08 assign (resid 238 and name HN ) (resid 239 and name HA ) 4.0 2.2 2.0 ! A.305 at 1.81e+07 assign (resid 238 and name HN ) (resid 240 and name HN ) 4.0 2.2 1.0 ! A.482 at 2.98e+07 assign (resid 238 and name HN ) (resid 241 and name HN ) 4.0 2.2 1.0 ! A.300 at 4.36e+07 assign (resid 238 and name HA ) (resid 242 and name HN ) 4.0 2.2 1.0 ! A.331 at 3.13e+07 ! I39 assign (resid 239 and name HB ) (resid 239 and name HN ) 2.5 0.7 0.4 ! A.415 at 3.42e+08 assign (resid 239 and name HN ) (resid 240 and name HN ) 3.0 1.2 0.5 ! A.412 at 1.24e+08 assign (resid 239 and name HN ) (resid 240 and name HB1 ) 4.0 2.2 2.0 ! A.405 at 1.74e+07 assign (resid 239 and name HG2# ) (resid 240 and name HN ) 3.0 1.2 1.0 ! A.478 at 1.03e+08 assign (resid 239 and name HA ) (resid 240 and name HN ) 4.0 2.2 1.0 ! A.470 at 4.95e+07 assign (resid 239 and name HB ) (resid 240 and name HN ) 2.5 0.7 0.4 ! A.476 at 2.42e+08 assign (resid 239 and name HN ) (resid 241 and name HN ) 4.0 2.2 1.0 ! A.594 at 6.12e+07 ! D40 assign (resid 240 and name HB1 ) (resid 240 and name HN ) 2.5 0.7 0.4 ! A.472 at 4.73e+08 assign (resid 240 and name HB1 ) (resid 241 and name HN ) 3.0 1.2 0.5 ! A.585 at 1.62e+08 assign (resid 240 and name HN ) (resid 241 and name HN ) 2.5 0.7 0.4 ! A.595 at 2.10e+08 assign (resid 240 and name HN ) (resid 241 and name HB2 ) 4.0 2.2 1.0 ! A.474 at 5.83e+07 assign (resid 240 and name HN ) (resid 242 and name HN ) 4.0 2.2 1.0 ! A.337 at 2.67e+07 assign (resid 240 and name HA ) (resid 243 and name HN ) 4.0 2.2 1.0 ! A.51 at 5.10e+07 assign (resid 240 and name HA ) (resid 244 and name HN ) 4.0 2.2 1.0 ! A.185 at 4.50e+07 ! E41 assign (resid 241 and name HB2 ) (resid 241 and name HN ) 2.5 0.7 0.4 ! A.583 at 4.47e+08 assign (resid 241 and name HN ) (resid 242 and name HN ) 2.5 0.7 0.4 ! A.593 at 1.86e+08 assign (resid 241 and name HN ) (resid 242 and name HB1 ) 4.0 2.2 1.0 ! A.586 at 2.92e+07 assign (resid 241 and name HB2 ) (resid 242 and name HN ) 3.0 1.2 0.5 ! A.336 at 1.67e+08 assign (resid 241 and name HA ) (resid 242 and name HN ) 3.0 1.2 0.5 ! A.332 at 7.08e+07 assign (resid 241 and name HB2 ) (resid 245 and name HN ) 4.0 2.2 2.0 ! A.556 at 1.98e+07 ! F42 assign (resid 242 and name HB2 ) (resid 242 and name HN ) 3.0 1.2 0.5 ! A.335 at 1.63e+08 assign (resid 242 and name HB1 ) (resid 242 and name HN ) 3.0 1.2 0.5 ! A.334 at 1.60e+08 assign (resid 242 and name HD# ) (resid 242 and name HN ) 4.0 2.2 1.0 ! A.330 at 6.53e+07 assign (resid 242 and name HN ) (resid 243 and name HN ) 3.0 1.2 0.5 ! A.340 at 1.26e+08 assign (resid 242 and name HB2 ) (resid 243 and name HN ) 3.0 1.2 0.5 ! A.49 at 8.09e+07 assign (resid 242 and name HA ) (resid 243 and name HN ) 4.0 2.2 1.0 ! A.50 at 4.63e+07 assign (resid 242 and name HD# ) (resid 243 and name HN ) 4.0 2.2 1.0 ! A.52 at 5.78e+07 assign (resid 242 and name HN ) (resid 244 and name HN ) 3.0 1.2 0.5 ! A.194 at 9.59e+07 assign (resid 242 and name HA ) (resid 245 and name HN ) 4.0 2.2 1.0 ! A.559 at 3.30e+07 assign (resid 242 and name HN ) (resid 245 and name HB2 ) 4.0 2.2 2.0 ! A.343 at 1.63e+07 ! V43 assign (resid 243 and name HG1# ) (resid 243 and name HN ) 3.0 1.2 1.0 ! A.46 at 1.44e+08 assign (resid 243 and name HG2# ) (resid 243 and name HN ) 2.5 0.7 0.9 ! A.47 at 1.96e+08 assign (resid 243 and name HB ) (resid 243 and name HN ) 3.0 1.2 0.5 ! A.48 at 1.70e+08 assign (resid 243 and name HN ) (resid 244 and name HN ) 3.0 1.2 0.5 ! A.53 at 1.04e+08 assign (resid 243 and name HG1# ) (resid 244 and name HN ) 3.0 1.2 1.0 ! A.191 at 8.07e+07 assign (resid 243 and name HB ) (resid 244 and name HN ) 3.0 1.2 0.5 ! A.187 at 1.19e+08 assign (resid 243 and name HA ) (resid 244 and name HN ) 4.0 2.2 1.0 ! A.182 at 4.91e+07 assign (resid 243 and name HG2# ) (resid 244 and name HN ) 3.0 1.2 1.0 ! A.190 at 9.90e+07 assign (resid 243 and name HA ) (resid 245 and name HN ) 4.0 2.2 2.0 ! A.558 at 1.54e+07 assign (resid 243 and name HA ) (resid 246 and name HN ) 4.0 2.2 1.0 ! A.121 at 5.29e+07 assign (resid 243 and name HA ) (resid 247 and name HN ) 4.0 2.2 2.0 ! A.71 at 1.74e+07 assign (resid 243 and name HG2# ) (resid 295 and name HN ) 4.0 2.2 1.5 ! A.153 at 5.32e+07 assign (resid 243 and name HG1# ) (resid 295 and name HN ) 3.0 1.2 1.0 ! A.154 at 8.00e+07 ! S44 assign (resid 244 and name HN ) (resid 245 and name HN ) 3.0 1.2 0.5 ! A.561 at 1.34e+08 assign (resid 244 and name HN ) (resid 245 and name HB2 ) 4.0 2.2 2.0 ! A.189 at 2.00e+07 assign (resid 244 and name HN ) (resid 245 and name HG1 ) 4.0 2.2 1.0 ! A.188 at 2.38e+07 assign (resid 244 and name HN ) (resid 246 and name HN ) 4.0 2.2 2.0 ! A.129 at 1.68e+07 ! K45 assign (resid 245 and name HE# ) (resid 245 and name HN ) 4.0 2.2 2.5 ! A.557 at 1.89e+07 assign (resid 245 and name HB2 ) (resid 245 and name HN ) 2.5 0.7 0.4 ! A.552 at 1.95e+08 assign (resid 245 and name HG2 ) (resid 245 and name HN ) 3.0 1.2 0.5 ! A.554 at 1.03e+08 assign (resid 245 and name HG1 ) (resid 245 and name HN ) 2.5 0.7 0.4 ! A.553 at 2.36e+08 assign (resid 245 and name HB1 ) (resid 246 and name HN ) 3.0 1.2 0.5 ! A.123 at 8.33e+07 assign (resid 245 and name HA ) (resid 246 and name HN ) 4.0 2.2 1.0 ! A.119 at 6.14e+07 assign (resid 245 and name HB2 ) (resid 246 and name HN ) 3.0 1.2 0.5 ! A.122 at 8.45e+07 assign (resid 245 and name HN ) (resid 246 and name HN ) 3.0 1.2 0.5 ! A.128 at 1.31e+08 assign (resid 245 and name HG2 ) (resid 246 and name HN ) 4.0 2.2 1.0 ! A.124 at 4.18e+07 assign (resid 245 and name HN ) (resid 246 and name HB# ) 4.0 2.2 1.5 ! A.555 at 4.21e+07 assign (resid 245 and name HN ) (resid 247 and name HN ) 4.0 2.2 2.0 ! A.76 at 1.43e+07 ! A46 assign (resid 246 and name HB# ) (resid 246 and name HN ) 2.5 0.7 0.9 ! A.125 at 2.83e+08 assign (resid 246 and name HB# ) (resid 247 and name HN ) 3.0 1.2 1.0 ! A.74 at 1.20e+08 assign (resid 246 and name HA ) (resid 247 and name HN ) 4.0 2.2 1.0 ! A.70 at 2.95e+07 assign (resid 246 and name HA ) (resid 249 and name HN ) 4.0 2.2 1.0 ! A.637 at 2.62e+07 assign (resid 246 and name HA ) (resid 251 and name HN ) 4.0 2.2 2.0 ! A.234 at 1.83e+07 assign (resid 246 and name HB# ) (resid 251 and name HN ) 4.0 2.2 1.5 ! A.238 at 3.47e+07 assign (resid 246 and name HN ) (resid 295 and name HD1# ) 4.0 2.2 1.5 ! A.127 at 3.75e+07 ! F47 assign (resid 247 and name HB# ) (resid 247 and name HN ) 3.0 1.2 1.0 ! A.73 at 1.59e+08 assign (resid 247 and name HD# ) (resid 247 and name HN ) 4.0 2.2 1.0 ! A.67 at 3.00e+07 assign (resid 247 and name HD# ) (resid 248 and name HN ) 4.0 2.2 1.0 ! A.444 at 2.63e+07 assign (resid 247 and name HB# ) (resid 248 and name HN ) 3.0 1.2 1.0 ! A.442 at 6.51e+07 assign (resid 247 and name HN ) (resid 248 and name HN ) 3.0 1.2 0.5 ! A.449 at 7.17e+07 assign (resid 247 and name HN ) (resid 248 and name HB# ) 4.0 2.2 1.5 ! A.72 at 2.78e+07 assign (resid 247 and name HN ) (resid 249 and name HN ) 4.0 2.2 2.0 ! A.642 at 2.25e+07 assign (resid 247 and name HN ) (resid 295 and name HD1# ) 4.0 2.2 1.5 ! A.75 at 5.86e+07 ! F48 assign (resid 248 and name HD# ) (resid 248 and name HN ) 4.0 2.2 2.0 ! A.445 at 1.83e+07 assign (resid 248 and name HB# ) (resid 248 and name HN ) 2.5 0.7 0.9 ! A.441 at 2.18e+08 assign (resid 248 and name HN ) (resid 249 and name HN ) 3.0 1.2 0.5 ! A.448 at 8.90e+07 assign (resid 248 and name HB# ) (resid 249 and name HN ) 3.0 1.2 1.0 ! A.636 at 1.05e+08 assign (resid 248 and name HN ) (resid 250 and name HN ) 4.0 2.2 1.0 ! A.696 at 2.87e+07 ! A49 assign (resid 249 and name HB# ) (resid 249 and name HN ) 2.5 0.7 0.9 ! A.635 at 2.56e+08 assign (resid 249 and name HN ) (resid 250 and name HA ) 4.0 2.2 2.0 ! A.639 at 1.92e+07 assign (resid 249 and name HN ) (resid 250 and name HN ) 3.0 1.2 0.5 ! A.640 at 8.92e+07 assign (resid 249 and name HN ) (resid 251 and name HN ) 4.0 2.2 2.0 ! A.236 at 2.07e+07 ! D50 assign (resid 250 and name HB2 ) (resid 250 and name HN ) 4.0 2.2 1.0 ! A.700 at 5.34e+07 assign (resid 250 and name HB1 ) (resid 250 and name HN ) 4.0 2.2 1.0 ! A.699 at 4.66e+07 assign (resid 250 and name HN ) (resid 251 and name HB ) 4.0 2.2 2.0 ! A.714 at 1.57e+07 assign (resid 250 and name HN ) (resid 251 and name HN ) 4.0 2.2 1.0 ! A.713 at 6.24e+07 assign (resid 250 and name HA ) (resid 251 and name HN ) 4.0 2.2 1.0 ! A.229 at 5.12e+07 ! I51 assign (resid 251 and name HD1# ) (resid 251 and name HN ) 4.0 2.2 1.5 ! A.237 at 3.82e+07 assign (resid 251 and name HG11 ) (resid 251 and name HN ) 3.0 1.2 0.5 ! A.225 at 1.19e+08 assign (resid 251 and name HB ) (resid 251 and name HN ) 3.0 1.2 0.5 ! A.224 at 8.44e+07 assign (resid 251 and name HG2# ) (resid 251 and name HN ) 3.0 1.2 1.0 ! A.227 at 7.18e+07 assign (resid 251 and name HG12 ) (resid 251 and name HN ) 4.0 2.2 1.0 ! A.226 at 4.76e+07 assign (resid 251 and name HD1# ) (resid 252 and name HN ) 4.0 2.2 1.5 ! A.329 at 2.52e+07 assign (resid 251 and name HA ) (resid 252 and name HN ) 2.5 0.7 0.4 ! A.323 at 2.55e+08 assign (resid 251 and name HG2# ) (resid 252 and name HN ) 3.0 1.2 1.0 ! A.319 at 1.25e+08 assign (resid 251 and name HN ) (resid 252 and name HN ) 4.0 2.2 1.0 ! A.324 at 2.80e+07 assign (resid 251 and name HN ) (resid 252 and name HA ) 4.0 2.2 1.0 ! A.233 at 3.88e+07 assign (resid 251 and name HG2# ) (resid 255 and name HN ) 4.0 2.2 1.5 ! A.580 at 4.70e+07 assign (resid 251 and name HD1# ) (resid 256 and name HN ) 4.0 2.2 1.5 ! A.565 at 3.02e+07 ! S52 assign (resid 252 and name HB2 ) (resid 252 and name HN ) 4.0 2.2 1.0 ! A.322 at 5.32e+07 assign (resid 252 and name HB2 ) (resid 253 and name HN ) 4.0 2.2 1.0 ! A.30 at 3.44e+07 assign (resid 252 and name HB1 ) (resid 253 and name HN ) 4.0 2.2 1.0 ! A.28 at 4.41e+07 assign (resid 252 and name HA ) (resid 253 and name HN ) 2.5 0.7 0.4 ! A.29 at 3.45e+08 assign (resid 252 and name HA ) (resid 255 and name HN ) 4.0 2.2 1.0 ! A.592 at 1.41e+08 assign (resid 252 and name HB1 ) (resid 255 and name HN ) 3.0 1.2 0.5 ! A.590 at 1.31e+08 ! V53 assign (resid 253 and name HG2# ) (resid 253 and name HN ) 3.0 1.2 1.0 ! A.33 at 9.98e+07 assign (resid 253 and name HG1# ) (resid 253 and name HN ) 4.0 2.2 1.5 ! A.34 at 5.15e+07 assign (resid 253 and name HA ) (resid 256 and name HN ) 4.0 2.2 1.0 ! A.587 at 2.55e+07 ! S54 assign (resid 254 and name HA ) (resid 256 and name HN ) 4.0 2.2 1.0 ! A.575 at 3.94e+07 ! Q55 assign (resid 255 and name HB1 ) (resid 255 and name HN ) 3.0 1.2 0.5 ! A.582 at 1.09e+08 assign (resid 255 and name HB2 ) (resid 255 and name HN ) 2.5 0.7 0.4 ! A.584 at 2.65e+08 assign (resid 255 and name HB1 ) (resid 256 and name HN ) 4.0 2.2 1.0 ! A.570 at 5.92e+07 assign (resid 255 and name HA ) (resid 256 and name HN ) 4.0 2.2 1.0 ! A.576 at 5.63e+07 assign (resid 255 and name HB2 ) (resid 256 and name HN ) 3.0 1.2 0.5 ! A.572 at 7.83e+07 assign (resid 255 and name HN ) (resid 257 and name HB2 ) 4.0 2.2 1.0 ! A.581 at 3.75e+07 assign (resid 255 and name HA ) (resid 258 and name HN ) 3.0 1.2 0.5 ! A.735 at 8.75e+07 assign (resid 255 and name HA ) (resid 259 and name HN ) 4.0 2.2 1.0 ! A.600 at 2.31e+07 ! V56 assign (resid 256 and name HG1# ) (resid 256 and name HN ) 3.0 1.2 1.0 ! A.563 at 1.38e+08 assign (resid 256 and name HB ) (resid 256 and name HN ) 2.5 0.7 0.4 ! A.571 at 2.48e+08 assign (resid 256 and name HG2# ) (resid 256 and name HN ) 2.5 0.7 0.9 ! A.566 at 3.02e+08 assign (resid 256 and name HN ) (resid 257 and name HG ) 4.0 2.2 1.0 ! A.568 at 3.38e+07 assign (resid 256 and name HN ) (resid 257 and name HB2 ) 4.0 2.2 1.0 ! A.569 at 4.46e+07 assign (resid 256 and name HN ) (resid 257 and name HN ) 3.0 1.2 0.5 ! A.578 at 1.55e+08 assign (resid 256 and name HB ) (resid 257 and name HN ) 3.0 1.2 0.5 ! A.459 at 9.06e+07 assign (resid 256 and name HG2# ) (resid 257 and name HN ) 4.0 2.2 1.5 ! A.456 at 5.01e+07 assign (resid 256 and name HA ) (resid 257 and name HN ) 4.0 2.2 1.0 ! A.460 at 2.93e+07 assign (resid 256 and name HA ) (resid 258 and name HN ) 4.0 2.2 2.0 ! A.733 at 1.76e+07 assign (resid 256 and name HA ) (resid 259 and name HN ) 3.0 1.2 0.5 ! A.603 at 7.41e+07 assign (resid 256 and name HA ) (resid 260 and name HN ) 4.0 2.2 1.0 ! A.676 at 3.68e+07 ! L57 assign (resid 257 and name HD2# ) (resid 257 and name HN ) 3.0 1.2 1.0 ! A.477 at 6.82e+07 assign (resid 257 and name HB2 ) (resid 257 and name HN ) 3.0 1.2 0.5 ! A.458 at 1.09e+08 assign (resid 257 and name HB1 ) (resid 257 and name HN ) 3.0 1.2 0.5 ! A.457 at 1.38e+08 assign (resid 257 and name HN ) (resid 258 and name HN ) 3.0 1.2 0.5 ! A.454 at 9.21e+07 assign (resid 257 and name HD2# ) (resid 258 and name HN ) 3.0 1.2 1.0 ! A.730 at 7.61e+07 assign (resid 257 and name HB2 ) (resid 258 and name HN ) 3.0 1.2 0.5 ! A.727 at 1.32e+08 assign (resid 257 and name HB1 ) (resid 258 and name HN ) 3.0 1.2 0.5 ! A.728 at 1.01e+08 assign (resid 257 and name HN ) (resid 259 and name HN ) 4.0 2.2 1.0 ! A.597 at 3.42e+07 assign (resid 257 and name HA ) (resid 260 and name HN ) 4.0 2.2 1.0 ! A.678 at 4.22e+07 assign (resid 257 and name HN ) (resid 260 and name HN ) 4.0 2.2 1.0 ! A.683 at 3.17e+07 ! E58 assign (resid 258 and name HG1 ) (resid 258 and name HN ) 3.0 1.2 0.5 ! A.732 at 1.49e+08 assign (resid 258 and name HN ) (resid 259 and name HN ) 3.0 1.2 0.5 ! A.599 at 1.52e+08 assign (resid 258 and name HA ) (resid 259 and name HN ) 4.0 2.2 1.0 ! A.601 at 5.97e+07 assign (resid 258 and name HG1 ) (resid 259 and name HN ) 4.0 2.2 1.0 ! A.606 at 2.82e+07 assign (resid 258 and name HB2 ) (resid 259 and name HN ) 3.0 1.2 0.5 ! A.607 at 1.27e+08 assign (resid 258 and name HN ) (resid 259 and name HG12 ) 4.0 2.2 2.0 ! A.729 at 2.28e+07 assign (resid 258 and name HN ) (resid 260 and name HN ) 3.0 1.2 0.5 ! A.737 at 9.63e+07 assign (resid 258 and name HA ) (resid 261 and name HN ) 3.0 1.2 0.5 ! A.98 at 7.09e+07 assign (resid 258 and name HN ) (resid 261 and name HG2# ) 4.0 2.2 2.5 ! A.731 at 2.25e+07 assign (resid 258 and name HA ) (resid 262 and name HN ) 4.0 2.2 1.0 ! A.429 at 4.04e+07 ! I59 assign (resid 259 and name HG12 ) (resid 259 and name HN ) 3.0 1.2 0.5 ! A.610 at 1.22e+08 assign (resid 259 and name HG2# ) (resid 259 and name HN ) 3.0 1.2 1.0 ! A.609 at 1.78e+08 assign (resid 259 and name HB ) (resid 259 and name HN ) 2.5 0.7 0.4 ! A.608 at 3.09e+08 assign (resid 259 and name HG12 ) (resid 260 and name HN ) 4.0 2.2 1.0 ! A.673 at 2.48e+07 assign (resid 259 and name HN ) (resid 260 and name HN ) 3.0 1.2 0.5 ! A.681 at 7.98e+07 assign (resid 259 and name HB ) (resid 260 and name HN ) 3.0 1.2 0.5 ! A.672 at 1.02e+08 assign (resid 259 and name HA ) (resid 260 and name HN ) 4.0 2.2 1.0 ! A.677 at 3.68e+07 assign (resid 259 and name HN ) (resid 260 and name HB2 ) 4.0 2.2 2.0 ! A.605 at 2.03e+07 assign (resid 259 and name HN ) (resid 260 and name HB1 ) 4.0 2.2 2.0 ! A.604 at 2.01e+07 assign (resid 259 and name HN ) (resid 261 and name HN ) 4.0 2.2 2.0 ! A.598 at 1.74e+07 assign (resid 259 and name HG2# ) (resid 261 and name HN ) 4.0 2.2 1.5 ! A.107 at 2.43e+07 assign (resid 259 and name HB ) (resid 261 and name HN ) 4.0 2.2 2.0 ! A.103 at 1.81e+07 assign (resid 259 and name HA ) (resid 262 and name HN ) 4.0 2.2 1.0 ! A.430 at 3.80e+07 assign (resid 259 and name HG2# ) (resid 262 and name HN ) 4.0 2.2 2.5 ! A.438 at 2.26e+07 assign (resid 259 and name HA ) (resid 263 and name HN ) 4.0 2.2 1.0 ! A.530 at 2.76e+07 ! H60 assign (resid 260 and name HB1 ) (resid 260 and name HN ) 3.0 1.2 0.5 ! A.675 at 1.24e+08 assign (resid 260 and name HB2 ) (resid 260 and name HN ) 3.0 1.2 0.5 ! A.670 at 1.32e+08 assign (resid 260 and name HN ) (resid 261 and name HN ) 3.0 1.2 0.5 ! A.682 at 7.78e+07 assign (resid 260 and name HB1 ) (resid 261 and name HN ) 3.0 1.2 0.5 ! A.101 at 8.44e+07 assign (resid 260 and name HB2 ) (resid 261 and name HN ) 3.0 1.2 0.5 ! A.105 at 6.82e+07 assign (resid 260 and name HD2 ) (resid 261 and name HN ) 4.0 2.2 1.0 ! A.93 at 3.03e+07 assign (resid 260 and name HA ) (resid 261 and name HN ) 4.0 2.2 1.0 ! A.97 at 5.15e+07 assign (resid 260 and name HB2 ) (resid 263 and name HN ) 4.0 2.2 2.0 ! A.528 at 1.65e+07 assign (resid 260 and name HB2 ) (resid 288 and name HN ) 4.0 2.2 2.0 ! A.278 at 1.71e+07 assign (resid 260 and name HE1 ) (resid 288 and name HN ) 4.0 2.2 2.0 ! A.275 at 2.16e+07 ! V61 assign (resid 261 and name HG2# ) (resid 261 and name HN ) 2.5 0.7 0.9 ! A.106 at 2.30e+08 assign (resid 261 and name HB ) (resid 261 and name HN ) 2.5 0.7 0.4 ! A.104 at 2.38e+08 assign (resid 261 and name HG1# ) (resid 261 and name HN ) 3.0 1.2 1.0 ! A.100 at 1.01e+08 assign (resid 261 and name HG2# ) (resid 262 and name HN ) 3.0 1.2 1.0 ! A.436 at 6.99e+07 assign (resid 261 and name HG1# ) (resid 262 and name HN ) 3.0 1.2 1.0 ! A.437 at 8.33e+07 assign (resid 261 and name HN ) (resid 262 and name HN ) 3.0 1.2 0.5 ! A.440 at 1.32e+08 assign (resid 261 and name HA ) (resid 262 and name HN ) 4.0 2.2 1.0 ! A.431 at 4.75e+07 assign (resid 261 and name HA ) (resid 263 and name HN ) 4.0 2.2 1.0 ! A.529 at 2.41e+07 assign (resid 261 and name HA ) (resid 264 and name HN ) 4.0 2.2 1.0 ! A.82 at 6.05e+07 assign (resid 261 and name HA ) (resid 265 and name HN ) 4.0 2.2 1.0 ! A.351 at 2.50e+07 ! E62 assign (resid 262 and name HG1 ) (resid 262 and name HN ) 4.0 2.2 1.0 ! A.433 at 1.05e+08 (widened1) assign (resid 262 and name HG1 ) (resid 263 and name HN ) 4.0 2.2 1.0 ! A.523 at 2.61e+07 assign (resid 262 and name HB1 ) (resid 263 and name HN ) 2.5 0.7 0.4 ! A.524 at 1.96e+08 assign (resid 262 and name HN ) (resid 263 and name HN ) 2.5 0.7 0.4 ! A.532 at 2.02e+08 assign (resid 262 and name HN ) (resid 263 and name HB# ) 4.0 2.2 1.5 ! A.435 at 2.80e+07 assign (resid 262 and name HN ) (resid 264 and name HN ) 4.0 2.2 1.0 ! A.87 at 2.35e+07 assign (resid 262 and name HA ) (resid 265 and name HN ) 3.0 1.2 0.5 ! A.352 at 1.13e+08 assign (resid 262 and name HN ) (resid 265 and name HB2 ) 4.0 2.2 2.0 ! A.432 at 1.66e+07 ! L63 assign (resid 263 and name HG ) (resid 263 and name HN ) 4.0 2.2 1.0 ! A.527 at 4.20e+07 assign (resid 263 and name HB# ) (resid 263 and name HN ) 2.5 0.7 0.9 ! A.525 at 4.19e+08 assign (resid 263 and name HN ) (resid 264 and name HN ) 2.5 0.7 0.4 ! A.533 at 1.88e+08 assign (resid 263 and name HG ) (resid 264 and name HN ) 4.0 2.2 1.0 ! A.89 at 3.47e+07 assign (resid 263 and name HD2# ) (resid 264 and name HN ) 4.0 2.2 1.5 ! A.85 at 3.67e+07 assign (resid 263 and name HB# ) (resid 265 and name HN ) 4.0 2.2 2.5 ! A.358 at 2.03e+07 assign (resid 263 and name HN ) (resid 265 and name HN ) 3.0 1.2 0.5 ! A.531 at 6.99e+07 assign (resid 263 and name HD1# ) (resid 267 and name HN ) 4.0 2.2 1.5 ! A.139 at 3.14e+07 ! M64 assign (resid 264 and name HG1 ) (resid 264 and name HN ) 3.0 1.2 0.5 ! A.83 at 7.53e+07 assign (resid 264 and name HB2 ) (resid 264 and name HN ) 3.0 1.2 0.5 ! A.84 at 1.16e+08 assign (resid 264 and name HN ) (resid 265 and name HN ) 3.0 1.2 0.5 ! A.354 at 1.40e+08 assign (resid 264 and name HB1 ) (resid 265 and name HN ) 4.0 2.2 1.0 ! A.356 at 3.71e+07 assign (resid 264 and name HB2 ) (resid 265 and name HN ) 3.0 1.2 0.5 ! A.355 at 7.37e+07 assign (resid 264 and name HB1 ) (resid 266 and name HN ) 4.0 2.2 2.0 ! A.814 at 1.47e+07 assign (resid 264 and name HN ) (resid 281 and name HD1# ) 4.0 2.2 2.5 ! A.91 at 1.54e+07 ! D65 assign (resid 265 and name HB1 ) (resid 265 and name HN ) 2.5 0.7 0.4 ! A.350 at 3.65e+08 assign (resid 265 and name HB2 ) (resid 266 and name HN ) 3.0 1.2 0.5 ! A.805 at 1.41e+08 assign (resid 265 and name HN ) (resid 266 and name HN ) 3.0 1.2 0.5 ! A.810 at 1.25e+08 ! T66 assign (resid 266 and name HB ) (resid 266 and name HN ) 2.5 0.7 0.4 ! A.808 at 1.92e+08 assign (resid 266 and name HG2# ) (resid 266 and name HN ) 3.0 1.2 1.0 ! A.806 at 9.52e+07 assign (resid 266 and name HN ) (resid 267 and name HN ) 3.0 1.2 0.5 ! A.131 at 1.20e+08 assign (resid 266 and name HG2# ) (resid 267 and name HN ) 4.0 2.2 1.5 ! A.137 at 6.07e+07 assign (resid 266 and name HB ) (resid 267 and name HN ) 3.0 1.2 0.5 ! A.133 at 1.63e+08 assign (resid 266 and name HA ) (resid 269 and name HN ) 3.0 1.2 0.5 ! A.644 at 8.61e+07 assign (resid 266 and name HN ) (resid 269 and name HG1 ) 4.0 2.2 2.0 ! A.815 at 1.48e+07 ! F67 assign (resid 267 and name HD# ) (resid 267 and name HN ) 4.0 2.2 1.0 ! A.130 at 4.33e+07 assign (resid 267 and name HB2 ) (resid 267 and name HN ) 3.0 1.2 0.5 ! A.135 at 1.71e+08 assign (resid 267 and name HB1 ) (resid 267 and name HN ) 3.0 1.2 0.5 ! A.136 at 1.27e+08 assign (resid 267 and name HN ) (resid 281 and name HD1# ) 4.0 2.2 1.5 ! A.138 at 2.90e+07 ! S68 ! K69 assign (resid 269 and name HB# ) (resid 269 and name HN ) 3.0 1.2 1.0 ! A.645 at 9.72e+07 assign (resid 269 and name HG1 ) (resid 269 and name HN ) 4.0 2.2 1.0 ! A.646 at 5.60e+07 assign (resid 269 and name HG2 ) (resid 269 and name HN ) 4.0 2.2 2.0 ! A.647 at 2.20e+07 ! Q70 assign (resid 270 and name HG1 ) (resid 270 and name HN ) 4.0 2.2 1.0 ! A.633 at 2.73e+07 assign (resid 270 and name HB# ) (resid 270 and name HN ) 3.0 1.2 1.0 ! A.634 at 1.31e+08 assign (resid 270 and name HB# ) (resid 271 and name HN ) 4.0 2.2 1.5 ! A.400 at 4.88e+07 assign (resid 270 and name HN ) (resid 271 and name HN ) 4.0 2.2 2.0 ! A.399 at 1.68e+07 assign (resid 270 and name HE22 ) (resid 274 and name HG1 ) 4.0 2.2 2.0 ! A.253 at -1.97e+07 ! L71 assign (resid 271 and name HD2# ) (resid 271 and name HN ) 4.0 2.2 1.5 ! A.401 at 5.53e+07 assign (resid 271 and name HB2 ) (resid 271 and name HN ) 3.0 1.2 0.5 ! A.398 at 1.18e+08 assign (resid 271 and name HB1 ) (resid 271 and name HN ) 4.0 2.2 1.0 ! A.397 at 4.47e+07 assign (resid 271 and name HN ) (resid 272 and name HN ) 4.0 2.2 1.0 ! A.170 at 2.63e+07 assign (resid 271 and name HD2# ) (resid 272 and name HN ) 4.0 2.2 1.5 ! A.169 at 2.63e+07 assign (resid 271 and name HB1 ) (resid 272 and name HN ) 4.0 2.2 1.0 ! A.168 at 5.58e+07 assign (resid 271 and name HA ) (resid 272 and name HN ) 4.0 2.2 1.0 ! A.165 at 4.92e+07 assign (resid 271 and name HN ) (resid 274 and name HG1 ) 4.0 2.2 2.0 ! A.402 at 2.03e+07 assign (resid 271 and name HG ) (resid 280 and name HN ) 4.0 2.2 2.0 ! A.689 at 1.99e+07 assign (resid 271 and name HG ) (resid 281 and name HN ) 3.0 1.2 0.5 ! A.650 at 1.12e+08 ! K72 assign (resid 272 and name HG1 ) (resid 272 and name HN ) 4.0 2.2 1.0 ! A.167 at 6.27e+07 assign (resid 272 and name HB# ) (resid 272 and name HN ) 3.0 1.2 1.0 ! A.166 at 1.80e+08 assign (resid 272 and name HN ) (resid 273 and name HN ) 4.0 2.2 1.0 ! A.551 at 3.66e+07 ! L73 assign (resid 273 and name HB2 ) (resid 273 and name HN ) 2.5 0.7 0.4 ! A.548 at 1.87e+08 assign (resid 273 and name HB1 ) (resid 273 and name HN ) 3.0 1.2 0.5 ! A.547 at 1.16e+08 assign (resid 273 and name HN ) (resid 274 and name HG2 ) 4.0 2.2 1.0 ! A.549 at 2.78e+07 ! E74 assign (resid 274 and name HB2 ) (resid 274 and name HN ) 3.0 1.2 0.5 ! A.763 at 7.76e+07 assign (resid 274 and name HB1 ) (resid 274 and name HN ) 4.0 2.2 1.0 ! A.762 at 4.47e+07 assign (resid 274 and name HG1 ) (resid 274 and name HN ) 4.0 2.2 1.0 ! A.761 at 5.22e+07 ! G75 assign (resid 275 and name HA1 ) (resid 276 and name HN ) 4.0 2.2 1.0 ! A.461 at 4.10e+07 ! R76 assign (resid 276 and name HD# ) (resid 276 and name HN ) 4.0 2.2 2.5 ! A.471 at 2.10e+07 ! S77 ! E78 assign (resid 278 and name HA ) (resid 279 and name HN ) 4.0 2.2 1.0 ! A.345 at 4.90e+07 ! D79 assign (resid 279 and name HB2 ) (resid 279 and name HN ) 4.0 2.2 1.0 ! A.344 at 5.81e+07 assign (resid 279 and name HN ) (resid 280 and name HN ) 4.0 2.2 2.0 ! A.694 at 1.86e+07 assign (resid 279 and name HA ) (resid 280 and name HN ) 3.0 1.2 0.5 ! A.684 at 6.46e+07 assign (resid 279 and name HB2 ) (resid 280 and name HN ) 4.0 2.2 1.0 ! A.686 at 3.74e+07 ! I80 assign (resid 280 and name HG11 ) (resid 280 and name HN ) 4.0 2.2 1.0 ! A.690 at 3.69e+07 assign (resid 280 and name HG12 ) (resid 280 and name HN ) 4.0 2.2 1.0 ! A.691 at 6.96e+07 (widened1) assign (resid 280 and name HB ) (resid 280 and name HN ) 3.0 1.2 0.5 ! A.688 at 1.34e+08 assign (resid 280 and name HG2# ) (resid 280 and name HN ) 3.0 1.2 1.0 ! A.692 at 1.63e+08 assign (resid 280 and name HA ) (resid 281 and name HN ) 4.0 2.2 1.0 ! A.651 at 4.28e+07 assign (resid 280 and name HG2# ) (resid 281 and name HN ) 4.0 2.2 1.5 ! A.649 at 3.87e+07 assign (resid 280 and name HN ) (resid 281 and name HN ) 4.0 2.2 1.0 ! A.693 at 5.55e+07 assign (resid 280 and name HG12 ) (resid 283 and name HN ) 4.0 2.2 1.0 ! A.618 at 4.02e+07 ! L81 assign (resid 281 and name HD1# ) (resid 281 and name HN ) 4.0 2.2 1.5 ! A.648 at 4.97e+07 ! L82 assign (resid 282 and name HB# ) (resid 282 and name HN ) 3.0 1.2 1.0 ! A.611 at 1.49e+08 assign (resid 282 and name HD2# ) (resid 283 and name HN ) 4.0 2.2 1.5 ! A.619 at 3.67e+07 assign (resid 282 and name HB# ) (resid 283 and name HN ) 4.0 2.2 1.5 ! A.617 at 5.74e+07 assign (resid 282 and name HD1# ) (resid 283 and name HN ) 4.0 2.2 1.5 ! A.620 at 2.44e+07 ! D83 assign (resid 283 and name HB2 ) (resid 283 and name HN ) 3.0 1.2 0.5 ! A.616 at 7.03e+07 assign (resid 283 and name HB1 ) (resid 283 and name HN ) 3.0 1.2 0.5 ! A.615 at 9.01e+07 assign (resid 283 and name HB2 ) (resid 286 and name HN ) 4.0 2.2 2.0 ! A.770 at 1.69e+07 ! Y84 assign (resid 284 and name HB2 ) (resid 285 and name HN ) 4.0 2.2 2.0 ! A.404 at 2.24e+07 assign (resid 284 and name HA ) (resid 286 and name HN ) 4.0 2.2 1.0 ! A.768 at 2.53e+07 assign (resid 284 and name HD# ) (resid 287 and name HN ) 4.0 2.2 2.0 ! A.267 at 2.05e+07 assign (resid 284 and name HA ) (resid 287 and name HN ) 3.0 1.2 0.5 ! A.265 at 7.35e+07 ! R85 assign (resid 285 and name HG# ) (resid 286 and name HN ) 4.0 2.2 1.5 ! A.773 at 2.82e+07 assign (resid 285 and name HN ) (resid 286 and name HN ) 4.0 2.2 1.0 ! A.765 at 4.04e+07 ! L86 assign (resid 286 and name HD1# ) (resid 286 and name HN ) 4.0 2.2 1.5 ! A.774 at 4.76e+07 assign (resid 286 and name HD2# ) (resid 286 and name HN ) 4.0 2.2 1.5 ! A.775 at 4.76e+07 assign (resid 286 and name HG ) (resid 286 and name HN ) 2.5 0.7 0.4 ! A.772 at 1.99e+08 assign (resid 286 and name HB2 ) (resid 286 and name HN ) 3.0 1.2 0.5 ! A.771 at 1.15e+08 assign (resid 286 and name HN ) (resid 287 and name HN ) 3.0 1.2 0.5 ! A.764 at 6.98e+07 assign (resid 286 and name HD1# ) (resid 287 and name HN ) 4.0 2.2 2.5 ! A.270 at 2.25e+07 assign (resid 286 and name HB1 ) (resid 287 and name HN ) 3.0 1.2 0.5 ! A.260 at 7.45e+07 assign (resid 286 and name HB2 ) (resid 287 and name HN ) 4.0 2.2 1.0 ! A.261 at 6.19e+07 assign (resid 286 and name HN ) (resid 289 and name HD1# ) 4.0 2.2 1.5 ! A.777 at 2.57e+07 assign (resid 286 and name HA ) (resid 290 and name HN ) 4.0 2.2 1.0 ! A.628 at 2.99e+07 ! T87 assign (resid 287 and name HB ) (resid 287 and name HN ) 3.0 1.2 0.5 ! A.263 at 1.43e+08 assign (resid 287 and name HG2# ) (resid 287 and name HN ) 4.0 2.2 1.5 ! A.272 at 4.78e+07 assign (resid 287 and name HN ) (resid 288 and name HN ) 4.0 2.2 1.0 ! A.274 at 6.30e+07 assign (resid 287 and name HA ) (resid 288 and name HN ) 4.0 2.2 2.0 ! A.279 at 1.51e+07 assign (resid 287 and name HN ) (resid 288 and name HB2 ) 4.0 2.2 1.0 ! A.271 at 2.47e+07 ! L88 assign (resid 288 and name HB1 ) (resid 288 and name HN ) 3.0 1.2 0.5 ! A.281 at 9.06e+07 assign (resid 288 and name HB2 ) (resid 288 and name HN ) 3.0 1.2 0.5 ! A.282 at 9.55e+07 assign (resid 288 and name HD1# ) (resid 288 and name HN ) 4.0 2.2 1.5 ! A.284 at 3.48e+07 assign (resid 288 and name HG ) (resid 288 and name HN ) 4.0 2.2 1.0 ! A.283 at 2.68e+07 assign (resid 288 and name HN ) (resid 289 and name HN ) 4.0 2.2 1.0 ! A.276 at 4.25e+07 assign (resid 288 and name HB1 ) (resid 289 and name HN ) 4.0 2.2 1.0 ! A.717 at 5.01e+07 assign (resid 288 and name HB2 ) (resid 289 and name HN ) 4.0 2.2 1.0 ! A.719 at 4.33e+07 assign (resid 288 and name HG ) (resid 289 and name HN ) 4.0 2.2 1.0 ! A.718 at 2.37e+07 assign (resid 288 and name HD1# ) (resid 289 and name HN ) 4.0 2.2 1.5 ! A.722 at 2.67e+07 assign (resid 288 and name HA ) (resid 291 and name HN ) 4.0 2.2 1.0 ! A.384 at 3.69e+07 ! I89 assign (resid 289 and name HG11 ) (resid 289 and name HN ) 2.5 0.7 0.4 ! A.716 at 1.90e+08 assign (resid 289 and name HG12 ) (resid 289 and name HN ) 3.0 1.2 0.5 ! A.721 at 7.11e+07 assign (resid 289 and name HB ) (resid 290 and name HN ) 3.0 1.2 0.5 ! A.624 at 9.69e+07 assign (resid 289 and name HG2# ) (resid 290 and name HN ) 3.0 1.2 1.0 ! A.626 at 9.67e+07 assign (resid 289 and name HA ) (resid 290 and name HN ) 4.0 2.2 2.0 ! A.627 at 2.08e+07 assign (resid 289 and name HA ) (resid 291 and name HN ) 4.0 2.2 2.0 ! A.395 at 1.70e+07 assign (resid 289 and name HA ) (resid 292 and name HN ) 4.0 2.2 2.0 ! A.57 at 1.95e+07 assign (resid 289 and name HA ) (resid 293 and name HN ) 4.0 2.2 2.0 ! A.6 at -2.10e+07 ! D90 assign (resid 290 and name HB# ) (resid 290 and name HN ) 2.5 0.7 0.9 ! A.623 at 1.85e+08 assign (resid 290 and name HN ) (resid 291 and name HN ) 3.0 1.2 0.5 ! A.629 at 8.05e+07 assign (resid 290 and name HB# ) (resid 291 and name HN ) 3.0 1.2 1.0 ! A.387 at 7.68e+07 assign (resid 290 and name HA ) (resid 291 and name HN ) 4.0 2.2 1.0 ! A.385 at 2.85e+07 assign (resid 290 and name HA ) (resid 293 and name HN ) 4.0 2.2 1.0 ! A.7 at -2.77e+07 ! V91 assign (resid 291 and name HG2# ) (resid 291 and name HN ) 3.0 1.2 1.0 ! A.389 at 1.72e+08 assign (resid 291 and name HG1# ) (resid 291 and name HN ) 3.0 1.2 1.0 ! A.390 at 1.00e+08 assign (resid 291 and name HB ) (resid 291 and name HN ) 3.0 1.2 0.5 ! A.388 at 1.50e+08 assign (resid 291 and name HN ) (resid 292 and name HN ) 3.0 1.2 0.5 ! A.391 at 7.99e+07 assign (resid 291 and name HB ) (resid 292 and name HN ) 4.0 2.2 1.0 ! A.59 at 5.89e+07 assign (resid 291 and name HA ) (resid 292 and name HN ) 4.0 2.2 1.0 ! A.56 at 2.32e+07 assign (resid 291 and name HG1# ) (resid 292 and name HN ) 3.0 1.2 1.0 ! A.64 at 1.52e+08 assign (resid 291 and name HA ) (resid 294 and name HN ) 4.0 2.2 1.0 ! A.817 at 4.34e+07 assign (resid 291 and name HA ) (resid 295 and name HN ) 4.0 2.2 1.0 ! A.158 at 2.76e+07 ! I92 assign (resid 292 and name HG11 ) (resid 292 and name HN ) 3.0 1.2 0.5 ! A.61 at 6.98e+07 assign (resid 292 and name HG12 ) (resid 292 and name HN ) 4.0 2.2 1.0 ! A.63 at 5.43e+07 assign (resid 292 and name HG2# ) (resid 292 and name HN ) 3.0 1.2 1.0 ! A.65 at 1.15e+08 assign (resid 292 and name HB ) (resid 292 and name HN ) 3.0 1.2 0.5 ! A.60 at 7.92e+07 assign (resid 292 and name HN ) (resid 293 and name HB# ) 4.0 2.2 1.5 ! A.62 at 2.68e+07 assign (resid 292 and name HG11 ) (resid 293 and name HN ) 4.0 2.2 1.0 ! A.5 at -3.54e+07 assign (resid 292 and name HN ) (resid 293 and name HN ) 3.0 1.2 0.5 ! A.3 at -6.77e+07 assign (resid 292 and name HG2# ) (resid 293 and name HN ) 3.0 1.2 1.0 ! A.11 at -7.11e+07 assign (resid 292 and name HG12 ) (resid 293 and name HN ) 4.0 2.2 1.0 ! A.10 at -3.14e+07 assign (resid 292 and name HB ) (resid 293 and name HN ) 4.0 2.2 1.0 ! A.8 at -5.53e+07 assign (resid 292 and name HG2# ) (resid 294 and name HN ) 4.0 2.2 2.5 ! A.821 at 2.25e+07 assign (resid 292 and name HA ) (resid 295 and name HN ) 3.0 1.2 0.5 ! A.160 at 6.41e+07 assign (resid 292 and name HA ) (resid 296 and name HN ) 4.0 2.2 1.0 ! A.39 at 3.74e+07 ! A93 assign (resid 293 and name HB# ) (resid 293 and name HN ) 2.5 0.7 0.9 ! A.4 at -2.47e+08 assign (resid 293 and name HB# ) (resid 294 and name HN ) 3.0 1.2 1.0 ! A.822 at 1.68e+08 assign (resid 293 and name HN ) (resid 294 and name HN ) 3.0 1.2 0.5 ! A.820 at 1.23e+08 assign (resid 293 and name HN ) (resid 295 and name HN ) 4.0 2.2 2.0 ! A.78 at -1.55e+07 assign (resid 293 and name HN ) (resid 296 and name HB2 ) 4.0 2.2 2.0 ! A.12 at -1.36e+07 ! H94 assign (resid 294 and name HB# ) (resid 294 and name HN ) 2.5 0.7 0.9 ! A.816 at 1.81e+08 assign (resid 294 and name HA ) (resid 295 and name HN ) 4.0 2.2 1.0 ! A.161 at 3.92e+07 assign (resid 294 and name HB# ) (resid 295 and name HN ) 3.0 1.2 1.0 ! A.157 at 6.92e+07 assign (resid 294 and name HN ) (resid 295 and name HN ) 3.0 1.2 0.5 ! A.162 at 1.18e+08 assign (resid 294 and name HA ) (resid 296 and name HN ) 4.0 2.2 1.0 ! A.42 at 2.39e+07 assign (resid 294 and name HA ) (resid 297 and name HN ) 4.0 2.2 2.0 ! A.494 at 1.94e+07 assign (resid 294 and name HA ) (resid 298 and name HN ) 4.0 2.2 2.0 ! A.292 at 2.16e+07 ! L95 assign (resid 295 and name HB1 ) (resid 295 and name HN ) 3.0 1.2 0.5 ! A.155 at 1.44e+08 assign (resid 295 and name HD2# ) (resid 295 and name HN ) 3.0 1.2 1.0 ! A.152 at 9.34e+07 assign (resid 295 and name HB2 ) (resid 295 and name HN ) 3.0 1.2 0.5 ! A.156 at 1.64e+08 assign (resid 295 and name HN ) (resid 296 and name HN ) 3.0 1.2 0.5 ! A.151 at 9.80e+07 assign (resid 295 and name HB1 ) (resid 296 and name HN ) 3.0 1.2 0.5 ! A.38 at 8.92e+07 assign (resid 295 and name HD1# ) (resid 298 and name HN ) 4.0 2.2 1.5 ! A.297 at 3.12e+07 assign (resid 295 and name HD1# ) (resid 299 and name HN ) 4.0 2.2 1.5 ! A.754 at 4.05e+07 ! C96 assign (resid 296 and name HB1 ) (resid 296 and name HN ) 3.0 1.2 0.5 ! A.36 at 1.89e+08 (widened1) assign (resid 296 and name HB1 ) (resid 297 and name HN ) 4.0 2.2 2.0 ! A.492 at 2.17e+07 assign (resid 296 and name HN ) (resid 297 and name HN ) 4.0 2.2 1.0 ! A.485 at 4.33e+07 assign (resid 296 and name HB2 ) (resid 297 and name HN ) 4.0 2.2 1.0 ! A.493 at 2.86e+07 assign (resid 296 and name HN ) (resid 298 and name HN ) 4.0 2.2 2.0 ! A.290 at 1.87e+07 assign (resid 296 and name HA ) (resid 299 and name HN ) 2.5 0.7 0.4 ! A.759 at 4.18e+08 ! E97 assign (resid 297 and name HB2 ) (resid 297 and name HN ) 3.0 1.2 0.5 ! A.489 at 6.82e+07 assign (resid 297 and name HG1 ) (resid 297 and name HN ) 4.0 2.2 1.0 ! A.490 at 2.75e+07 assign (resid 297 and name HB1 ) (resid 297 and name HN ) 4.0 2.2 1.0 ! A.488 at 5.56e+07 assign (resid 297 and name HG2 ) (resid 297 and name HN ) 4.0 2.2 1.0 ! A.491 at 3.22e+07 assign (resid 297 and name HN ) (resid 298 and name HN ) 3.0 1.2 0.5 ! A.495 at 6.62e+07 assign (resid 297 and name HG1 ) (resid 298 and name HN ) 4.0 2.2 2.0 ! A.296 at 1.96e+07 assign (resid 297 and name HG2 ) (resid 298 and name HN ) 4.0 2.2 1.0 ! A.295 at 3.29e+07 assign (resid 297 and name HA ) (resid 298 and name HN ) 4.0 2.2 1.0 ! A.293 at 3.48e+07 assign (resid 297 and name HA ) (resid 300 and name HN ) 4.0 2.2 1.0 ! A.378 at 4.41e+07 ! M98 assign (resid 298 and name HG1 ) (resid 298 and name HN ) 3.0 1.2 0.5 ! A.294 at 9.51e+07 assign (resid 298 and name HB2 ) (resid 298 and name HN ) 3.0 1.2 0.5 ! A.289 at 1.23e+08 assign (resid 298 and name HB1 ) (resid 298 and name HN ) 2.5 0.7 0.4 ! A.288 at 1.85e+08 assign (resid 298 and name HN ) (resid 299 and name HN ) 3.0 1.2 0.5 ! A.291 at 1.62e+08 assign (resid 298 and name HA ) (resid 299 and name HN ) 4.0 2.2 1.0 ! A.751 at 4.70e+07 assign (resid 298 and name HN ) (resid 300 and name HN ) 4.0 2.2 1.0 ! A.298 at 2.84e+07 assign (resid 298 and name HA ) (resid 301 and name HN ) 4.0 2.2 1.0 ! A.826 at 3.25e+07 assign (resid 298 and name HA ) (resid 302 and name HN ) 4.0 2.2 2.0 ! A.200 at 1.95e+07 ! Y99 assign (resid 299 and name HB2 ) (resid 299 and name HN ) 3.0 1.2 0.5 ! A.752 at 9.32e+07 assign (resid 299 and name HB1 ) (resid 299 and name HN ) 4.0 2.2 1.0 ! A.753 at 5.87e+07 assign (resid 299 and name HA ) (resid 300 and name HN ) 4.0 2.2 1.0 ! A.379 at 2.63e+07 assign (resid 299 and name HN ) (resid 300 and name HN ) 4.0 2.2 1.0 ! A.381 at 6.39e+07 assign (resid 299 and name HN ) (resid 300 and name HB2 ) 4.0 2.2 1.0 ! A.755 at 3.14e+07 assign (resid 299 and name HB1 ) (resid 302 and name HN ) 4.0 2.2 2.0 ! A.201 at 1.47e+07 ! R100 assign (resid 300 and name HG# ) (resid 300 and name HN ) 3.0 1.2 1.0 ! A.377 at 1.13e+08 assign (resid 300 and name HB1 ) (resid 300 and name HN ) 3.0 1.2 0.5 ! A.376 at 7.79e+07 assign (resid 300 and name HN ) (resid 301 and name HN ) 4.0 2.2 1.0 ! A.382 at 5.29e+07 assign (resid 300 and name HG# ) (resid 301 and name HN ) 4.0 2.2 1.5 ! A.831 at 5.10e+07 assign (resid 300 and name HA ) (resid 301 and name HN ) 4.0 2.2 1.0 ! A.827 at 3.22e+07 assign (resid 300 and name HA ) (resid 302 and name HN ) 4.0 2.2 2.0 ! A.202 at 1.96e+07 ! R101 assign (resid 301 and name HD2 ) (resid 301 and name HN ) 4.0 2.2 1.0 ! A.828 at 3.92e+07 assign (resid 301 and name HG2 ) (resid 301 and name HN ) 3.0 1.2 0.5 ! A.830 at 1.21e+08 assign (resid 301 and name HG1 ) (resid 301 and name HN ) 2.5 0.7 0.4 ! A.829 at 1.94e+08 assign (resid 301 and name HN ) (resid 302 and name HN ) 4.0 2.2 1.0 ! A.832 at 5.83e+07 assign (resid 301 and name HB2 ) (resid 302 and name HN ) 3.0 1.2 0.5 ! A.203 at 8.80e+07 assign (resid 301 and name HA ) (resid 302 and name HN ) 4.0 2.2 1.0 ! A.198 at 6.11e+07 ! S102 assign (resid 302 and name HB# ) (resid 302 and name HN ) 2.5 0.7 0.9 ! A.197 at 1.97e+08 assign (resid 302 and name HN ) (resid 303 and name HN ) 3.0 1.2 0.5 ! A.195 at 1.69e+08 assign (resid 302 and name HN ) (resid 303 and name HG12 ) 3.0 1.2 0.5 ! A.205 at 6.58e+07 ! I103 assign (resid 103 and name HG2# ) (resid 103 and name HN ) 3.0 1.2 1.0 ! A.855 at 9.83e+07 assign (resid 103 and name HG12 ) (resid 103 and name HN ) 3.0 1.2 0.5 ! A.852 at 1.68e+08 assign (resid 101 and name HN ) (resid 103 and name HN) 4.0 2.2 2.0 ! A.851 at 2.08e+07 assign (resid 103 and name HB ) (resid 103 and name HN ) 2.5 0.7 0.4 ! A.849 at 2.29e+08 assign (resid 100 and name HA ) (resid 103 and name HN ) 4.0 2.2 2.0 ! A.846 at 1.99e+07 assign (resid 102 and name HN ) (resid 103 and name HN ) 3.0 1.2 0.5 ! A.850 at 1.23e+08 ! P104 assign (resid 304 and name HB1 ) (resid 305 and name HN ) 4.0 2.2 1.0 ! A.346 at 2.77e+07 assign (resid 304 and name HB2 ) (resid 305 and name HN ) 4.0 2.2 1.0 ! A.347 at 2.78e+07 ! R105 assign (resid 305 and name HB1 ) (resid 305 and name HN ) 4.0 2.2 1.0 ! A.348 at 4.58e+07 assign (resid 305 and name HB2 ) (resid 305 and name HN ) 3.0 1.2 0.5 ! A.349 at 6.81e+07 assign (resid 305 and name HA ) (resid 307 and name HN ) 3.0 1.2 0.5 ! A.259 at -1.00e+08 ! E106 assign (resid 306 and name HB2 ) (resid 307 and name HN ) 4.0 2.2 2.0 ! A.257 at -1.92e+07 assign (resid 306 and name HA ) (resid 307 and name HN ) 3.0 1.2 0.5 ! A.254 at -1.78e+08 assign (resid 306 and name HB1 ) (resid 307 and name HN ) 4.0 2.2 1.0 ! A.256 at -5.09e+07 ! V107 assign (resid 307 and name HG1# ) (resid 307 and name HN ) 4.0 2.2 1.5 ! A.258 at -3.16e+07 ! 108 !@ END_XPLR_NOE_FILE