NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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26095 |
2kes   |
16156 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign (segid " " and resid 541 and name HB1) (segid " " and resid 538 and name HA) 3.091 1.194 1.194 weight 1.000 ! spec=C13NOESY, no=1, id=314, vol=2.790000e+08 assign (segid " " and resid 541 and name HB2) (segid " " and resid 538 and name HA) 2.952 1.089 1.089 weight 1.000 ! spec=C13NOESY, no=2, id=315, vol=3.680000e+08 assign (segid " " and resid 541 and name HB2) (segid " " and resid 541 and name HA) 2.866 1.027 1.027 weight 1.000 ! spec=C13NOESY, no=3, id=316, vol=4.390000e+08 assign (segid " " and resid 541 and name HB1) (segid " " and resid 541 and name HA) 2.467 0.761 0.761 weight 1.000 ! spec=C13NOESY, no=4, id=317, vol=1.080000e+09 assign (segid " " and resid 541 and name HB1) (segid " " and resid 541 and name HB2) 2.357 0.694 0.694 weight 1.000 ! spec=C13NOESY, no=5, id=318, vol=1.420000e+09 assign (segid " " and resid 546 and name HB2) (segid " " and resid 546 and name HB1) 2.872 1.031 1.031 weight 1.000 ! spec=C13NOESY, no=10, id=323, vol=4.340000e+08 assign (segid " " and resid 543 and name HB1) (segid " " and resid 543 and name HA) 2.707 0.916 0.916 weight 1.000 ! spec=C13NOESY, no=11, id=324, vol=6.180000e+08 assign (segid " " and resid 543 and name HB2) (segid " " and resid 543 and name HA) 3.049 1.162 1.162 weight 1.000 ! spec=C13NOESY, no=12, id=325, vol=3.030000e+08 assign (segid " " and resid 526 and name HG21) (segid " " and resid 526 and name HA) 2.960 1.095 1.095 weight 1.000 ! spec=C13NOESY, no=13, id=326, vol=3.620000e+08 assign (segid " " and resid 526 and name HG21) (segid " " and resid 523 and name HA) 2.830 1.001 1.001 weight 1.000 ! spec=C13NOESY, no=14, id=327, vol=4.740000e+08 assign (segid " " and resid 538 and name HG21) (segid " " and resid 538 and name HB) 1.935 0.468 0.468 weight 1.000 ! spec=C13NOESY, no=15, id=328, vol=4.630000e+09 assign (segid " " and resid 533 and name HG21) (segid " " and resid 533 and name HA) 2.234 0.624 0.624 weight 1.000 ! spec=C13NOESY, no=16, id=329, vol=1.960000e+09 assign (segid " " and resid 534 and name HG12) (segid " " and resid 534 and name HA) 2.613 0.854 0.854 weight 1.000 ! spec=C13NOESY, no=17, id=330, vol=7.640000e+08 assign (segid " " and resid 534 and name HG12) (segid " " and resid 531 and name HA) 2.733 0.934 0.934 weight 1.000 ! spec=C13NOESY, no=18, id=331, vol=5.840000e+08 assign (segid " " and resid 534 and name HG12) (segid " " and resid 534 and name HB) 2.644 0.874 0.874 weight 1.000 ! spec=C13NOESY, no=19, id=332, vol=7.130000e+08 assign (segid " " and resid 549 and name HB2) (segid " " and resid 549 and name HA) 2.575 0.829 0.829 weight 1.000 ! spec=C13NOESY, no=20, id=333, vol=8.340000e+08 assign (segid " " and resid 549 and name HB2) (segid " " and resid 550 and name HG1) 2.827 0.999 0.999 weight 1.000 ! spec=C13NOESY, no=22, id=334, vol=4.770000e+08 assign (segid " " and resid 555 and name HD2) (segid " " and resid 555 and name HA) 3.502 1.533 1.533 weight 1.000 ! spec=C13NOESY, no=24, id=335, vol=1.320000e+08 assign (segid " " and resid 555 and name HD2) (segid " " and resid 555 and name HE2) 1.996 0.498 0.498 weight 1.000 ! spec=C13NOESY, no=25, id=336, vol=3.850000e+09 assign (segid " " and resid 537 and name HB) (segid " " and resid 537 and name HG12) 2.721 0.925 0.925 weight 1.000 ! spec=C13NOESY, no=26, id=337, vol=6.000000e+08 assign (segid " " and resid 537 and name HB) (segid " " and resid 537 and name HG22) 2.015 0.507 0.507 weight 1.000 ! spec=C13NOESY, no=27, id=338, vol=3.640000e+09 assign (segid " " and resid 537 and name HB) (segid " " and resid 537 and name HA) 2.526 0.798 0.798 weight 1.000 ! spec=C13NOESY, no=28, id=339, vol=9.370000e+08 assign (segid " " and resid 516 and name HB2) (segid " " and resid 516 and name HA) 3.010 1.133 1.133 weight 1.000 ! spec=C13NOESY, no=29, id=340, vol=3.270000e+08 assign (segid " " and resid 534 and name HA) (segid " " and resid 534 and name HB) 2.398 0.719 0.719 weight 1.000 ! spec=C13NOESY, no=31, id=342, vol=1.280000e+09 assign (segid " " and resid 534 and name HA) (segid " " and resid 534 and name HG22) 2.800 0.980 0.980 weight 1.000 ! spec=C13NOESY, no=33, id=344, vol=5.050000e+08 assign (segid " " and resid 523 and name HA) (segid " " and resid 526 and name HB) 2.775 0.963 0.963 weight 1.000 ! spec=C13NOESY, no=35, id=346, vol=5.330000e+08 assign (segid " " and resid 538 and name HA) (segid " " and resid 538 and name HB) 3.130 1.224 1.224 weight 1.000 ! spec=C13NOESY, no=38, id=349, vol=2.590000e+08 assign (segid " " and resid 538 and name HA) (segid " " and resid 537 and name HG22) 3.152 1.242 1.242 weight 1.000 ! spec=C13NOESY, no=40, id=351, vol=2.480000e+08 assign (segid " " and resid 520 and name HB2) (segid " " and resid 520 and name HA) 1.990 0.495 0.495 weight 1.000 ! spec=C13NOESY, no=41, id=352, vol=3.920000e+09 assign (segid " " and resid 514 and name HA) (segid " " and resid 514 and name HG21) 2.678 0.896 0.896 weight 1.000 ! spec=C13NOESY, no=42, id=353, vol=6.600000e+08 assign (segid " " and resid 514 and name HA) (segid " " and resid 517 and name HB2) 2.685 0.901 0.901 weight 1.000 ! spec=C13NOESY, no=43, id=354, vol=6.500000e+08 assign (segid " " and resid 514 and name HB) (segid " " and resid 514 and name HG21) 2.272 0.645 0.645 weight 1.000 ! spec=C13NOESY, no=46, id=357, vol=1.770000e+09 assign (segid " " and resid 526 and name HA) (segid " " and resid 526 and name HB) 3.420 1.462 1.462 weight 1.000 ! spec=C13NOESY, no=47, id=358, vol=1.520000e+08 assign (segid " " and resid 526 and name HA) (segid " " and resid 529 and name HD12) 3.007 1.131 1.131 weight 1.000 ! spec=C13NOESY, no=49, id=360, vol=3.290000e+08 assign (segid " " and resid 526 and name HA) (segid " " and resid 529 and name HB2) 3.409 1.453 1.453 weight 1.000 ! spec=C13NOESY, no=51, id=362, vol=1.550000e+08 assign (segid " " and resid 519 and name HA) (segid " " and resid 522 and name HB) 3.132 1.226 1.226 weight 1.000 ! spec=C13NOESY, no=55, id=366, vol=2.580000e+08 assign (segid " " and resid 549 and name HA) (segid " " and resid 548 and name HB2) 3.384 1.432 1.432 weight 1.000 ! spec=C13NOESY, no=58, id=369, vol=1.620000e+08 assign (segid " " and resid 531 and name HG1) (segid " " and resid 531 and name HG2) 2.173 0.590 0.590 weight 1.000 ! spec=C13NOESY, no=60, id=371, vol=2.310000e+09 assign (segid " " and resid 553 and name HG2) (segid " " and resid 553 and name HA) 2.263 0.640 0.640 weight 1.000 ! spec=C13NOESY, no=61, id=372, vol=1.810000e+09 assign (segid " " and resid 553 and name HB2) (segid " " and resid 553 and name HA) 2.659 0.884 0.884 weight 1.000 ! spec=C13NOESY, no=62, id=373, vol=6.880000e+08 assign (segid " " and resid 552 and name HA) (segid " " and resid 552 and name HB2) 2.338 0.683 0.683 weight 1.000 ! spec=C13NOESY, no=63, id=374, vol=1.490000e+09 assign (segid " " and resid 556 and name HA) (segid " " and resid 556 and name HB1) 2.545 0.810 0.810 weight 1.000 ! spec=C13NOESY, no=64, id=375, vol=8.950000e+08 assign (segid " " and resid 556 and name HA) (segid " " and resid 556 and name HB2) 2.152 0.579 0.579 weight 1.000 ! spec=C13NOESY, no=65, id=376, vol=2.450000e+09 assign (segid " " and resid 556 and name HA) (segid " " and resid 555 and name HG2) 3.511 1.541 1.541 weight 1.000 ! spec=C13NOESY, no=66, id=377, vol=1.300000e+08 assign (segid " " and resid 541 and name HA) (segid " " and resid 544 and name HB2) 2.874 1.032 1.032 weight 1.000 ! spec=C13NOESY, no=68, id=379, vol=4.320000e+08 assign (segid " " and resid 541 and name HA) (segid " " and resid 544 and name HB1) 2.787 0.971 0.971 weight 1.000 ! spec=C13NOESY, no=69, id=380, vol=5.190000e+08 assign (segid " " and resid 519 and name HA) (segid " " and resid 519 and name HB2) 2.505 0.784 0.784 weight 1.000 ! spec=C13NOESY, no=70, id=381, vol=9.850000e+08 assign (segid " " and resid 555 and name HD2) (segid " " and resid 555 and name HG2) 2.175 0.591 0.591 weight 1.000 ! spec=C13NOESY, no=71, id=382, vol=2.300000e+09 assign (segid " " and resid 545 and name HG2) (segid " " and resid 545 and name HA) 2.357 0.694 0.694 weight 1.000 ! spec=C13NOESY, no=72, id=383, vol=1.420000e+09 assign (segid " " and resid 542 and name HG2) (segid " " and resid 539 and name HA) 2.705 0.915 0.915 weight 1.000 ! spec=C13NOESY, no=73, id=384, vol=6.210000e+08 assign (segid " " and resid 550 and name HG1) (segid " " and resid 550 and name HA) 2.632 0.866 0.866 weight 1.000 ! spec=C13NOESY, no=75, id=385, vol=7.320000e+08 assign (segid " " and resid 540 and name HG1) (segid " " and resid 540 and name HA) 2.961 1.096 1.096 weight 1.000 ! spec=C13NOESY, no=76, id=386, vol=3.610000e+08 assign (segid " " and resid 550 and name HG1) (segid " " and resid 547 and name HA) 2.033 0.516 0.516 weight 1.000 ! spec=C13NOESY, no=77, id=387, vol=3.450000e+09 assign (segid " " and resid 512 and name HA) (segid " " and resid 512 and name HB) 2.702 0.913 0.913 weight 1.000 ! spec=C13NOESY, no=80, id=389, vol=6.250000e+08 assign (segid " " and resid 520 and name HA) (segid " " and resid 523 and name HB) 1.801 0.405 0.405 weight 1.000 ! spec=C13NOESY, no=82, id=391, vol=7.130000e+09 assign (segid " " and resid 520 and name HA) (segid " " and resid 523 and name HG22) 3.134 1.228 1.228 weight 1.000 ! spec=C13NOESY, no=84, id=393, vol=2.570000e+08 assign (segid " " and resid 520 and name HA) (segid " " and resid 519 and name HB2) 3.497 1.529 1.529 weight 1.000 ! spec=C13NOESY, no=85, id=394, vol=1.330000e+08 assign (segid " " and resid 513 and name HA) (segid " " and resid 516 and name HB1) 3.290 1.353 1.353 weight 1.000 ! spec=C13NOESY, no=86, id=395, vol=1.920000e+08 assign (segid " " and resid 513 and name HA) (segid " " and resid 513 and name HG2) 2.859 1.021 1.021 weight 1.000 ! spec=C13NOESY, no=87, id=396, vol=4.460000e+08 assign (segid " " and resid 555 and name HA) (segid " " and resid 555 and name HB2) 3.006 1.129 1.129 weight 1.000 ! spec=C13NOESY, no=88, id=397, vol=3.300000e+08 assign (segid " " and resid 555 and name HA) (segid " " and resid 555 and name HB1) 2.978 1.108 1.108 weight 1.000 ! spec=C13NOESY, no=90, id=399, vol=3.490000e+08 assign (segid " " and resid 544 and name HG2) (segid " " and resid 544 and name HA) 2.713 0.920 0.920 weight 1.000 ! spec=C13NOESY, no=91, id=400, vol=6.110000e+08 assign (segid " " and resid 541 and name HA) (segid " " and resid 544 and name HG2) 3.325 1.382 1.382 weight 1.000 ! spec=C13NOESY, no=92, id=401, vol=1.800000e+08 assign (segid " " and resid 551 and name HG2) (segid " " and resid 551 and name HE2) 2.445 0.747 0.747 weight 1.000 ! spec=C13NOESY, no=93, id=402, vol=1.140000e+09 assign (segid " " and resid 551 and name HG1) (segid " " and resid 551 and name HE2) 2.341 0.685 0.685 weight 1.000 ! spec=C13NOESY, no=94, id=403, vol=1.480000e+09 assign (segid " " and resid 551 and name HG2) (segid " " and resid 548 and name HA) 2.478 0.768 0.768 weight 1.000 ! spec=C13NOESY, no=97, id=406, vol=1.050000e+09 assign (segid " " and resid 551 and name HG1) (segid " " and resid 548 and name HA) 2.158 0.582 0.582 weight 1.000 ! spec=C13NOESY, no=98, id=407, vol=2.410000e+09 assign (segid " " and resid 551 and name HG2) (segid " " and resid 551 and name HD2) 1.938 0.470 0.470 weight 1.000 ! spec=C13NOESY, no=99, id=408, vol=4.590000e+09 assign (segid " " and resid 551 and name HG1) (segid " " and resid 551 and name HD2) 2.564 0.822 0.822 weight 1.000 ! spec=C13NOESY, no=100, id=409, vol=8.560000e+08 assign (segid " " and resid 551 and name HG2) (segid " " and resid 551 and name HG1) 1.900 0.451 0.451 weight 1.000 ! spec=C13NOESY, no=101, id=410, vol=5.180000e+09 assign (segid " " and resid 543 and name HG) (segid " " and resid 543 and name HB2) 2.459 0.756 0.756 weight 1.000 ! spec=C13NOESY, no=103, id=412, vol=1.100000e+09 assign (segid " " and resid 543 and name HG) (segid " " and resid 546 and name HB1) 2.467 0.761 0.761 weight 1.000 ! spec=C13NOESY, no=104, id=413, vol=1.080000e+09 assign (segid " " and resid 543 and name HG) (segid " " and resid 543 and name HA) 2.241 0.628 0.628 weight 1.000 ! spec=C13NOESY, no=106, id=414, vol=1.920000e+09 assign (segid " " and resid 538 and name HB) (segid " " and resid 535 and name HA) 2.188 0.598 0.598 weight 1.000 ! spec=C13NOESY, no=107, id=415, vol=2.220000e+09 assign (segid " " and resid 524 and name HA) (segid " " and resid 524 and name HG2) 2.604 0.848 0.848 weight 1.000 ! spec=C13NOESY, no=108, id=416, vol=7.800000e+08 assign (segid " " and resid 531 and name HA) (segid " " and resid 534 and name HG22) 2.545 0.810 0.810 weight 1.000 ! spec=C13NOESY, no=109, id=417, vol=8.950000e+08 assign (segid " " and resid 524 and name HB2) (segid " " and resid 524 and name HD1) 2.215 0.613 0.613 weight 1.000 ! spec=C13NOESY, no=112, id=419, vol=2.060000e+09 assign (segid " " and resid 524 and name HB2) (segid " " and resid 524 and name HD2) 2.145 0.575 0.575 weight 1.000 ! spec=C13NOESY, no=113, id=420, vol=2.500000e+09 assign (segid " " and resid 524 and name HB2) (segid " " and resid 524 and name HG2) 2.323 0.674 0.674 weight 1.000 ! spec=C13NOESY, no=114, id=421, vol=1.550000e+09 assign (segid " " and resid 529 and name HB2) (segid " " and resid 529 and name HA) 2.787 0.971 0.971 weight 1.000 ! spec=C13NOESY, no=116, id=423, vol=5.190000e+08 assign (segid " " and resid 543 and name HB2) (segid " " and resid 540 and name HA) 1.877 0.441 0.441 weight 1.000 ! spec=C13NOESY, no=117, id=424, vol=5.560000e+09 assign (segid " " and resid 529 and name HB1) (segid " " and resid 529 and name HA) 3.086 1.190 1.190 weight 1.000 ! spec=C13NOESY, no=118, id=425, vol=2.820000e+08 assign (segid " " and resid 529 and name HB1) (segid " " and resid 529 and name HB2) 2.514 0.790 0.790 weight 1.000 ! spec=C13NOESY, no=120, id=427, vol=9.650000e+08 assign (segid " " and resid 529 and name HB2) (segid " " and resid 529 and name HD12) 2.292 0.656 0.656 weight 1.000 ! spec=C13NOESY, no=121, id=428, vol=1.680000e+09 assign (segid " " and resid 529 and name HB1) (segid " " and resid 529 and name HD12) 2.338 0.683 0.683 weight 1.000 ! spec=C13NOESY, no=122, id=429, vol=1.490000e+09 assign (segid " " and resid 536 and name HD2) (segid " " and resid 536 and name HA) 2.840 1.008 1.008 weight 1.000 ! spec=C13NOESY, no=123, id=430, vol=4.640000e+08 assign (segid " " and resid 536 and name HD2) (segid " " and resid 537 and name HA) 3.262 1.330 1.330 weight 1.000 ! spec=C13NOESY, no=124, id=431, vol=2.020000e+08 assign (segid " " and resid 536 and name HD2) (segid " " and resid 536 and name HB2) 2.583 0.834 0.834 weight 1.000 ! spec=C13NOESY, no=125, id=432, vol=8.190000e+08 assign (segid " " and resid 536 and name HD2) (segid " " and resid 536 and name HB1) 2.811 0.988 0.988 weight 1.000 ! spec=C13NOESY, no=126, id=433, vol=4.930000e+08 assign (segid " " and resid 547 and name HA) (segid " " and resid 547 and name HG) 2.864 1.025 1.025 weight 1.000 ! spec=C13NOESY, no=130, id=435, vol=4.410000e+08 assign (segid " " and resid 547 and name HA) (segid " " and resid 547 and name HB1) 2.773 0.961 0.961 weight 1.000 ! spec=C13NOESY, no=131, id=436, vol=5.350000e+08 assign (segid " " and resid 547 and name HA) (segid " " and resid 550 and name HB1) 3.086 1.190 1.190 weight 1.000 ! spec=C13NOESY, no=134, id=439, vol=2.820000e+08 assign (segid " " and resid 547 and name HA) (segid " " and resid 550 and name HB2) 2.495 0.778 0.778 weight 1.000 ! spec=C13NOESY, no=135, id=440, vol=1.010000e+09 assign (segid " " and resid 547 and name HA) (segid " " and resid 550 and name HG2) 3.063 1.172 1.172 weight 1.000 ! spec=C13NOESY, no=136, id=441, vol=2.950000e+08 assign (segid " " and resid 547 and name HA) (segid " " and resid 547 and name HB2) 2.621 0.859 0.859 weight 1.000 ! spec=C13NOESY, no=138, id=443, vol=7.510000e+08 assign (segid " " and resid 547 and name HB1) (segid " " and resid 547 and name HB2) 2.666 0.888 0.888 weight 1.000 ! spec=C13NOESY, no=139, id=444, vol=6.780000e+08 assign (segid " " and resid 547 and name HB2) (segid " " and resid 547 and name HD12) 2.386 0.711 0.711 weight 1.000 ! spec=C13NOESY, no=142, id=447, vol=1.320000e+09 assign (segid " " and resid 539 and name HB1) (segid " " and resid 539 and name HB2) 2.014 0.507 0.507 weight 1.000 ! spec=C13NOESY, no=143, id=448, vol=3.650000e+09 assign (segid " " and resid 539 and name HB1) (segid " " and resid 539 and name HG) 2.626 0.862 0.862 weight 1.000 ! spec=C13NOESY, no=145, id=449, vol=7.430000e+08 assign (segid " " and resid 539 and name HB2) (segid " " and resid 539 and name HG) 4.401 2.421 2.421 weight 1.000 ! spec=C13NOESY, no=146, id=450, vol=3.350000e+07 assign (segid " " and resid 539 and name HB2) (segid " " and resid 539 and name HD12) 2.773 0.961 0.961 weight 1.000 ! spec=C13NOESY, no=149, id=452, vol=5.350000e+08 assign (segid " " and resid 539 and name HB1) (segid " " and resid 539 and name HD12) 1.801 0.405 0.405 weight 1.000 ! spec=C13NOESY, no=150, id=453, vol=7.130000e+09 assign (segid " " and resid 539 and name HB2) (segid " " and resid 539 and name HA) 3.971 1.971 1.971 weight 1.000 ! spec=C13NOESY, no=151, id=454, vol=6.210000e+07 assign (segid " " and resid 539 and name HB1) (segid " " and resid 539 and name HA) 3.398 1.444 1.444 weight 1.000 ! spec=C13NOESY, no=152, id=455, vol=1.580000e+08 assign (segid " " and resid 546 and name HB2) (segid " " and resid 546 and name HA) 2.873 1.032 1.032 weight 1.000 ! spec=C13NOESY, no=153, id=456, vol=4.330000e+08 assign (segid " " and resid 546 and name HA) (segid " " and resid 549 and name HB2) 2.915 1.062 1.062 weight 1.000 ! spec=C13NOESY, no=154, id=457, vol=3.970000e+08 assign (segid " " and resid 546 and name HB1) (segid " " and resid 546 and name HA) 2.688 0.903 0.903 weight 1.000 ! spec=C13NOESY, no=155, id=458, vol=6.450000e+08 assign (segid " " and resid 521 and name HB1) (segid " " and resid 521 and name HA) 2.594 0.841 0.841 weight 1.000 ! spec=C13NOESY, no=157, id=460, vol=7.990000e+08 assign (segid " " and resid 527 and name HB2) (segid " " and resid 527 and name HD2) 2.732 0.933 0.933 weight 1.000 ! spec=C13NOESY, no=158, id=461, vol=5.850000e+08 assign (segid " " and resid 527 and name HB2) (segid " " and resid 527 and name HD1) 2.644 0.874 0.874 weight 1.000 ! spec=C13NOESY, no=159, id=462, vol=7.130000e+08 assign (segid " " and resid 527 and name HB2) (segid " " and resid 527 and name HA) 2.600 0.845 0.845 weight 1.000 ! spec=C13NOESY, no=160, id=463, vol=7.870000e+08 assign (segid " " and resid 527 and name HB1) (segid " " and resid 527 and name HA) 2.577 0.830 0.830 weight 1.000 ! spec=C13NOESY, no=161, id=464, vol=8.310000e+08 assign (segid " " and resid 527 and name HB1) (segid " " and resid 527 and name HE2) 2.703 0.913 0.913 weight 1.000 ! spec=C13NOESY, no=162, id=465, vol=6.240000e+08 assign (segid " " and resid 527 and name HB2) (segid " " and resid 527 and name HG2) 2.228 0.620 0.620 weight 1.000 ! spec=C13NOESY, no=164, id=467, vol=1.990000e+09 assign (segid " " and resid 533 and name HA) (segid " " and resid 533 and name HB) 3.003 1.127 1.127 weight 1.000 ! spec=C13NOESY, no=166, id=469, vol=3.320000e+08 assign (segid " " and resid 552 and name HB2) (segid " " and resid 553 and name HG2) 3.223 1.299 1.299 weight 1.000 ! spec=C13NOESY, no=169, id=470, vol=2.170000e+08 assign (segid " " and resid 552 and name HB2) (segid " " and resid 553 and name HB2) 3.674 1.687 1.687 weight 1.000 ! spec=C13NOESY, no=170, id=471, vol=9.900000e+07 assign (segid " " and resid 538 and name HB) (segid " " and resid 537 and name HG22) 2.889 1.043 1.043 weight 1.000 ! spec=C13NOESY, no=173, id=473, vol=4.190000e+08 assign (segid " " and resid 522 and name HA) (segid " " and resid 522 and name HG12) 2.810 0.987 0.987 weight 1.000 ! 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