NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
455690 |
2kum   |
16839 | cing | 1-original | 4 | XPLOR/CNS | distance | NOE | ambi |
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ASSI { 2}
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OR { 2}
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OR { 3}
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OR { 4}
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OR { 5}
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ASSI { 6}
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OR { 6}
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OR { 6}
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OR { 6}
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OR { 6}
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OR { 6}
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ASSI { 7}
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OR { 7}
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ASSI { 8}
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OR { 8}
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ASSI { 9}
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OR { 9}
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ASSI { 10}
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OR { 10}
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ASSI { 11}
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OR { 11}
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OR { 12}
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OR { 13}
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OR { 14}
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3.400 1.500 1.500 peak 453 spectrum 1 weight 0.10000E+01 volume 0.31894E-02 ppm1 7.983 ppm2 8.421 CV 1
ASSI { 455}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 82 and name H ))
3.300 1.300 1.300 peak 455 spectrum 1 weight 0.10000E+01 volume 0.28747E-02 ppm1 8.214 ppm2 8.423 CV 1
ASSI { 458}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 76 and name H ))
3.200 1.300 1.300 peak 458 spectrum 1 weight 0.10000E+01 volume 0.39442E-02 ppm1 8.008 ppm2 8.267 CV 1
ASSI { 459}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 74 and name H ))
3.400 1.400 1.400 peak 459 spectrum 1 weight 0.10000E+01 volume 0.36083E-02 ppm1 8.008 ppm2 8.310 CV 1
ASSI { 461}
(( segid " " and resid 72 and name H ))
(( segid " " and resid 73 and name H ))
3.700 1.700 1.700 peak 461 spectrum 1 weight 0.10000E+01 volume 0.11570E-02 ppm1 8.001 ppm2 8.278 CV 1
ASSI { 462}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 69 and name H ))
3.600 1.600 1.600 peak 462 spectrum 1 weight 0.10000E+01 volume 0.20041E-02 ppm1 8.032 ppm2 8.327 CV 1
ASSI { 464}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 68 and name H ))
3.700 1.700 1.700 peak 464 spectrum 1 weight 0.10000E+01 volume 0.15427E-02 ppm1 8.326 ppm2 7.920 CV 1
ASSI { 466}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 65 and name H ))
3.500 1.500 1.500 peak 466 spectrum 1 weight 0.10000E+01 volume 0.21294E-02 ppm1 8.019 ppm2 8.146 CV 1
ASSI { 469}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 65 and name H ))
3.600 1.600 1.600 peak 469 spectrum 1 weight 0.10000E+01 volume 0.11357E-02 ppm1 7.724 ppm2 8.144 CV 1
ASSI { 470}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 63 and name H ))
3.700 1.800 1.800 peak 470 spectrum 1 weight 0.10000E+01 volume 0.11570E-02 ppm1 7.724 ppm2 7.859 CV 1
ASSI { 473}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 63 and name H ))
3.400 1.500 1.500 peak 473 spectrum 1 weight 0.10000E+01 volume 0.17272E-02 ppm1 7.650 ppm2 7.859 CV 1
ASSI { 474}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name H ))
3.500 1.600 1.600 peak 474 spectrum 1 weight 0.10000E+01 volume 0.21531E-02 ppm1 7.649 ppm2 7.544 CV 1
ASSI { 476}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 60 and name H ))
3.500 1.600 1.600 peak 476 spectrum 1 weight 0.10000E+01 volume 0.19638E-02 ppm1 7.550 ppm2 8.696 CV 1
ASSI { 479}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 43 and name H ))
2.600 0.800 0.800 peak 479 spectrum 1 weight 0.10000E+01 volume 0.57969E-03 ppm1 9.759 ppm2 8.381 CV 1
ASSI { 480}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 53 and name H ))
4.200 2.200 1.800 peak 480 spectrum 1 weight 0.10000E+01 volume 0.44956E-03 ppm1 9.756 ppm2 8.891 CV 1
ASSI { 482}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 52 and name H ))
4.400 2.400 1.600 peak 482 spectrum 1 weight 0.10000E+01 volume 0.26499E-03 ppm1 8.885 ppm2 8.721 CV 1
ASSI { 485}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 52 and name H ))
3.800 1.800 1.800 peak 485 spectrum 1 weight 0.10000E+01 volume 0.11949E-02 ppm1 8.534 ppm2 8.737 CV 1
ASSI { 487}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 51 and name H ))
3.000 1.100 1.100 peak 487 spectrum 1 weight 0.10000E+01 volume 0.13652E-02 ppm1 7.242 ppm2 8.537 CV 1
ASSI { 488}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 49 and name H ))
2.500 0.800 0.800 peak 488 spectrum 1 weight 0.10000E+01 volume 0.79146E-02 ppm1 7.241 ppm2 8.415 CV 1
ASSI { 490}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 48 and name H ))
3.200 1.300 1.300 peak 490 spectrum 1 weight 0.10000E+01 volume 0.19828E-02 ppm1 8.414 ppm2 8.840 CV 1
ASSI { 492}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 46 and name H ))
4.300 2.300 1.700 peak 492 spectrum 1 weight 0.10000E+01 volume 0.56076E-03 ppm1 8.734 ppm2 8.930 CV 1
ASSI { 494}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 44 and name H ))
4.600 2.700 1.400 peak 494 spectrum 1 weight 0.10000E+01 volume 0.33598E-03 ppm1 9.074 ppm2 9.545 CV 1
ASSI { 496}
(( segid " " and resid 44 and name H ))
(( segid " " and resid 43 and name H ))
5.200 3.400 0.800 peak 496 spectrum 1 weight 0.10000E+01 volume 0.30523E-03 ppm1 9.538 ppm2 8.388 CV 1
ASSI { 498}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name H ))
3.500 1.500 1.500 peak 498 spectrum 1 weight 0.10000E+01 volume 0.21815E-02 ppm1 8.260 ppm2 10.600 CV 1
ASSI { 499}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 42 and name H ))
5.200 3.400 0.800 peak 499 spectrum 1 weight 0.10000E+01 volume 0.22715E-03 ppm1 8.369 ppm2 8.679 CV 1
ASSI { 501}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name H ))
3.700 1.700 1.700 peak 501 spectrum 1 weight 0.10000E+01 volume 0.57732E-03 ppm1 8.690 ppm2 8.463 CV 1
ASSI { 503}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 39 and name H ))
4.100 2.100 1.900 peak 503 spectrum 1 weight 0.10000E+01 volume 0.28156E-03 ppm1 7.009 ppm2 7.988 CV 1
ASSI { 506}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 39 and name H ))
3.300 1.400 1.400 peak 506 spectrum 1 weight 0.10000E+01 volume 0.14812E-02 ppm1 8.434 ppm2 7.988 CV 1
ASSI { 507}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 38 and name H ))
2.900 1.000 1.000 peak 507 spectrum 1 weight 0.10000E+01 volume 0.26547E-02 ppm1 8.504 ppm2 8.431 CV 1
ASSI { 508}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 36 and name H ))
3.800 1.800 1.800 peak 508 spectrum 1 weight 0.10000E+01 volume 0.58679E-03 ppm1 8.505 ppm2 7.555 CV 1
ASSI { 511}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 36 and name H ))
3.400 1.400 1.400 peak 511 spectrum 1 weight 0.10000E+01 volume 0.95825E-03 ppm1 8.008 ppm2 7.558 CV 1
ASSI { 512}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 34 and name H ))
3.800 1.800 1.800 peak 512 spectrum 1 weight 0.10000E+01 volume 0.11665E-02 ppm1 8.009 ppm2 8.786 CV 1
ASSI { 515}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 34 and name H ))
4.300 2.300 1.700 peak 515 spectrum 1 weight 0.10000E+01 volume 0.57258E-03 ppm1 8.449 ppm2 8.782 CV 1
ASSI { 516}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 32 and name H ))
3.300 1.400 1.400 peak 516 spectrum 1 weight 0.10000E+01 volume 0.70036E-03 ppm1 8.449 ppm2 8.832 CV 1
ASSI { 518}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 31 and name H ))
3.600 1.600 1.600 peak 518 spectrum 1 weight 0.10000E+01 volume 0.43063E-03 ppm1 9.025 ppm2 8.857 CV 1
ASSI { 520}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 29 and name H ))
4.900 3.000 1.100 peak 520 spectrum 1 weight 0.10000E+01 volume 0.33362E-03 ppm1 9.035 ppm2 8.739 CV 1
ASSI { 523}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 29 and name H ))
5.100 3.200 0.900 peak 523 spectrum 1 weight 0.10000E+01 volume 0.56076E-03 ppm1 7.523 ppm2 8.745 CV 1
ASSI { 524}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 27 and name H ))
3.100 1.200 1.200 peak 524 spectrum 1 weight 0.10000E+01 volume 0.29836E-02 ppm1 7.522 ppm2 9.026 CV 1
ASSI { 526}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 26 and name H ))
4.500 2.500 1.500 peak 526 spectrum 1 weight 0.10000E+01 volume 0.36674E-03 ppm1 9.030 ppm2 7.213 CV 1
ASSI { 528}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name H ))
2.700 0.900 0.900 peak 528 spectrum 1 weight 0.10000E+01 volume 0.57803E-02 ppm1 7.206 ppm2 7.648 CV 1
ASSI { 530}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 24 and name H ))
3.300 1.400 1.400 peak 530 spectrum 1 weight 0.10000E+01 volume 0.28582E-02 ppm1 7.647 ppm2 7.751 CV 1
ASSI { 532}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 24 and name H ))
3.000 1.100 1.100 peak 532 spectrum 1 weight 0.10000E+01 volume 0.18787E-02 ppm1 7.800 ppm2 7.728 CV 1
ASSI { 534}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 23 and name H ))
2.300 0.600 0.600 peak 534 spectrum 1 weight 0.10000E+01 volume 0.40412E-02 ppm1 7.230 ppm2 7.797 CV 1
ASSI { 535}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 21 and name H ))
3.500 1.500 1.500 peak 535 spectrum 1 weight 0.10000E+01 volume 0.46611E-02 ppm1 7.230 ppm2 7.906 CV 1
ASSI { 537}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 20 and name H ))
2.900 1.000 1.000 peak 537 spectrum 1 weight 0.10000E+01 volume 0.35964E-02 ppm1 7.904 ppm2 8.878 CV 1
ASSI { 539}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 19 and name H ))
4.000 2.000 2.000 peak 539 spectrum 1 weight 0.10000E+01 volume 0.41406E-03 ppm1 8.878 ppm2 8.129 CV 1
ASSI { 542}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 19 and name H ))
4.400 2.400 1.600 peak 542 spectrum 1 weight 0.10000E+01 volume 0.35964E-03 ppm1 8.449 ppm2 8.131 CV 1
ASSI { 543}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name H ))
4.600 2.600 1.400 peak 543 spectrum 1 weight 0.10000E+01 volume 0.35255E-03 ppm1 8.918 ppm2 8.551 CV 1
ASSI { 545}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 12 and name H ))
4.300 2.300 1.700 peak 545 spectrum 1 weight 0.10000E+01 volume 0.65304E-03 ppm1 8.556 ppm2 7.765 CV 1
ASSI { 547}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 11 and name H ))
3.200 1.200 1.200 peak 547 spectrum 1 weight 0.10000E+01 volume 0.38828E-02 ppm1 7.763 ppm2 8.852 CV 1
ASSI { 549}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 11 and name H ))
4.300 2.300 1.700 peak 549 spectrum 1 weight 0.10000E+01 volume 0.23424E-03 ppm1 9.587 ppm2 8.850 CV 1
ASSI { 552}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 10 and name H ))
4.200 2.200 1.800 peak 552 spectrum 1 weight 0.10000E+01 volume 0.74767E-03 ppm1 8.232 ppm2 9.594 CV 1
ASSI { 553}
(( segid " " and resid 7 and name H ))
(( segid " " and resid 6 and name H ))
3.500 1.500 1.500 peak 553 spectrum 1 weight 0.10000E+01 volume 0.14954E-02 ppm1 8.182 ppm2 8.381 CV 1
ASSI { 555}
(( segid " " and resid 2 and name H ))
(( segid " " and resid 3 and name H ))
4.800 2.900 1.200 peak 555 spectrum 1 weight 0.10000E+01 volume 0.26499E-03 ppm1 8.395 ppm2 8.270 CV 1
ASSI { 556}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 88 and name HA3 ))
2.300 0.700 0.700 peak 556 spectrum 1 weight 0.10000E+01 volume 0.75122E-02 ppm1 7.924 ppm2 3.693 CV 1
OR { 556}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 88 and name HA2 ))
ASSI { 557}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HA ))
2.100 0.600 0.600 peak 557 spectrum 1 weight 0.10000E+01 volume 0.71691E-02 ppm1 7.924 ppm2 4.470 CV 1
ASSI { 558}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HG2 ))
3.200 1.300 1.300 peak 558 spectrum 1 weight 0.10000E+01 volume 0.30049E-03 ppm1 7.925 ppm2 2.546 CV 1
ASSI { 559}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HG3 ))
6.000 4.600 0.000 peak 559 spectrum 1 weight 0.10000E+01 volume 0.27920E-03 ppm1 7.924 ppm2 2.454 CV 1
ASSI { 560}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HB2 ))
4.100 2.100 1.900 peak 560 spectrum 1 weight 0.10000E+01 volume 0.13676E-02 ppm1 7.924 ppm2 2.062 CV 1
ASSI { 561}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HB3 ))
4.100 2.100 1.900 peak 561 spectrum 1 weight 0.10000E+01 volume 0.97718E-03 ppm1 7.924 ppm2 1.929 CV 1
ASSI { 562}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HA ))
2.300 0.600 0.600 peak 562 spectrum 1 weight 0.10000E+01 volume 0.35728E-02 ppm1 8.375 ppm2 4.469 CV 1
ASSI { 563}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HG2 ))
3.600 1.600 1.600 peak 563 spectrum 1 weight 0.10000E+01 volume 0.13297E-02 ppm1 8.376 ppm2 2.554 CV 1
ASSI { 564}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HG3 ))
4.000 2.000 2.000 peak 564 spectrum 1 weight 0.10000E+01 volume 0.15829E-02 ppm1 8.375 ppm2 2.455 CV 1
ASSI { 565}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HB2 ))
3.100 1.200 1.200 peak 565 spectrum 1 weight 0.10000E+01 volume 0.20490E-02 ppm1 8.375 ppm2 2.062 CV 1
ASSI { 566}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HB3 ))
2.400 0.700 0.700 peak 566 spectrum 1 weight 0.10000E+01 volume 0.53662E-02 ppm1 8.376 ppm2 1.929 CV 1
ASSI { 567}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 85 and name HB3 ))
2.200 0.600 0.600 peak 567 spectrum 1 weight 0.10000E+01 volume 0.16657E-02 ppm1 8.375 ppm2 1.770 CV 1
ASSI { 568}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 86 and name HA ))
2.400 0.700 0.700 peak 568 spectrum 1 weight 0.10000E+01 volume 0.13477E-01 ppm1 8.376 ppm2 4.241 CV 1
ASSI { 570}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 85 and name HD2 ))
4.300 2.300 1.700 peak 570 spectrum 1 weight 0.10000E+01 volume 0.78791E-03 ppm1 8.118 ppm2 3.099 CV 1
OR { 570}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 85 and name HD3 ))
ASSI { 571}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 85 and name HB2 ))
2.800 1.000 1.000 peak 571 spectrum 1 weight 0.10000E+01 volume 0.55649E-02 ppm1 8.118 ppm2 1.673 CV 1
ASSI { 572}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 84 and name HA ))
2.500 0.800 0.800 peak 572 spectrum 1 weight 0.10000E+01 volume 0.40909E-02 ppm1 8.049 ppm2 4.249 CV 1
ASSI { 573}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HA ))
2.500 0.800 0.800 peak 573 spectrum 1 weight 0.10000E+01 volume 0.71313E-02 ppm1 8.049 ppm2 4.377 CV 1
ASSI { 574}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HG3 ))
3.800 1.800 1.800 peak 574 spectrum 1 weight 0.10000E+01 volume 0.40696E-03 ppm1 8.048 ppm2 2.449 CV 1
ASSI { 575}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HB3 ))
4.200 2.200 1.800 peak 575 spectrum 1 weight 0.10000E+01 volume 0.16042E-02 ppm1 8.048 ppm2 2.016 CV 1
ASSI { 576}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HA ))
2.600 0.800 0.800 peak 576 spectrum 1 weight 0.10000E+01 volume 0.53023E-02 ppm1 7.983 ppm2 4.379 CV 1
ASSI { 577}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HG2 ))
3.500 1.500 1.500 peak 577 spectrum 1 weight 0.10000E+01 volume 0.21911E-02 ppm1 7.984 ppm2 2.508 CV 1
ASSI { 578}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HG3 ))
3.000 1.100 1.100 peak 578 spectrum 1 weight 0.10000E+01 volume 0.21698E-02 ppm1 7.983 ppm2 2.442 CV 1
ASSI { 579}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HB2 ))
3.100 1.200 1.200 peak 579 spectrum 1 weight 0.10000E+01 volume 0.68024E-02 ppm1 7.984 ppm2 1.947 CV 1
ASSI { 580}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 82 and name HA3 ))
2.500 0.800 0.800 peak 580 spectrum 1 weight 0.10000E+01 volume 0.77086E-02 ppm1 7.983 ppm2 3.828 CV 1
OR { 580}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 82 and name HA2 ))
ASSI { 581}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 82 and name HA3 ))
2.500 0.800 0.800 peak 581 spectrum 1 weight 0.10000E+01 volume 0.67811E-02 ppm1 8.415 ppm2 3.830 CV 1
OR { 581}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 82 and name HA2 ))
ASSI { 582}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 81 and name HA ))
2.800 1.000 1.000 peak 582 spectrum 1 weight 0.10000E+01 volume 0.33266E-02 ppm1 8.417 ppm2 4.425 CV 1
ASSI { 583}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 81 and name HB2 ))
3.500 1.500 1.500 peak 583 spectrum 1 weight 0.10000E+01 volume 0.10529E-02 ppm1 8.416 ppm2 3.081 CV 1
ASSI { 584}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 81 and name HB3 ))
4.300 2.300 1.700 peak 584 spectrum 1 weight 0.10000E+01 volume 0.94170E-03 ppm1 8.416 ppm2 2.892 CV 1
ASSI { 585}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HA ))
2.600 0.900 0.900 peak 585 spectrum 1 weight 0.10000E+01 volume 0.42754E-02 ppm1 8.215 ppm2 4.426 CV 1
ASSI { 586}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HB2 ))
3.300 1.400 1.400 peak 586 spectrum 1 weight 0.10000E+01 volume 0.36177E-02 ppm1 8.215 ppm2 3.080 CV 1
ASSI { 587}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HB3 ))
2.500 0.800 0.800 peak 587 spectrum 1 weight 0.10000E+01 volume 0.54325E-02 ppm1 8.215 ppm2 2.893 CV 1
ASSI { 588}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 80 and name HB3 ))
3.100 1.200 1.200 peak 588 spectrum 1 weight 0.10000E+01 volume 0.15427E-02 ppm1 8.214 ppm2 2.747 CV 1
ASSI { 589}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 80 and name HB2 ))
3.700 1.700 1.700 peak 589 spectrum 1 weight 0.10000E+01 volume 0.19094E-02 ppm1 8.215 ppm2 2.622 CV 1
ASSI { 590}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 80 and name HA ))
2.500 0.800 0.800 peak 590 spectrum 1 weight 0.10000E+01 volume 0.11833E-01 ppm1 8.214 ppm2 4.629 CV 1
ASSI { 591}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HA ))
2.400 0.700 0.700 peak 591 spectrum 1 weight 0.10000E+01 volume 0.49072E-02 ppm1 8.251 ppm2 4.629 CV 1
ASSI { 592}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HB3 ))
2.700 0.900 0.900 peak 592 spectrum 1 weight 0.10000E+01 volume 0.36296E-02 ppm1 8.251 ppm2 2.745 CV 1
ASSI { 593}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HB2 ))
2.700 0.900 0.900 peak 593 spectrum 1 weight 0.10000E+01 volume 0.43228E-02 ppm1 8.251 ppm2 2.623 CV 1
ASSI { 594}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 79 and name HB2 ))
2.700 0.900 0.900 peak 594 spectrum 1 weight 0.10000E+01 volume 0.22667E-02 ppm1 8.251 ppm2 1.436 CV 1
OR { 594}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 79 and name HG ))
ASSI { 595}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 79 and name HB3 ))
4.100 2.100 1.900 peak 595 spectrum 1 weight 0.10000E+01 volume 0.23211E-02 ppm1 8.251 ppm2 1.249 CV 1
ASSI { 596}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 86 and name HB2 ))
4.200 2.200 1.800 peak 596 spectrum 1 weight 0.10000E+01 volume 0.13392E-02 ppm1 8.375 ppm2 1.700 CV 1
ASSI { 598}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 85 and name HG3 ))
3.300 1.400 1.400 peak 598 spectrum 1 weight 0.10000E+01 volume 0.13818E-02 ppm1 8.231 ppm2 1.532 CV 1
OR { 598}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 85 and name HG2 ))
ASSI { 599}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HG2 ))
5.100 3.300 0.900 peak 599 spectrum 1 weight 0.10000E+01 volume 0.35255E-03 ppm1 8.048 ppm2 2.511 CV 1
ASSI { 600}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HB2 ))
3.000 1.200 1.200 peak 600 spectrum 1 weight 0.10000E+01 volume 0.13368E-02 ppm1 8.049 ppm2 1.953 CV 1
ASSI { 601}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 85 and name HB3 ))
2.300 0.700 0.700 peak 601 spectrum 1 weight 0.10000E+01 volume 0.34875E-02 ppm1 8.118 ppm2 1.746 CV 1
ASSI { 602}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HB3 ))
2.700 0.900 0.900 peak 602 spectrum 1 weight 0.10000E+01 volume 0.36342E-02 ppm1 7.984 ppm2 2.019 CV 1
ASSI { 603}
(( segid " " and resid 82 and name H ))
( segid " " and resid 81 and name HD% )
4.000 2.000 2.000 peak 603 spectrum 1 weight 0.10000E+01 volume 0.39750E-03 ppm1 8.415 ppm2 7.096 CV 1
ASSI { 604}
(( segid " " and resid 81 and name H ))
( segid " " and resid 81 and name HD% )
3.200 1.300 1.300 peak 604 spectrum 1 weight 0.10000E+01 volume 0.19899E-02 ppm1 8.214 ppm2 7.099 CV 1
ASSI { 606}
(( segid " " and resid 80 and name H ))
( segid " " and resid 81 and name HD% )
5.100 3.200 0.900 peak 606 spectrum 1 weight 0.10000E+01 volume 0.26737E-03 ppm1 8.250 ppm2 7.097 CV 1
ASSI { 607}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HD22))
6.000 4.600 0.000 peak 607 spectrum 1 weight 0.10000E+01 volume 0.39750E-03 ppm1 8.253 ppm2 6.844 CV 1
ASSI { 608}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 79 and name HA ))
2.200 0.600 0.600 peak 608 spectrum 1 weight 0.10000E+01 volume 0.14923E-01 ppm1 8.252 ppm2 4.242 CV 1
ASSI { 610}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 79 and name HB2 ))
2.700 0.900 0.900 peak 610 spectrum 1 weight 0.10000E+01 volume 0.10086E-01 ppm1 8.094 ppm2 1.435 CV 1
OR { 610}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 79 and name HG ))
ASSI { 611}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 79 and name HB3 ))
2.600 0.900 0.900 peak 611 spectrum 1 weight 0.10000E+01 volume 0.28488E-02 ppm1 8.094 ppm2 1.247 CV 1
ASSI { 613}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 78 and name HA ))
2.700 0.900 0.900 peak 613 spectrum 1 weight 0.10000E+01 volume 0.41335E-02 ppm1 8.207 ppm2 4.203 CV 1
ASSI { 614}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 77 and name HD2 ))
2.800 0.900 0.900 peak 614 spectrum 1 weight 0.10000E+01 volume 0.39277E-03 ppm1 8.209 ppm2 3.501 CV 1
ASSI { 615}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 77 and name HB3 ))
3.000 1.100 1.100 peak 615 spectrum 1 weight 0.10000E+01 volume 0.17178E-02 ppm1 8.207 ppm2 2.165 CV 1
ASSI { 616}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 77 and name HG3 ))
4.200 2.200 1.800 peak 616 spectrum 1 weight 0.10000E+01 volume 0.86835E-03 ppm1 8.207 ppm2 1.871 CV 1
OR { 616}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 77 and name HG2 ))
ASSI { 617}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 74 and name HA2 ))
2.400 0.700 0.700 peak 617 spectrum 1 weight 0.10000E+01 volume 0.96180E-02 ppm1 8.009 ppm2 3.944 CV 1
OR { 617}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 74 and name HA3 ))
ASSI { 618}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 75 and name HB ))
2.900 1.000 1.000 peak 618 spectrum 1 weight 0.10000E+01 volume 0.38496E-02 ppm1 8.009 ppm2 4.127 CV 1
ASSI { 619}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 75 and name HA ))
2.800 1.000 1.000 peak 619 spectrum 1 weight 0.10000E+01 volume 0.37644E-02 ppm1 8.009 ppm2 4.302 CV 1
ASSI { 620}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 73 and name HA ))
2.600 0.800 0.800 peak 620 spectrum 1 weight 0.10000E+01 volume 0.57022E-03 ppm1 8.007 ppm2 4.605 CV 1
ASSI { 621}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 73 and name HB2 ))
2.900 1.100 1.100 peak 621 spectrum 1 weight 0.10000E+01 volume 0.26973E-03 ppm1 8.006 ppm2 3.112 CV 1
ASSI { 622}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 73 and name HB3 ))
2.900 1.000 1.000 peak 622 spectrum 1 weight 0.10000E+01 volume 0.29576E-03 ppm1 8.009 ppm2 3.231 CV 1
ASSI { 623}
(( segid " " and resid 75 and name H ))
( segid " " and resid 75 and name HG2%)
2.900 1.100 1.100 peak 623 spectrum 1 weight 0.10000E+01 volume 0.34639E-02 ppm1 8.009 ppm2 1.129 CV 1
ASSI { 624}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 74 and name HA2 ))
2.700 0.900 0.900 peak 624 spectrum 1 weight 0.10000E+01 volume 0.53686E-02 ppm1 8.309 ppm2 3.944 CV 1
OR { 624}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 74 and name HA3 ))
ASSI { 625}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 73 and name HA ))
2.800 1.000 1.000 peak 625 spectrum 1 weight 0.10000E+01 volume 0.32368E-02 ppm1 8.310 ppm2 4.605 CV 1
ASSI { 626}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 73 and name HB3 ))
3.900 1.900 1.900 peak 626 spectrum 1 weight 0.10000E+01 volume 0.64120E-03 ppm1 8.310 ppm2 3.229 CV 1
ASSI { 627}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 73 and name HB2 ))
4.200 2.200 1.800 peak 627 spectrum 1 weight 0.10000E+01 volume 0.63411E-03 ppm1 8.312 ppm2 3.117 CV 1
ASSI { 628}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 73 and name HA ))
2.800 1.000 1.000 peak 628 spectrum 1 weight 0.10000E+01 volume 0.18148E-02 ppm1 8.274 ppm2 4.607 CV 1
ASSI { 629}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 72 and name HA ))
3.100 1.200 1.200 peak 629 spectrum 1 weight 0.10000E+01 volume 0.22431E-02 ppm1 8.273 ppm2 4.189 CV 1
ASSI { 631}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 73 and name HB2 ))
3.100 1.200 1.200 peak 631 spectrum 1 weight 0.10000E+01 volume 0.13274E-02 ppm1 8.273 ppm2 3.123 CV 1
ASSI { 632}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 72 and name HB3 ))
4.200 2.200 1.800 peak 632 spectrum 1 weight 0.10000E+01 volume 0.60336E-03 ppm1 8.274 ppm2 1.507 CV 1
ASSI { 634}
(( segid " " and resid 72 and name H ))
(( segid " " and resid 72 and name HB3 ))
2.500 0.800 0.800 peak 634 spectrum 1 weight 0.10000E+01 volume 0.32320E-02 ppm1 7.999 ppm2 1.506 CV 1
ASSI { 637}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 70 and name HD3 ))
4.000 2.000 2.000 peak 637 spectrum 1 weight 0.10000E+01 volume 0.29576E-03 ppm1 7.986 ppm2 3.080 CV 1
OR { 637}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 70 and name HD2 ))
ASSI { 638}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 70 and name HA ))
2.800 1.000 1.000 peak 638 spectrum 1 weight 0.10000E+01 volume 0.32132E-02 ppm1 8.032 ppm2 4.130 CV 1
ASSI { 639}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 67 and name HA ))
2.700 0.900 0.900 peak 639 spectrum 1 weight 0.10000E+01 volume 0.44482E-03 ppm1 8.031 ppm2 4.464 CV 1
ASSI { 640}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 70 and name HD3 ))
4.500 2.500 1.500 peak 640 spectrum 1 weight 0.10000E+01 volume 0.67197E-03 ppm1 8.031 ppm2 3.070 CV 1
OR { 640}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 70 and name HD2 ))
ASSI { 641}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 69 and name HG3 ))
4.300 2.300 1.700 peak 641 spectrum 1 weight 0.10000E+01 volume 0.34071E-03 ppm1 8.036 ppm2 2.231 CV 1
ASSI { 642}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 69 and name HG2 ))
4.800 2.900 1.200 peak 642 spectrum 1 weight 0.10000E+01 volume 0.49214E-03 ppm1 8.032 ppm2 2.145 CV 1
ASSI { 644}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 65 and name HA ))
2.700 0.900 0.900 peak 644 spectrum 1 weight 0.10000E+01 volume 0.45665E-03 ppm1 8.325 ppm2 4.143 CV 1
ASSI { 645}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 67 and name HA ))
2.800 1.000 1.000 peak 645 spectrum 1 weight 0.10000E+01 volume 0.32178E-03 ppm1 8.328 ppm2 4.461 CV 1
ASSI { 646}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 67 and name HB3 ))
2.900 1.100 1.100 peak 646 spectrum 1 weight 0.10000E+01 volume 0.27209E-03 ppm1 8.327 ppm2 3.089 CV 1
ASSI { 647}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 69 and name HG3 ))
3.500 1.500 1.500 peak 647 spectrum 1 weight 0.10000E+01 volume 0.89910E-03 ppm1 8.326 ppm2 2.216 CV 1
ASSI { 648}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 69 and name HG2 ))
4.400 2.400 1.600 peak 648 spectrum 1 weight 0.10000E+01 volume 0.81866E-03 ppm1 8.327 ppm2 2.164 CV 1
ASSI { 649}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HA ))
3.100 1.200 1.200 peak 649 spectrum 1 weight 0.10000E+01 volume 0.16846E-02 ppm1 7.918 ppm2 4.461 CV 1
ASSI { 650}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HA ))
3.000 1.100 1.100 peak 650 spectrum 1 weight 0.10000E+01 volume 0.20893E-02 ppm1 7.916 ppm2 3.998 CV 1
ASSI { 651}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 65 and name HA ))
2.700 0.900 0.900 peak 651 spectrum 1 weight 0.10000E+01 volume 0.48504E-03 ppm1 7.918 ppm2 4.137 CV 1
ASSI { 652}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HB2 ))
3.800 1.800 1.800 peak 652 spectrum 1 weight 0.10000E+01 volume 0.85888E-03 ppm1 7.917 ppm2 3.185 CV 1
ASSI { 653}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HB3 ))
4.400 2.400 1.600 peak 653 spectrum 1 weight 0.10000E+01 volume 0.10221E-02 ppm1 7.918 ppm2 3.100 CV 1
ASSI { 654}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HB2 ))
3.600 1.600 1.600 peak 654 spectrum 1 weight 0.10000E+01 volume 0.25791E-02 ppm1 7.917 ppm2 1.865 CV 1
OR { 654}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 655}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HB3 ))
3.000 1.100 1.100 peak 655 spectrum 1 weight 0.10000E+01 volume 0.20964E-02 ppm1 7.916 ppm2 1.674 CV 1
ASSI { 658}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 67 and name HA ))
3.100 1.200 1.200 peak 658 spectrum 1 weight 0.10000E+01 volume 0.14741E-02 ppm1 7.924 ppm2 4.462 CV 1
ASSI { 659}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 66 and name HA ))
3.200 1.300 1.300 peak 659 spectrum 1 weight 0.10000E+01 volume 0.13983E-02 ppm1 7.926 ppm2 4.031 CV 1
ASSI { 662}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 65 and name HB3 ))
3.700 1.700 1.700 peak 662 spectrum 1 weight 0.10000E+01 volume 0.16823E-02 ppm1 8.019 ppm2 3.003 CV 1
ASSI { 663}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 65 and name HB2 ))
3.500 1.500 1.500 peak 663 spectrum 1 weight 0.10000E+01 volume 0.19236E-02 ppm1 8.019 ppm2 3.129 CV 1
ASSI { 664}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 65 and name HA ))
3.100 1.200 1.200 peak 664 spectrum 1 weight 0.10000E+01 volume 0.18407E-02 ppm1 8.020 ppm2 4.132 CV 1
ASSI { 665}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 66 and name HA ))
2.700 0.900 0.900 peak 665 spectrum 1 weight 0.10000E+01 volume 0.39844E-02 ppm1 8.019 ppm2 4.038 CV 1
ASSI { 666}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 64 and name HA ))
2.800 1.000 1.000 peak 666 spectrum 1 weight 0.10000E+01 volume 0.38093E-03 ppm1 8.021 ppm2 4.274 CV 1
ASSI { 667}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 65 and name HA ))
3.200 1.300 1.300 peak 667 spectrum 1 weight 0.10000E+01 volume 0.14906E-02 ppm1 8.142 ppm2 4.135 CV 1
ASSI { 668}
(( segid " " and resid 65 and name H ))
( segid " " and resid 65 and name HD% )
4.400 2.400 1.600 peak 668 spectrum 1 weight 0.10000E+01 volume 0.68143E-03 ppm1 8.138 ppm2 7.172 CV 1
ASSI { 670}
(( segid " " and resid 66 and name H ))
( segid " " and resid 65 and name HD% )
3.700 1.700 1.700 peak 670 spectrum 1 weight 0.10000E+01 volume 0.68380E-03 ppm1 8.020 ppm2 7.167 CV 1
ASSI { 671}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HE22))
6.000 4.600 0.000 peak 671 spectrum 1 weight 0.10000E+01 volume 0.17983E-03 ppm1 7.915 ppm2 6.784 CV 1
ASSI { 672}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HB2 ))
3.500 1.600 1.600 peak 672 spectrum 1 weight 0.10000E+01 volume 0.17272E-02 ppm1 7.725 ppm2 3.127 CV 1
ASSI { 673}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HB3 ))
2.800 1.000 1.000 peak 673 spectrum 1 weight 0.10000E+01 volume 0.20041E-02 ppm1 7.724 ppm2 3.027 CV 1
ASSI { 674}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HA ))
3.000 1.100 1.100 peak 674 spectrum 1 weight 0.10000E+01 volume 0.11807E-02 ppm1 7.723 ppm2 4.271 CV 1
ASSI { 677}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 63 and name HG2 ))
3.300 1.300 1.300 peak 677 spectrum 1 weight 0.10000E+01 volume 0.34545E-03 ppm1 7.725 ppm2 2.237 CV 1
OR { 677}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 63 and name HG3 ))
ASSI { 678}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 60 and name HA ))
2.700 0.900 0.900 peak 678 spectrum 1 weight 0.10000E+01 volume 0.44718E-03 ppm1 7.857 ppm2 4.361 CV 1
ASSI { 679}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 62 and name HB3 ))
4.400 2.400 1.600 peak 679 spectrum 1 weight 0.10000E+01 volume 0.13037E-02 ppm1 7.859 ppm2 3.933 CV 1
OR { 679}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 682}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 62 and name HA ))
2.700 0.900 0.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.25908E-02 ppm1 7.650 ppm2 4.115 CV 1
ASSI { 683}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 59 and name HA ))
2.400 0.700 0.700 peak 683 spectrum 1 weight 0.10000E+01 volume 0.84232E-03 ppm1 7.650 ppm2 4.410 CV 1
ASSI { 684}
(( segid " " and resid 62 and name H ))
( segid " " and resid 61 and name HD1%)
3.500 1.600 1.600 peak 684 spectrum 1 weight 0.10000E+01 volume 0.40696E-03 ppm1 7.650 ppm2 0.473 CV 1
ASSI { 685}
(( segid " " and resid 62 and name H ))
( segid " " and resid 61 and name HD2%)
3.200 1.300 1.300 peak 685 spectrum 1 weight 0.10000E+01 volume 0.41643E-03 ppm1 7.651 ppm2 0.357 CV 1
ASSI { 686}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name HB3 ))
3.500 1.500 1.500 peak 686 spectrum 1 weight 0.10000E+01 volume 0.14386E-02 ppm1 7.651 ppm2 1.528 CV 1
ASSI { 687}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name HB2 ))
4.400 2.500 1.600 peak 687 spectrum 1 weight 0.10000E+01 volume 0.11381E-02 ppm1 7.650 ppm2 1.377 CV 1
ASSI { 688}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name HG ))
4.800 2.900 1.200 peak 688 spectrum 1 weight 0.10000E+01 volume 0.64358E-03 ppm1 7.651 ppm2 1.230 CV 1
ASSI { 689}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 60 and name HA ))
3.600 1.600 1.600 peak 689 spectrum 1 weight 0.10000E+01 volume 0.98428E-03 ppm1 7.551 ppm2 4.363 CV 1
ASSI { 690}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 61 and name HA ))
3.000 1.100 1.100 peak 690 spectrum 1 weight 0.10000E+01 volume 0.16089E-02 ppm1 7.550 ppm2 4.013 CV 1
ASSI { 691}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 60 and name HB3 ))
4.900 3.000 1.100 peak 691 spectrum 1 weight 0.10000E+01 volume 0.95353E-03 ppm1 7.550 ppm2 3.918 CV 1
ASSI { 692}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 60 and name HB2 ))
3.700 1.700 1.700 peak 692 spectrum 1 weight 0.10000E+01 volume 0.97482E-03 ppm1 7.550 ppm2 3.650 CV 1
ASSI { 693}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 58 and name HB2 ))
2.700 0.900 0.900 peak 693 spectrum 1 weight 0.10000E+01 volume 0.46375E-03 ppm1 7.554 ppm2 2.811 CV 1
ASSI { 694}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 61 and name HB3 ))
3.100 1.200 1.200 peak 694 spectrum 1 weight 0.10000E+01 volume 0.19450E-02 ppm1 7.551 ppm2 1.526 CV 1
ASSI { 695}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 61 and name HB2 ))
2.900 1.100 1.100 peak 695 spectrum 1 weight 0.10000E+01 volume 0.23992E-02 ppm1 7.549 ppm2 1.374 CV 1
ASSI { 697}
(( segid " " and resid 61 and name H ))
( segid " " and resid 61 and name HD1%)
4.500 2.500 1.500 peak 697 spectrum 1 weight 0.10000E+01 volume 0.80920E-03 ppm1 7.551 ppm2 0.468 CV 1
ASSI { 698}
(( segid " " and resid 61 and name H ))
( segid " " and resid 61 and name HD2%)
4.500 2.500 1.500 peak 698 spectrum 1 weight 0.10000E+01 volume 0.88254E-03 ppm1 7.550 ppm2 0.357 CV 1
ASSI { 699}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 58 and name HB3 ))
2.700 0.900 0.900 peak 699 spectrum 1 weight 0.10000E+01 volume 0.43299E-03 ppm1 7.552 ppm2 3.048 CV 1
ASSI { 700}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 58 and name HA ))
2.900 1.100 1.100 peak 700 spectrum 1 weight 0.10000E+01 volume 0.26027E-03 ppm1 8.699 ppm2 4.726 CV 1
ASSI { 701}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 60 and name HA ))
3.200 1.300 1.300 peak 701 spectrum 1 weight 0.10000E+01 volume 0.14764E-02 ppm1 8.697 ppm2 4.358 CV 1
ASSI { 702}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 59 and name HD3 ))
2.600 0.900 0.900 peak 702 spectrum 1 weight 0.10000E+01 volume 0.50397E-03 ppm1 8.697 ppm2 4.038 CV 1
ASSI { 703}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 60 and name HB3 ))
3.300 1.300 1.300 peak 703 spectrum 1 weight 0.10000E+01 volume 0.11310E-02 ppm1 8.696 ppm2 3.911 CV 1
ASSI { 704}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 59 and name HB3 ))
5.700 4.000 0.300 peak 704 spectrum 1 weight 0.10000E+01 volume 0.34071E-03 ppm1 8.695 ppm2 2.388 CV 1
ASSI { 705}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 58 and name HA ))
3.000 1.200 1.200 peak 705 spectrum 1 weight 0.10000E+01 volume 0.19331E-02 ppm1 8.258 ppm2 4.695 CV 1
ASSI { 706}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HA ))
3.100 1.200 1.200 peak 706 spectrum 1 weight 0.10000E+01 volume 0.20371E-02 ppm1 8.260 ppm2 4.496 CV 1
ASSI { 707}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 58 and name HB3 ))
3.100 1.200 1.200 peak 707 spectrum 1 weight 0.10000E+01 volume 0.40011E-02 ppm1 8.258 ppm2 3.052 CV 1
ASSI { 708}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 58 and name HB2 ))
2.600 0.900 0.900 peak 708 spectrum 1 weight 0.10000E+01 volume 0.41998E-02 ppm1 8.259 ppm2 2.810 CV 1
ASSI { 709}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HG2 ))
3.900 1.900 1.900 peak 709 spectrum 1 weight 0.10000E+01 volume 0.15237E-02 ppm1 8.259 ppm2 2.388 CV 1
OR { 709}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HB2 ))
OR { 709}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HG3 ))
ASSI { 710}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HB3 ))
3.300 1.300 1.300 peak 710 spectrum 1 weight 0.10000E+01 volume 0.88728E-03 ppm1 8.258 ppm2 1.968 CV 1
ASSI { 711}
(( segid " " and resid 58 and name H ))
( segid " " and resid 54 and name HG2%)
2.200 0.600 0.600 peak 711 spectrum 1 weight 0.10000E+01 volume 0.17249E-02 ppm1 8.259 ppm2 1.226 CV 1
ASSI { 712}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 58 and name HD22))
4.900 3.000 1.100 peak 712 spectrum 1 weight 0.10000E+01 volume 0.64120E-03 ppm1 8.259 ppm2 7.110 CV 1
ASSI { 713}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 58 and name HD21))
5.100 3.200 0.900 peak 713 spectrum 1 weight 0.10000E+01 volume 0.47795E-03 ppm1 8.259 ppm2 7.371 CV 1
ASSI { 715}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 55 and name HE1 ))
2.800 1.000 1.000 peak 715 spectrum 1 weight 0.10000E+01 volume 0.36438E-03 ppm1 10.597 ppm2 7.767 CV 1
ASSI { 718}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HB2 ))
3.600 1.600 1.600 peak 718 spectrum 1 weight 0.10000E+01 volume 0.93932E-03 ppm1 10.600 ppm2 2.387 CV 1
OR { 718}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HG3 ))
OR { 718}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 719}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 56 and name HA ))
4.500 2.500 1.500 peak 719 spectrum 1 weight 0.10000E+01 volume 0.28866E-03 ppm1 10.598 ppm2 4.337 CV 1
ASSI { 720}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 54 and name HA ))
4.000 2.000 2.000 peak 720 spectrum 1 weight 0.10000E+01 volume 0.53236E-03 ppm1 8.398 ppm2 4.798 CV 1
ASSI { 721}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 55 and name HA ))
3.600 1.600 1.600 peak 721 spectrum 1 weight 0.10000E+01 volume 0.47795E-03 ppm1 8.397 ppm2 4.348 CV 1
ASSI { 722}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 55 and name HB3 ))
4.200 2.200 1.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.37621E-03 ppm1 8.395 ppm2 2.715 CV 1
ASSI { 723}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 55 and name HB2 ))
4.500 2.600 1.500 peak 723 spectrum 1 weight 0.10000E+01 volume 0.37621E-03 ppm1 8.398 ppm2 2.848 CV 1
ASSI { 725}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 53 and name HA ))
2.800 1.000 1.000 peak 725 spectrum 1 weight 0.10000E+01 volume 0.30878E-02 ppm1 9.758 ppm2 5.085 CV 1
ASSI { 726}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 54 and name HA ))
3.600 1.700 1.700 peak 726 spectrum 1 weight 0.10000E+01 volume 0.60808E-03 ppm1 9.757 ppm2 4.797 CV 1
ASSI { 727}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 44 and name HA ))
2.500 0.800 0.800 peak 727 spectrum 1 weight 0.10000E+01 volume 0.74295E-03 ppm1 9.757 ppm2 4.504 CV 1
ASSI { 728}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 53 and name HB3 ))
5.000 3.100 1.000 peak 728 spectrum 1 weight 0.10000E+01 volume 0.38803E-03 ppm1 9.755 ppm2 3.628 CV 1
ASSI { 729}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 53 and name HB2 ))
4.200 2.300 1.800 peak 729 spectrum 1 weight 0.10000E+01 volume 0.89438E-03 ppm1 9.757 ppm2 2.635 CV 1
ASSI { 730}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 54 and name HB ))
3.200 1.300 1.300 peak 730 spectrum 1 weight 0.10000E+01 volume 0.14149E-02 ppm1 9.758 ppm2 2.218 CV 1
ASSI { 731}
(( segid " " and resid 54 and name H ))
( segid " " and resid 54 and name HD1%)
4.200 2.200 1.800 peak 731 spectrum 1 weight 0.10000E+01 volume 0.10718E-02 ppm1 9.758 ppm2 0.781 CV 1
ASSI { 732}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 52 and name HA ))
2.500 0.800 0.800 peak 732 spectrum 1 weight 0.10000E+01 volume 0.41264E-02 ppm1 8.886 ppm2 4.447 CV 1
ASSI { 734}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 52 and name HB ))
4.100 2.100 1.900 peak 734 spectrum 1 weight 0.10000E+01 volume 0.83523E-03 ppm1 8.886 ppm2 1.491 CV 1
ASSI { 736}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 52 and name HG12))
2.600 0.900 0.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.50871E-03 ppm1 8.887 ppm2 1.252 CV 1
ASSI { 737}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 53 and name HA ))
3.500 1.500 1.500 peak 737 spectrum 1 weight 0.10000E+01 volume 0.71691E-03 ppm1 8.887 ppm2 5.087 CV 1
ASSI { 738}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 53 and name HB2 ))
3.800 1.800 1.800 peak 738 spectrum 1 weight 0.10000E+01 volume 0.12895E-02 ppm1 8.885 ppm2 2.652 CV 1
ASSI { 739}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 45 and name H ))
3.800 1.800 1.800 peak 739 spectrum 1 weight 0.10000E+01 volume 0.10837E-02 ppm1 8.726 ppm2 9.074 CV 1
ASSI { 740}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 51 and name HA ))
3.000 1.100 1.100 peak 740 spectrum 1 weight 0.10000E+01 volume 0.43772E-02 ppm1 8.726 ppm2 5.418 CV 1
ASSI { 741}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 46 and name HA ))
2.400 0.700 0.700 peak 741 spectrum 1 weight 0.10000E+01 volume 0.82813E-03 ppm1 8.726 ppm2 4.806 CV 1
ASSI { 742}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 52 and name HA ))
3.000 1.200 1.200 peak 742 spectrum 1 weight 0.10000E+01 volume 0.13818E-02 ppm1 8.725 ppm2 4.455 CV 1
ASSI { 743}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 52 and name HB ))
3.000 1.200 1.200 peak 743 spectrum 1 weight 0.10000E+01 volume 0.16965E-02 ppm1 8.726 ppm2 1.497 CV 1
ASSI { 744}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 52 and name HG12))
2.800 1.000 1.000 peak 744 spectrum 1 weight 0.10000E+01 volume 0.15782E-02 ppm1 8.724 ppm2 1.259 CV 1
ASSI { 746}
(( segid " " and resid 52 and name H ))
( segid " " and resid 52 and name HG2%)
4.000 2.000 2.000 peak 746 spectrum 1 weight 0.10000E+01 volume 0.14575E-02 ppm1 8.726 ppm2 0.656 CV 1
ASSI { 747}
(( segid " " and resid 52 and name H ))
( segid " " and resid 44 and name HG1%)
2.300 0.700 0.700 peak 747 spectrum 1 weight 0.10000E+01 volume 0.10671E-02 ppm1 8.725 ppm2 0.423 CV 1
ASSI { 748}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 51 and name HA ))
2.900 1.100 1.100 peak 748 spectrum 1 weight 0.10000E+01 volume 0.23139E-02 ppm1 8.533 ppm2 5.418 CV 1
ASSI { 749}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 50 and name HA ))
2.100 0.600 0.600 peak 749 spectrum 1 weight 0.10000E+01 volume 0.11359E-01 ppm1 8.532 ppm2 4.630 CV 1
ASSI { 750}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 50 and name HG2 ))
2.200 0.600 0.600 peak 750 spectrum 1 weight 0.10000E+01 volume 0.13416E-02 ppm1 8.533 ppm2 1.474 CV 1
ASSI { 751}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 50 and name HG3 ))
2.200 0.600 0.600 peak 751 spectrum 1 weight 0.10000E+01 volume 0.14764E-02 ppm1 8.534 ppm2 1.247 CV 1
ASSI { 752}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 48 and name H ))
3.900 1.900 1.900 peak 752 spectrum 1 weight 0.10000E+01 volume 0.12446E-02 ppm1 7.241 ppm2 8.843 CV 1
ASSI { 753}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 47 and name H ))
2.100 0.600 0.600 peak 753 spectrum 1 weight 0.10000E+01 volume 0.17533E-02 ppm1 7.241 ppm2 8.730 CV 1
ASSI { 754}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 50 and name HA ))
2.400 0.700 0.700 peak 754 spectrum 1 weight 0.10000E+01 volume 0.50280E-02 ppm1 7.242 ppm2 4.630 CV 1
ASSI { 755}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 49 and name HA ))
2.600 0.800 0.800 peak 755 spectrum 1 weight 0.10000E+01 volume 0.34804E-02 ppm1 7.241 ppm2 4.453 CV 1
ASSI { 756}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 48 and name HA ))
4.200 2.200 1.800 peak 756 spectrum 1 weight 0.10000E+01 volume 0.10766E-02 ppm1 7.242 ppm2 3.990 CV 1
ASSI { 757}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 47 and name HB3 ))
1.800 0.400 0.400 peak 757 spectrum 1 weight 0.10000E+01 volume 0.45309E-02 ppm1 7.242 ppm2 1.888 CV 1
ASSI { 758}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 47 and name HB2 ))
1.900 0.500 0.500 peak 758 spectrum 1 weight 0.10000E+01 volume 0.35918E-02 ppm1 7.241 ppm2 1.719 CV 1
ASSI { 759}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 50 and name HG2 ))
2.900 1.100 1.100 peak 759 spectrum 1 weight 0.10000E+01 volume 0.32982E-02 ppm1 7.241 ppm2 1.458 CV 1
ASSI { 760}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 50 and name HG3 ))
4.000 2.000 2.000 peak 760 spectrum 1 weight 0.10000E+01 volume 0.16492E-02 ppm1 7.242 ppm2 1.245 CV 1
ASSI { 761}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 50 and name HB2 ))
2.400 0.700 0.700 peak 761 spectrum 1 weight 0.10000E+01 volume 0.29221E-02 ppm1 7.241 ppm2 1.826 CV 1
ASSI { 762}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 49 and name HA ))
2.400 0.700 0.700 peak 762 spectrum 1 weight 0.10000E+01 volume 0.45144E-02 ppm1 8.414 ppm2 4.454 CV 1
ASSI { 763}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 48 and name HA ))
2.500 0.800 0.800 peak 763 spectrum 1 weight 0.10000E+01 volume 0.31894E-02 ppm1 8.414 ppm2 3.990 CV 1
ASSI { 764}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 49 and name HB3 ))
2.600 0.900 0.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.41477E-02 ppm1 8.414 ppm2 1.914 CV 1
ASSI { 765}
(( segid " " and resid 49 and name H ))
( segid " " and resid 48 and name HB% )
3.200 1.300 1.300 peak 765 spectrum 1 weight 0.10000E+01 volume 0.53710E-02 ppm1 8.414 ppm2 1.420 CV 1
ASSI { 767}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HA ))
2.300 0.700 0.700 peak 767 spectrum 1 weight 0.10000E+01 volume 0.49120E-02 ppm1 8.839 ppm2 4.822 CV 1
ASSI { 768}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 48 and name HA ))
2.200 0.600 0.600 peak 768 spectrum 1 weight 0.10000E+01 volume 0.46375E-02 ppm1 8.840 ppm2 3.990 CV 1
ASSI { 769}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HB3 ))
3.100 1.200 1.200 peak 769 spectrum 1 weight 0.10000E+01 volume 0.51841E-02 ppm1 8.840 ppm2 1.889 CV 1
ASSI { 770}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HB2 ))
3.400 1.500 1.500 peak 770 spectrum 1 weight 0.10000E+01 volume 0.30688E-02 ppm1 8.839 ppm2 1.715 CV 1
ASSI { 771}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HG ))
2.600 0.800 0.800 peak 771 spectrum 1 weight 0.10000E+01 volume 0.10837E-02 ppm1 8.839 ppm2 1.532 CV 1
ASSI { 772}
(( segid " " and resid 48 and name H ))
( segid " " and resid 48 and name HB% )
2.500 0.800 0.800 peak 772 spectrum 1 weight 0.10000E+01 volume 0.96417E-02 ppm1 8.840 ppm2 1.419 CV 1
ASSI { 776}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 46 and name HB2 ))
4.000 2.000 2.000 peak 776 spectrum 1 weight 0.10000E+01 volume 0.90857E-03 ppm1 8.733 ppm2 3.180 CV 1
ASSI { 777}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 46 and name HB3 ))
3.300 1.400 1.400 peak 777 spectrum 1 weight 0.10000E+01 volume 0.13321E-02 ppm1 8.733 ppm2 3.050 CV 1
ASSI { 778}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 47 and name HB3 ))
2.800 1.000 1.000 peak 778 spectrum 1 weight 0.10000E+01 volume 0.17367E-02 ppm1 8.733 ppm2 1.885 CV 1
ASSI { 779}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 47 and name HB2 ))
3.300 1.300 1.300 peak 779 spectrum 1 weight 0.10000E+01 volume 0.21413E-02 ppm1 8.734 ppm2 1.718 CV 1
ASSI { 780}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 47 and name HG ))
3.800 1.800 1.800 peak 780 spectrum 1 weight 0.10000E+01 volume 0.16515E-02 ppm1 8.733 ppm2 1.516 CV 1
ASSI { 781}
(( segid " " and resid 47 and name H ))
( segid " " and resid 47 and name HD2%)
3.700 1.700 1.700 peak 781 spectrum 1 weight 0.10000E+01 volume 0.29836E-02 ppm1 8.734 ppm2 0.688 CV 1
OR { 781}
(( segid " " and resid 47 and name H ))
( segid " " and resid 47 and name HD1%)
ASSI { 782}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 28 and name H ))
2.400 0.700 0.700 peak 782 spectrum 1 weight 0.10000E+01 volume 0.90146E-03 ppm1 8.918 ppm2 7.521 CV 1
ASSI { 783}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 29 and name HA ))
2.400 0.700 0.700 peak 783 spectrum 1 weight 0.10000E+01 volume 0.79737E-03 ppm1 8.916 ppm2 4.910 CV 1
ASSI { 784}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 46 and name HA ))
2.900 1.000 1.000 peak 784 spectrum 1 weight 0.10000E+01 volume 0.13629E-02 ppm1 8.917 ppm2 4.804 CV 1
ASSI { 785}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 45 and name HA ))
2.800 1.000 1.000 peak 785 spectrum 1 weight 0.10000E+01 volume 0.51746E-02 ppm1 8.917 ppm2 4.563 CV 1
ASSI { 786}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 46 and name HB2 ))
2.500 0.800 0.800 peak 786 spectrum 1 weight 0.10000E+01 volume 0.21815E-02 ppm1 8.919 ppm2 3.183 CV 1
ASSI { 787}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 46 and name HB3 ))
3.000 1.100 1.100 peak 787 spectrum 1 weight 0.10000E+01 volume 0.17887E-02 ppm1 8.919 ppm2 3.054 CV 1
ASSI { 788}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 45 and name HB2 ))
2.200 0.600 0.600 peak 788 spectrum 1 weight 0.10000E+01 volume 0.92514E-03 ppm1 8.917 ppm2 1.282 CV 1
ASSI { 789}
(( segid " " and resid 46 and name H ))
( segid " " and resid 26 and name HG2%)
2.100 0.600 0.600 peak 789 spectrum 1 weight 0.10000E+01 volume 0.18858E-02 ppm1 8.918 ppm2 0.687 CV 1
ASSI { 790}
(( segid " " and resid 46 and name H ))
( segid " " and resid 44 and name HG1%)
2.800 1.000 1.000 peak 790 spectrum 1 weight 0.10000E+01 volume 0.33362E-03 ppm1 8.920 ppm2 0.407 CV 1
ASSI { 793}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 53 and name HA ))
4.200 2.200 1.800 peak 793 spectrum 1 weight 0.10000E+01 volume 0.68852E-03 ppm1 9.077 ppm2 5.092 CV 1
ASSI { 794}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 44 and name HB ))
4.800 2.900 1.200 peak 794 spectrum 1 weight 0.10000E+01 volume 0.57496E-03 ppm1 9.078 ppm2 1.948 CV 1
ASSI { 795}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 45 and name HB2 ))
3.500 1.500 1.500 peak 795 spectrum 1 weight 0.10000E+01 volume 0.15450E-02 ppm1 9.075 ppm2 1.274 CV 1
ASSI { 797}
(( segid " " and resid 44 and name H ))
(( segid " " and resid 31 and name H ))
2.800 1.000 1.000 peak 797 spectrum 1 weight 0.10000E+01 volume 0.38331E-03 ppm1 9.536 ppm2 8.860 CV 1
ASSI { 798}
(( segid " " and resid 44 and name H ))
( segid " " and resid 43 and name HD% )
3.800 1.800 1.800 peak 798 spectrum 1 weight 0.10000E+01 volume 0.68143E-03 ppm1 9.539 ppm2 6.880 CV 1
ASSI { 799}
(( segid " " and resid 44 and name H ))
(( segid " " and resid 43 and name HA ))
2.500 0.800 0.800 peak 799 spectrum 1 weight 0.10000E+01 volume 0.44317E-02 ppm1 9.538 ppm2 5.118 CV 1
ASSI { 800}
(( segid " " and resid 44 and name H ))
(( segid " " and resid 43 and name HB3 ))
4.000 2.000 2.000 peak 800 spectrum 1 weight 0.10000E+01 volume 0.15853E-02 ppm1 9.539 ppm2 2.601 CV 1
OR { 800}
(( segid " " and resid 44 and name H ))
(( segid " " and resid 43 and name HB2 ))
ASSI { 801}
(( segid " " and resid 44 and name H ))
(( segid " " and resid 44 and name HB ))
3.200 1.300 1.300 peak 801 spectrum 1 weight 0.10000E+01 volume 0.21744E-02 ppm1 9.538 ppm2 1.952 CV 1
ASSI { 803}
(( segid " " and resid 44 and name H ))
( segid " " and resid 44 and name HG1%)
3.400 1.400 1.400 peak 803 spectrum 1 weight 0.10000E+01 volume 0.10624E-02 ppm1 9.537 ppm2 0.403 CV 1
ASSI { 805}
(( segid " " and resid 43 and name H ))
( segid " " and resid 43 and name HD% )
4.500 2.600 1.500 peak 805 spectrum 1 weight 0.10000E+01 volume 0.61044E-03 ppm1 8.382 ppm2 6.880 CV 1
ASSI { 806}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 43 and name HA ))
3.300 1.400 1.400 peak 806 spectrum 1 weight 0.10000E+01 volume 0.83049E-03 ppm1 8.383 ppm2 5.116 CV 1
ASSI { 807}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 43 and name HB2 ))
3.300 1.400 1.400 peak 807 spectrum 1 weight 0.10000E+01 volume 0.16231E-02 ppm1 8.378 ppm2 2.602 CV 1
OR { 807}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 43 and name HB3 ))
ASSI { 810}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 32 and name H ))
2.300 0.700 0.700 peak 810 spectrum 1 weight 0.10000E+01 volume 0.10529E-02 ppm1 8.689 ppm2 8.821 CV 1
ASSI { 811}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name HA ))
2.500 0.800 0.800 peak 811 spectrum 1 weight 0.10000E+01 volume 0.54112E-02 ppm1 8.689 ppm2 4.633 CV 1
ASSI { 812}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 42 and name HA ))
3.100 1.200 1.200 peak 812 spectrum 1 weight 0.10000E+01 volume 0.17201E-02 ppm1 8.689 ppm2 4.366 CV 1
ASSI { 813}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name HG2 ))
3.800 1.800 1.800 peak 813 spectrum 1 weight 0.10000E+01 volume 0.16160E-02 ppm1 8.688 ppm2 2.291 CV 1
ASSI { 814}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name HG3 ))
2.000 0.500 0.500 peak 814 spectrum 1 weight 0.10000E+01 volume 0.24370E-02 ppm1 8.689 ppm2 1.875 CV 1
ASSI { 815}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name HB3 ))
3.600 1.600 1.600 peak 815 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 8.689 ppm2 1.778 CV 1
OR { 815}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name HB2 ))
ASSI { 817}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 41 and name HA ))
3.400 1.400 1.400 peak 817 spectrum 1 weight 0.10000E+01 volume 0.64594E-03 ppm1 8.472 ppm2 4.633 CV 1
ASSI { 818}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 40 and name HA ))
2.600 0.800 0.800 peak 818 spectrum 1 weight 0.10000E+01 volume 0.27423E-02 ppm1 8.471 ppm2 4.411 CV 1
ASSI { 819}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 41 and name HG2 ))
5.300 3.500 0.700 peak 819 spectrum 1 weight 0.10000E+01 volume 0.39750E-03 ppm1 8.471 ppm2 2.287 CV 1
ASSI { 821}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 39 and name HA ))
3.600 1.700 1.700 peak 821 spectrum 1 weight 0.10000E+01 volume 0.47085E-03 ppm1 7.010 ppm2 4.627 CV 1
ASSI { 822}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 40 and name HA ))
3.800 1.800 1.800 peak 822 spectrum 1 weight 0.10000E+01 volume 0.30759E-03 ppm1 7.017 ppm2 4.418 CV 1
ASSI { 823}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 40 and name HB2 ))
4.700 2.700 1.300 peak 823 spectrum 1 weight 0.10000E+01 volume 0.26973E-03 ppm1 7.017 ppm2 1.408 CV 1
ASSI { 824}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 40 and name HB3 ))
5.200 3.400 0.800 peak 824 spectrum 1 weight 0.10000E+01 volume 0.28156E-03 ppm1 7.005 ppm2 1.206 CV 1
ASSI { 825}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 39 and name HB3 ))
4.200 2.200 1.800 peak 825 spectrum 1 weight 0.10000E+01 volume 0.29576E-03 ppm1 7.983 ppm2 3.350 CV 1
ASSI { 826}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 38 and name HB2 ))
5.400 3.700 0.600 peak 826 spectrum 1 weight 0.10000E+01 volume 0.26737E-03 ppm1 7.992 ppm2 2.905 CV 1
ASSI { 827}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 37 and name HA ))
3.700 1.800 1.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.85888E-03 ppm1 8.434 ppm2 4.207 CV 1
ASSI { 828}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 36 and name HA3 ))
4.500 2.600 1.500 peak 828 spectrum 1 weight 0.10000E+01 volume 0.26737E-03 ppm1 8.437 ppm2 4.029 CV 1
ASSI { 829}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 36 and name HA2 ))
2.600 0.900 0.900 peak 829 spectrum 1 weight 0.10000E+01 volume 0.53000E-03 ppm1 8.435 ppm2 3.757 CV 1
ASSI { 830}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 38 and name HB3 ))
3.600 1.600 1.600 peak 830 spectrum 1 weight 0.10000E+01 volume 0.14670E-02 ppm1 8.434 ppm2 3.153 CV 1
ASSI { 831}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 38 and name HB2 ))
3.100 1.200 1.200 peak 831 spectrum 1 weight 0.10000E+01 volume 0.22951E-02 ppm1 8.434 ppm2 2.904 CV 1
ASSI { 832}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 37 and name HB2 ))
3.200 1.300 1.300 peak 832 spectrum 1 weight 0.10000E+01 volume 0.85652E-03 ppm1 8.434 ppm2 2.608 CV 1
ASSI { 833}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 37 and name HB3 ))
4.200 2.200 1.800 peak 833 spectrum 1 weight 0.10000E+01 volume 0.93224E-03 ppm1 8.431 ppm2 2.463 CV 1
ASSI { 834}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 35 and name H ))
2.700 0.900 0.900 peak 834 spectrum 1 weight 0.10000E+01 volume 0.43535E-03 ppm1 8.506 ppm2 8.011 CV 1
ASSI { 835}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 35 and name HA ))
4.500 2.500 1.500 peak 835 spectrum 1 weight 0.10000E+01 volume 0.51107E-03 ppm1 8.504 ppm2 4.625 CV 1
ASSI { 836}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 37 and name HA ))
2.900 1.100 1.100 peak 836 spectrum 1 weight 0.10000E+01 volume 0.23282E-02 ppm1 8.504 ppm2 4.208 CV 1
ASSI { 837}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 36 and name HA3 ))
2.800 1.000 1.000 peak 837 spectrum 1 weight 0.10000E+01 volume 0.28889E-02 ppm1 8.504 ppm2 4.032 CV 1
ASSI { 838}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 36 and name HA2 ))
3.300 1.400 1.400 peak 838 spectrum 1 weight 0.10000E+01 volume 0.39915E-02 ppm1 8.504 ppm2 3.756 CV 1
ASSI { 839}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 37 and name HB2 ))
3.400 1.400 1.400 peak 839 spectrum 1 weight 0.10000E+01 volume 0.22170E-02 ppm1 8.504 ppm2 2.604 CV 1
ASSI { 840}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 37 and name HB3 ))
3.200 1.300 1.300 peak 840 spectrum 1 weight 0.10000E+01 volume 0.30546E-02 ppm1 8.504 ppm2 2.464 CV 1
ASSI { 841}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 35 and name HA ))
4.600 2.600 1.400 peak 841 spectrum 1 weight 0.10000E+01 volume 0.38567E-03 ppm1 7.562 ppm2 4.629 CV 1
ASSI { 842}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 35 and name HB3 ))
4.600 2.600 1.400 peak 842 spectrum 1 weight 0.10000E+01 volume 0.20112E-03 ppm1 7.558 ppm2 2.646 CV 1
ASSI { 843}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 36 and name HA3 ))
4.400 2.400 1.600 peak 843 spectrum 1 weight 0.10000E+01 volume 0.30759E-03 ppm1 7.579 ppm2 4.033 CV 1
ASSI { 845}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 35 and name HA ))
2.900 1.000 1.000 peak 845 spectrum 1 weight 0.10000E+01 volume 0.31919E-02 ppm1 8.009 ppm2 4.629 CV 1
ASSI { 846}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 34 and name HA ))
2.700 0.900 0.900 peak 846 spectrum 1 weight 0.10000E+01 volume 0.30995E-02 ppm1 8.009 ppm2 3.833 CV 1
ASSI { 847}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 35 and name HB3 ))
4.100 2.100 1.900 peak 847 spectrum 1 weight 0.10000E+01 volume 0.15072E-02 ppm1 8.009 ppm2 2.667 CV 1
ASSI { 849}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 33 and name HB2 ))
2.300 0.700 0.700 peak 849 spectrum 1 weight 0.10000E+01 volume 0.11712E-02 ppm1 8.009 ppm2 2.023 CV 1
ASSI { 853}
(( segid " " and resid 34 and name H ))
(( segid " " and resid 34 and name HA ))
3.400 1.400 1.400 peak 853 spectrum 1 weight 0.10000E+01 volume 0.11002E-02 ppm1 8.786 ppm2 3.835 CV 1
ASSI { 854}
(( segid " " and resid 34 and name H ))
(( segid " " and resid 33 and name HA ))
2.600 0.800 0.800 peak 854 spectrum 1 weight 0.10000E+01 volume 0.32013E-02 ppm1 8.785 ppm2 4.342 CV 1
ASSI { 855}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 32 and name HA ))
2.400 0.700 0.700 peak 855 spectrum 1 weight 0.10000E+01 volume 0.71313E-02 ppm1 8.449 ppm2 4.483 CV 1
ASSI { 856}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 33 and name HA ))
2.900 1.000 1.000 peak 856 spectrum 1 weight 0.10000E+01 volume 0.16302E-02 ppm1 8.449 ppm2 4.344 CV 1
ASSI { 857}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 33 and name HG2 ))
3.900 1.900 1.900 peak 857 spectrum 1 weight 0.10000E+01 volume 0.25293E-02 ppm1 8.449 ppm2 2.245 CV 1
ASSI { 858}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 33 and name HG3 ))
3.400 1.400 1.400 peak 858 spectrum 1 weight 0.10000E+01 volume 0.25814E-02 ppm1 8.449 ppm2 2.084 CV 1
ASSI { 859}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 33 and name HB2 ))
2.500 0.800 0.800 peak 859 spectrum 1 weight 0.10000E+01 volume 0.21579E-02 ppm1 8.449 ppm2 2.033 CV 1
ASSI { 860}
(( segid " " and resid 32 and name H ))
(( segid " " and resid 32 and name HG2 ))
4.000 2.000 2.000 peak 860 spectrum 1 weight 0.10000E+01 volume 0.24370E-03 ppm1 8.828 ppm2 2.268 CV 1
ASSI { 861}
(( segid " " and resid 32 and name H ))
(( segid " " and resid 32 and name HG3 ))
5.200 3.400 0.800 peak 861 spectrum 1 weight 0.10000E+01 volume 0.26263E-03 ppm1 8.827 ppm2 2.120 CV 1
ASSI { 863}
(( segid " " and resid 32 and name H ))
(( segid " " and resid 32 and name HB2 ))
4.400 2.400 1.600 peak 863 spectrum 1 weight 0.10000E+01 volume 0.67906E-03 ppm1 8.834 ppm2 1.894 CV 1
ASSI { 864}
(( segid " " and resid 32 and name H ))
(( segid " " and resid 31 and name HB2 ))
5.200 3.400 0.800 peak 864 spectrum 1 weight 0.10000E+01 volume 0.29576E-03 ppm1 8.841 ppm2 1.621 CV 1
ASSI { 866}
(( segid " " and resid 32 and name H ))
( segid " " and resid 31 and name HD2%)
5.300 3.600 0.700 peak 866 spectrum 1 weight 0.10000E+01 volume 0.50397E-03 ppm1 8.835 ppm2 0.347 CV 1
ASSI { 867}
(( segid " " and resid 32 and name H ))
( segid " " and resid 31 and name HD1%)
4.000 2.000 2.000 peak 867 spectrum 1 weight 0.10000E+01 volume 0.21769E-03 ppm1 8.835 ppm2 0.655 CV 1
ASSI { 868}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 43 and name HA ))
3.000 1.100 1.100 peak 868 spectrum 1 weight 0.10000E+01 volume 0.24844E-03 ppm1 8.853 ppm2 5.127 CV 1
ASSI { 869}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HA ))
2.900 1.100 1.100 peak 869 spectrum 1 weight 0.10000E+01 volume 0.42376E-02 ppm1 8.859 ppm2 4.841 CV 1
ASSI { 870}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 31 and name HA ))
2.700 0.900 0.900 peak 870 spectrum 1 weight 0.10000E+01 volume 0.13250E-02 ppm1 8.858 ppm2 4.466 CV 1
ASSI { 871}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HG2 ))
3.500 1.500 1.500 peak 871 spectrum 1 weight 0.10000E+01 volume 0.94406E-03 ppm1 8.858 ppm2 2.215 CV 1
ASSI { 872}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HG3 ))
2.500 0.800 0.800 peak 872 spectrum 1 weight 0.10000E+01 volume 0.16633E-02 ppm1 8.859 ppm2 2.118 CV 1
OR { 872}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HB3 ))
ASSI { 873}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HB2 ))
3.700 1.700 1.700 peak 873 spectrum 1 weight 0.10000E+01 volume 0.10553E-02 ppm1 8.857 ppm2 1.968 CV 1
ASSI { 874}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 31 and name HB2 ))
2.800 1.000 1.000 peak 874 spectrum 1 weight 0.10000E+01 volume 0.23519E-02 ppm1 8.858 ppm2 1.618 CV 1
ASSI { 875}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 31 and name HB3 ))
3.300 1.400 1.400 peak 875 spectrum 1 weight 0.10000E+01 volume 0.15876E-02 ppm1 8.859 ppm2 1.232 CV 1
ASSI { 877}
(( segid " " and resid 31 and name H ))
( segid " " and resid 31 and name HD2%)
5.200 3.400 0.800 peak 877 spectrum 1 weight 0.10000E+01 volume 0.39039E-03 ppm1 8.858 ppm2 0.352 CV 1
ASSI { 878}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 31 and name HG ))
4.300 2.300 1.700 peak 878 spectrum 1 weight 0.10000E+01 volume 0.74767E-03 ppm1 8.857 ppm2 1.149 CV 1
ASSI { 879}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 28 and name HA ))
2.800 1.000 1.000 peak 879 spectrum 1 weight 0.10000E+01 volume 0.24157E-02 ppm1 8.749 ppm2 4.663 CV 1
ASSI { 880}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 29 and name HA ))
3.400 1.400 1.400 peak 880 spectrum 1 weight 0.10000E+01 volume 0.69326E-03 ppm1 8.750 ppm2 4.905 CV 1
ASSI { 881}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 28 and name HG2 ))
4.100 2.100 1.900 peak 881 spectrum 1 weight 0.10000E+01 volume 0.97010E-03 ppm1 8.755 ppm2 2.278 CV 1
ASSI { 882}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 29 and name HB ))
2.800 1.000 1.000 peak 882 spectrum 1 weight 0.10000E+01 volume 0.20939E-02 ppm1 8.752 ppm2 1.792 CV 1
ASSI { 883}
(( segid " " and resid 29 and name H ))
( segid " " and resid 29 and name HG1%)
4.500 2.600 1.500 peak 883 spectrum 1 weight 0.10000E+01 volume 0.76187E-03 ppm1 8.750 ppm2 0.732 CV 1
ASSI { 884}
(( segid " " and resid 29 and name H ))
( segid " " and resid 29 and name HG2%)
3.200 1.300 1.300 peak 884 spectrum 1 weight 0.10000E+01 volume 0.92986E-03 ppm1 8.750 ppm2 0.521 CV 1
ASSI { 885}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 47 and name HA ))
2.400 0.700 0.700 peak 885 spectrum 1 weight 0.10000E+01 volume 0.79973E-03 ppm1 7.521 ppm2 4.814 CV 1
ASSI { 886}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 28 and name HA ))
3.300 1.400 1.400 peak 886 spectrum 1 weight 0.10000E+01 volume 0.98903E-03 ppm1 7.521 ppm2 4.660 CV 1
ASSI { 887}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 27 and name HA ))
3.100 1.200 1.200 peak 887 spectrum 1 weight 0.10000E+01 volume 0.97010E-03 ppm1 7.522 ppm2 4.248 CV 1
ASSI { 888}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 26 and name HA ))
2.200 0.600 0.600 peak 888 spectrum 1 weight 0.10000E+01 volume 0.14315E-02 ppm1 7.522 ppm2 3.666 CV 1
ASSI { 889}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 28 and name HG2 ))
5.500 3.800 0.500 peak 889 spectrum 1 weight 0.10000E+01 volume 0.40224E-03 ppm1 7.529 ppm2 2.280 CV 1
ASSI { 890}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 28 and name HG3 ))
4.600 2.700 1.400 peak 890 spectrum 1 weight 0.10000E+01 volume 0.75241E-03 ppm1 7.521 ppm2 2.148 CV 1
ASSI { 891}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 28 and name HB2 ))
2.800 1.000 1.000 peak 891 spectrum 1 weight 0.10000E+01 volume 0.11499E-02 ppm1 7.521 ppm2 2.028 CV 1
ASSI { 892}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 27 and name HG12))
2.400 0.700 0.700 peak 892 spectrum 1 weight 0.10000E+01 volume 0.82102E-03 ppm1 7.522 ppm2 1.471 CV 1
ASSI { 893}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 27 and name HG13))
4.500 2.500 1.500 peak 893 spectrum 1 weight 0.10000E+01 volume 0.70509E-03 ppm1 7.521 ppm2 1.053 CV 1
ASSI { 895}
(( segid " " and resid 28 and name H ))
( segid " " and resid 26 and name HG2%)
3.100 1.200 1.200 peak 895 spectrum 1 weight 0.10000E+01 volume 0.30168E-02 ppm1 7.522 ppm2 0.684 CV 1
ASSI { 897}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 24 and name H ))
2.600 0.900 0.900 peak 897 spectrum 1 weight 0.10000E+01 volume 0.52764E-03 ppm1 7.208 ppm2 7.757 CV 1
ASSI { 898}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HA ))
2.600 0.900 0.900 peak 898 spectrum 1 weight 0.10000E+01 volume 0.19851E-02 ppm1 7.206 ppm2 4.335 CV 1
ASSI { 899}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 24 and name HA ))
2.400 0.700 0.700 peak 899 spectrum 1 weight 0.10000E+01 volume 0.99375E-03 ppm1 7.205 ppm2 4.126 CV 1
ASSI { 900}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 26 and name HA ))
2.600 0.900 0.900 peak 900 spectrum 1 weight 0.10000E+01 volume 0.29836E-02 ppm1 7.206 ppm2 3.657 CV 1
ASSI { 901}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 22 and name HA ))
2.800 1.000 1.000 peak 901 spectrum 1 weight 0.10000E+01 volume 0.35964E-03 ppm1 7.214 ppm2 3.977 CV 1
ASSI { 902}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 26 and name HB ))
2.200 0.600 0.600 peak 902 spectrum 1 weight 0.10000E+01 volume 0.64310E-02 ppm1 7.206 ppm2 2.162 CV 1
ASSI { 903}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HB3 ))
4.000 2.000 2.000 peak 903 spectrum 1 weight 0.10000E+01 volume 0.93696E-03 ppm1 7.206 ppm2 2.025 CV 1
ASSI { 904}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HB2 ))
4.300 2.300 1.700 peak 904 spectrum 1 weight 0.10000E+01 volume 0.11617E-02 ppm1 7.206 ppm2 1.953 CV 1
ASSI { 905}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HG2 ))
4.900 3.000 1.100 peak 905 spectrum 1 weight 0.10000E+01 volume 0.80684E-03 ppm1 7.206 ppm2 1.391 CV 1
ASSI { 906}
(( segid " " and resid 26 and name H ))
( segid " " and resid 26 and name HG1%)
2.700 0.900 0.900 peak 906 spectrum 1 weight 0.10000E+01 volume 0.66345E-02 ppm1 7.206 ppm2 0.846 CV 1
ASSI { 907}
(( segid " " and resid 26 and name H ))
( segid " " and resid 26 and name HG2%)
3.500 1.600 1.600 peak 907 spectrum 1 weight 0.10000E+01 volume 0.32817E-02 ppm1 7.206 ppm2 0.691 CV 1
ASSI { 908}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HA ))
2.300 0.700 0.700 peak 908 spectrum 1 weight 0.10000E+01 volume 0.45665E-02 ppm1 7.647 ppm2 4.335 CV 1
ASSI { 909}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 24 and name HA ))
3.400 1.400 1.400 peak 909 spectrum 1 weight 0.10000E+01 volume 0.21579E-02 ppm1 7.647 ppm2 4.126 CV 1
ASSI { 910}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 22 and name HA ))
2.200 0.600 0.600 peak 910 spectrum 1 weight 0.10000E+01 volume 0.14055E-02 ppm1 7.647 ppm2 3.974 CV 1
ASSI { 911}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 23 and name HA ))
3.600 1.600 1.600 peak 911 spectrum 1 weight 0.10000E+01 volume 0.13889E-02 ppm1 7.647 ppm2 3.650 CV 1
ASSI { 912}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 21 and name HA ))
2.900 1.000 1.000 peak 912 spectrum 1 weight 0.10000E+01 volume 0.30049E-03 ppm1 7.647 ppm2 3.777 CV 1
ASSI { 913}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HE3 ))
4.900 3.000 1.100 peak 913 spectrum 1 weight 0.10000E+01 volume 0.50161E-03 ppm1 7.647 ppm2 2.925 CV 1
OR { 913}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HE2 ))
ASSI { 914}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 24 and name HD3 ))
5.500 3.800 0.500 peak 914 spectrum 1 weight 0.10000E+01 volume 0.22005E-03 ppm1 7.646 ppm2 3.079 CV 1
ASSI { 915}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HB2 ))
2.600 0.800 0.800 peak 915 spectrum 1 weight 0.10000E+01 volume 0.52503E-02 ppm1 7.647 ppm2 1.957 CV 1
ASSI { 916}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 24 and name HG2 ))
4.200 2.200 1.800 peak 916 spectrum 1 weight 0.10000E+01 volume 0.20419E-02 ppm1 7.646 ppm2 1.774 CV 1
ASSI { 917}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HG2 ))
3.600 1.600 1.600 peak 917 spectrum 1 weight 0.10000E+01 volume 0.33362E-02 ppm1 7.647 ppm2 1.387 CV 1
ASSI { 919}
(( segid " " and resid 25 and name H ))
( segid " " and resid 47 and name HD1%)
2.000 0.500 0.500 peak 919 spectrum 1 weight 0.10000E+01 volume 0.23708E-02 ppm1 7.647 ppm2 0.701 CV 1
OR { 919}
(( segid " " and resid 25 and name H ))
( segid " " and resid 47 and name HD2%)
ASSI { 920}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HB3 ))
2.700 0.900 0.900 peak 920 spectrum 1 weight 0.10000E+01 volume 0.36509E-02 ppm1 7.646 ppm2 2.046 CV 1
ASSI { 922}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 24 and name HA ))
2.500 0.800 0.800 peak 922 spectrum 1 weight 0.10000E+01 volume 0.54490E-02 ppm1 7.730 ppm2 4.131 CV 1
ASSI { 923}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 22 and name HA ))
4.000 2.000 2.000 peak 923 spectrum 1 weight 0.10000E+01 volume 0.58205E-03 ppm1 7.727 ppm2 3.979 CV 1
ASSI { 924}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 23 and name HA ))
3.100 1.200 1.200 peak 924 spectrum 1 weight 0.10000E+01 volume 0.12824E-02 ppm1 7.729 ppm2 3.643 CV 1
ASSI { 925}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 21 and name HA ))
2.200 0.600 0.600 peak 925 spectrum 1 weight 0.10000E+01 volume 0.15640E-02 ppm1 7.730 ppm2 3.780 CV 1
ASSI { 927}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 24 and name HB2 ))
2.400 0.700 0.700 peak 927 spectrum 1 weight 0.10000E+01 volume 0.41477E-02 ppm1 7.729 ppm2 1.879 CV 1
ASSI { 928}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 24 and name HG2 ))
2.800 1.000 1.000 peak 928 spectrum 1 weight 0.10000E+01 volume 0.95353E-02 ppm1 7.730 ppm2 1.774 CV 1
ASSI { 929}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 24 and name HG3 ))
2.500 0.800 0.800 peak 929 spectrum 1 weight 0.10000E+01 volume 0.31208E-02 ppm1 7.729 ppm2 1.689 CV 1
ASSI { 930}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 23 and name HB3 ))
3.900 1.900 1.900 peak 930 spectrum 1 weight 0.10000E+01 volume 0.15758E-02 ppm1 7.730 ppm2 0.833 CV 1
ASSI { 931}
(( segid " " and resid 24 and name H ))
( segid " " and resid 23 and name HD2%)
2.700 0.900 0.900 peak 931 spectrum 1 weight 0.10000E+01 volume 0.42353E-03 ppm1 7.729 ppm2 0.230 CV 1
ASSI { 932}
(( segid " " and resid 24 and name H ))
( segid " " and resid 23 and name HD1%)
2.500 0.800 0.800 peak 932 spectrum 1 weight 0.10000E+01 volume 0.62701E-03 ppm1 7.730 ppm2 0.480 CV 1
ASSI { 933}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 20 and name HA ))
2.300 0.700 0.700 peak 933 spectrum 1 weight 0.10000E+01 volume 0.11949E-02 ppm1 7.802 ppm2 4.170 CV 1
ASSI { 934}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 22 and name HA ))
3.800 1.800 1.800 peak 934 spectrum 1 weight 0.10000E+01 volume 0.71691E-03 ppm1 7.801 ppm2 3.972 CV 1
ASSI { 935}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 21 and name HA ))
4.600 2.600 1.400 peak 935 spectrum 1 weight 0.10000E+01 volume 0.32178E-03 ppm1 7.800 ppm2 3.788 CV 1
ASSI { 936}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 23 and name HA ))
3.000 1.100 1.100 peak 936 spectrum 1 weight 0.10000E+01 volume 0.11925E-02 ppm1 7.802 ppm2 3.641 CV 1
ASSI { 937}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 22 and name HB2 ))
3.000 1.100 1.100 peak 937 spectrum 1 weight 0.10000E+01 volume 0.24890E-02 ppm1 7.802 ppm2 1.558 CV 1
OR { 937}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 938}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 23 and name HB3 ))
3.200 1.300 1.300 peak 938 spectrum 1 weight 0.10000E+01 volume 0.12942E-02 ppm1 7.800 ppm2 0.834 CV 1
ASSI { 941}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 19 and name HA ))
2.600 0.900 0.900 peak 941 spectrum 1 weight 0.10000E+01 volume 0.52526E-03 ppm1 7.232 ppm2 4.356 CV 1
ASSI { 942}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 20 and name HA ))
2.100 0.600 0.600 peak 942 spectrum 1 weight 0.10000E+01 volume 0.18455E-02 ppm1 7.229 ppm2 4.161 CV 1
ASSI { 943}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 22 and name HA ))
2.400 0.700 0.700 peak 943 spectrum 1 weight 0.10000E+01 volume 0.41643E-02 ppm1 7.230 ppm2 3.972 CV 1
ASSI { 944}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 21 and name HA ))
2.600 0.900 0.900 peak 944 spectrum 1 weight 0.10000E+01 volume 0.18833E-02 ppm1 7.230 ppm2 3.795 CV 1
ASSI { 945}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 20 and name HB3 ))
2.500 0.800 0.800 peak 945 spectrum 1 weight 0.10000E+01 volume 0.62227E-03 ppm1 7.230 ppm2 2.605 CV 1
OR { 945}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 946}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 21 and name HB2 ))
3.300 1.300 1.300 peak 946 spectrum 1 weight 0.10000E+01 volume 0.43985E-02 ppm1 7.230 ppm2 1.667 CV 1
OR { 946}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 947}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 20 and name H ))
2.600 0.800 0.800 peak 947 spectrum 1 weight 0.10000E+01 volume 0.54419E-03 ppm1 7.233 ppm2 8.873 CV 1
ASSI { 948}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 19 and name H ))
2.300 0.700 0.700 peak 948 spectrum 1 weight 0.10000E+01 volume 0.10931E-02 ppm1 7.908 ppm2 8.127 CV 1
ASSI { 949}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 19 and name HA ))
2.100 0.600 0.600 peak 949 spectrum 1 weight 0.10000E+01 volume 0.17935E-02 ppm1 7.905 ppm2 4.361 CV 1
ASSI { 950}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 20 and name HA ))
2.600 0.800 0.800 peak 950 spectrum 1 weight 0.10000E+01 volume 0.46327E-02 ppm1 7.904 ppm2 4.158 CV 1
ASSI { 951}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HA ))
2.400 0.700 0.700 peak 951 spectrum 1 weight 0.10000E+01 volume 0.60714E-02 ppm1 7.904 ppm2 3.786 CV 1
ASSI { 952}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HE3 ))
5.800 4.100 0.200 peak 952 spectrum 1 weight 0.10000E+01 volume 0.44482E-03 ppm1 7.903 ppm2 2.911 CV 1
OR { 952}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HE2 ))
ASSI { 953}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 20 and name HB3 ))
2.800 1.000 1.000 peak 953 spectrum 1 weight 0.10000E+01 volume 0.49498E-02 ppm1 7.905 ppm2 2.607 CV 1
OR { 953}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 954}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HB2 ))
2.200 0.600 0.600 peak 954 spectrum 1 weight 0.10000E+01 volume 0.11584E-01 ppm1 7.904 ppm2 1.670 CV 1
OR { 954}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 955}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HG2 ))
3.800 1.800 1.800 peak 955 spectrum 1 weight 0.10000E+01 volume 0.37006E-02 ppm1 7.905 ppm2 1.423 CV 1
ASSI { 956}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HG3 ))
3.900 1.900 1.900 peak 956 spectrum 1 weight 0.10000E+01 volume 0.19094E-02 ppm1 7.904 ppm2 1.290 CV 1
ASSI { 958}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 19 and name HA ))
2.500 0.800 0.800 peak 958 spectrum 1 weight 0.10000E+01 volume 0.90100E-02 ppm1 8.878 ppm2 4.361 CV 1
ASSI { 960}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 19 and name HB3 ))
2.700 0.900 0.900 peak 960 spectrum 1 weight 0.10000E+01 volume 0.19260E-02 ppm1 8.879 ppm2 3.841 CV 1
ASSI { 961}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 20 and name HB3 ))
2.400 0.700 0.700 peak 961 spectrum 1 weight 0.10000E+01 volume 0.63955E-02 ppm1 8.879 ppm2 2.607 CV 1
OR { 961}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 962}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HG ))
5.000 3.100 1.000 peak 962 spectrum 1 weight 0.10000E+01 volume 0.28630E-03 ppm1 8.135 ppm2 1.757 CV 1
ASSI { 963}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HB2 ))
4.700 2.800 1.300 peak 963 spectrum 1 weight 0.10000E+01 volume 0.60336E-03 ppm1 8.127 ppm2 1.527 CV 1
ASSI { 964}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HB3 ))
2.600 0.900 0.900 peak 964 spectrum 1 weight 0.10000E+01 volume 0.59151E-03 ppm1 8.132 ppm2 1.273 CV 1
ASSI { 966}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HA ))
3.200 1.300 1.300 peak 966 spectrum 1 weight 0.10000E+01 volume 0.27943E-02 ppm1 8.128 ppm2 4.434 CV 1
ASSI { 969}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 19 and name HA ))
2.900 1.100 1.100 peak 969 spectrum 1 weight 0.10000E+01 volume 0.13558E-02 ppm1 8.127 ppm2 4.376 CV 1
ASSI { 971}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 17 and name HD3 ))
2.200 0.600 0.600 peak 971 spectrum 1 weight 0.10000E+01 volume 0.13510E-02 ppm1 8.451 ppm2 3.656 CV 1
ASSI { 972}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 17 and name HB2 ))
2.300 0.600 0.600 peak 972 spectrum 1 weight 0.10000E+01 volume 0.16397E-02 ppm1 8.451 ppm2 2.195 CV 1
ASSI { 974}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 17 and name HG2 ))
4.400 2.400 1.600 peak 974 spectrum 1 weight 0.10000E+01 volume 0.45192E-03 ppm1 8.453 ppm2 1.872 CV 1
ASSI { 975}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 18 and name HB2 ))
2.500 0.800 0.800 peak 975 spectrum 1 weight 0.10000E+01 volume 0.24725E-02 ppm1 8.451 ppm2 1.488 CV 1
ASSI { 976}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 18 and name HB3 ))
2.800 1.000 1.000 peak 976 spectrum 1 weight 0.10000E+01 volume 0.15734E-02 ppm1 8.449 ppm2 1.265 CV 1
ASSI { 977}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 55 and name H ))
2.800 0.900 0.900 peak 977 spectrum 1 weight 0.10000E+01 volume 0.39277E-03 ppm1 8.915 ppm2 8.393 CV 1
ASSI { 978}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HA ))
3.000 1.100 1.100 peak 978 spectrum 1 weight 0.10000E+01 volume 0.13345E-02 ppm1 8.919 ppm2 4.523 CV 1
ASSI { 979}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name HA ))
2.600 0.800 0.800 peak 979 spectrum 1 weight 0.10000E+01 volume 0.38780E-02 ppm1 8.919 ppm2 4.349 CV 1
ASSI { 980}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HB3 ))
2.700 0.900 0.900 peak 980 spectrum 1 weight 0.10000E+01 volume 0.29576E-02 ppm1 8.920 ppm2 3.108 CV 1
OR { 980}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 981}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name HB3 ))
4.800 2.800 1.200 peak 981 spectrum 1 weight 0.10000E+01 volume 0.52764E-03 ppm1 8.921 ppm2 1.914 CV 1
ASSI { 982}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name HG ))
2.900 1.000 1.000 peak 982 spectrum 1 weight 0.10000E+01 volume 0.41879E-03 ppm1 8.922 ppm2 1.577 CV 1
ASSI { 983}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name HB2 ))
4.700 2.800 1.300 peak 983 spectrum 1 weight 0.10000E+01 volume 0.61044E-03 ppm1 8.920 ppm2 1.131 CV 1
ASSI { 987}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HG ))
3.200 1.300 1.300 peak 987 spectrum 1 weight 0.10000E+01 volume 0.43086E-02 ppm1 8.556 ppm2 1.575 CV 1
ASSI { 988}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HB2 ))
3.400 1.400 1.400 peak 988 spectrum 1 weight 0.10000E+01 volume 0.15616E-02 ppm1 8.556 ppm2 1.127 CV 1
ASSI { 990}
(( segid " " and resid 13 and name H ))
( segid " " and resid 13 and name HD2%)
3.700 1.700 1.700 peak 990 spectrum 1 weight 0.10000E+01 volume 0.17320E-02 ppm1 8.556 ppm2 0.567 CV 1
ASSI { 992}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 12 and name HB3 ))
3.700 1.700 1.700 peak 992 spectrum 1 weight 0.10000E+01 volume 0.16420E-02 ppm1 8.555 ppm2 2.005 CV 1
ASSI { 993}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 12 and name HA ))
2.200 0.600 0.600 peak 993 spectrum 1 weight 0.10000E+01 volume 0.11087E-01 ppm1 8.556 ppm2 4.487 CV 1
ASSI { 994}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HA ))
2.800 1.000 1.000 peak 994 spectrum 1 weight 0.10000E+01 volume 0.22099E-02 ppm1 8.556 ppm2 4.350 CV 1
ASSI { 995}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HA ))
2.900 1.100 1.100 peak 995 spectrum 1 weight 0.10000E+01 volume 0.23637E-02 ppm1 7.763 ppm2 4.518 CV 1
ASSI { 996}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HG3 ))
3.700 1.700 1.700 peak 996 spectrum 1 weight 0.10000E+01 volume 0.17296E-02 ppm1 7.763 ppm2 2.257 CV 1
OR { 996}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HG2 ))
ASSI { 997}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HB2 ))
3.300 1.300 1.300 peak 997 spectrum 1 weight 0.10000E+01 volume 0.23116E-02 ppm1 7.763 ppm2 1.923 CV 1
ASSI { 998}
(( segid " " and resid 12 and name H ))
( segid " " and resid 11 and name HG2%)
3.400 1.500 1.500 peak 998 spectrum 1 weight 0.10000E+01 volume 0.11120E-02 ppm1 7.764 ppm2 1.083 CV 1
ASSI { 999}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HB3 ))
3.100 1.200 1.200 peak 999 spectrum 1 weight 0.10000E+01 volume 0.16066E-02 ppm1 7.761 ppm2 1.996 CV 1
ASSI { 1000}
(( segid " " and resid 11 and name H ))
(( segid " " and resid 10 and name HA ))
2.900 1.000 1.000 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.32888E-02 ppm1 8.852 ppm2 4.553 CV 1
ASSI { 1001}
(( segid " " and resid 11 and name H ))
(( segid " " and resid 10 and name HB2 ))
4.700 2.800 1.300 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.35255E-03 ppm1 8.852 ppm2 2.736 CV 1
ASSI { 1002}
(( segid " " and resid 11 and name H ))
(( segid " " and resid 10 and name HB3 ))
4.400 2.400 1.600 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.48268E-03 ppm1 8.851 ppm2 2.538 CV 1
ASSI { 1003}
(( segid " " and resid 11 and name H ))
( segid " " and resid 11 and name HG2%)
4.000 2.000 2.000 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.10529E-02 ppm1 8.852 ppm2 1.080 CV 1
ASSI { 1004}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 32 and name HE21))
2.900 1.000 1.000 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.30049E-03 ppm1 9.598 ppm2 7.903 CV 1
ASSI { 1005}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 32 and name HE22))
2.600 0.800 0.800 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.58679E-03 ppm1 9.600 ppm2 7.076 CV 1
ASSI { 1006}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 9 and name HB3 ))
4.300 2.300 1.700 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.81866E-03 ppm1 9.596 ppm2 2.887 CV 1
ASSI { 1007}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 10 and name HB2 ))
3.000 1.100 1.100 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.11759E-02 ppm1 9.596 ppm2 2.742 CV 1
ASSI { 1008}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 9 and name HB2 ))
3.100 1.200 1.200 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.63647E-03 ppm1 9.596 ppm2 2.628 CV 1
ASSI { 1009}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 10 and name HB3 ))
4.300 2.300 1.700 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.83285E-03 ppm1 9.597 ppm2 2.545 CV 1
ASSI { 1011}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HA ))
2.800 1.000 1.000 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.24890E-02 ppm1 8.233 ppm2 4.493 CV 1
ASSI { 1012}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 8 and name HA ))
2.200 0.600 0.600 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.86385E-02 ppm1 8.233 ppm2 4.294 CV 1
ASSI { 1013}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HB3 ))
3.300 1.400 1.400 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.26854E-02 ppm1 8.232 ppm2 2.888 CV 1
ASSI { 1014}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HB2 ))
2.800 1.000 1.000 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.38519E-02 ppm1 8.233 ppm2 2.631 CV 1
ASSI { 1015}
(( segid " " and resid 9 and name H ))
( segid " " and resid 8 and name HB% )
2.700 0.900 0.900 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.37029E-02 ppm1 8.233 ppm2 1.294 CV 1
ASSI { 1016}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 7 and name HB ))
2.700 0.900 0.900 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.28889E-02 ppm1 8.252 ppm2 4.130 CV 1
ASSI { 1018}
(( segid " " and resid 8 and name H ))
( segid " " and resid 7 and name HG2%)
3.200 1.300 1.300 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.30191E-02 ppm1 8.251 ppm2 1.149 CV 1
ASSI { 1020}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HD3 ))
5.500 3.800 0.500 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.46139E-03 ppm1 8.373 ppm2 3.540 CV 1
ASSI { 1021}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HD2 ))
4.900 3.000 1.100 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.31942E-03 ppm1 8.372 ppm2 3.680 CV 1
ASSI { 1022}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HB2 ))
2.500 0.800 0.800 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.15001E-02 ppm1 8.372 ppm2 2.201 CV 1
ASSI { 1023}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HB3 ))
4.100 2.100 1.900 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.20325E-02 ppm1 8.371 ppm2 1.849 CV 1
ASSI { 1024}
(( segid " " and resid 7 and name H ))
(( segid " " and resid 6 and name HA ))
2.400 0.700 0.700 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.76520E-02 ppm1 8.183 ppm2 4.388 CV 1
ASSI { 1025}
(( segid " " and resid 7 and name H ))
(( segid " " and resid 7 and name HA ))
2.800 1.000 1.000 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.25791E-02 ppm1 8.183 ppm2 4.257 CV 1
ASSI { 1026}
(( segid " " and resid 7 and name H ))
(( segid " " and resid 7 and name HB ))
2.900 1.100 1.100 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.31066E-02 ppm1 8.181 ppm2 4.133 CV 1
ASSI { 1027}
(( segid " " and resid 7 and name H ))
( segid " " and resid 7 and name HG2%)
3.600 1.600 1.600 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.22005E-02 ppm1 8.183 ppm2 1.147 CV 1
ASSI { 1028}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HG2 ))
4.800 2.800 1.200 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.74295E-03 ppm1 8.371 ppm2 1.929 CV 1
OR { 1028}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HG3 ))
ASSI { 1029}
(( segid " " and resid 2 and name H ))
(( segid " " and resid 2 and name HA ))
3.600 1.700 1.700 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.34545E-03 ppm1 8.395 ppm2 4.351 CV 1
ASSI { 1030}
(( segid " " and resid 2 and name H ))
(( segid " " and resid 1 and name HA ))
3.100 1.200 1.200 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.90621E-03 ppm1 8.390 ppm2 4.156 CV 1
ASSI { 1031}
(( segid " " and resid 2 and name H ))
(( segid " " and resid 1 and name HB3 ))
4.200 2.200 1.800 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.21531E-03 ppm1 8.393 ppm2 3.132 CV 1
ASSI { 1032}
(( segid " " and resid 2 and name H ))
(( segid " " and resid 2 and name HB2 ))
4.000 2.000 2.000 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.11050E-02 ppm1 8.392 ppm2 1.471 CV 1
OR { 1032}
(( segid " " and resid 2 and name H ))
(( segid " " and resid 2 and name HB3 ))
OR { 1032}
(( segid " " and resid 2 and name H ))
(( segid " " and resid 2 and name HG ))
ASSI { 1034}
(( segid " " and resid 80 and name HD22))
(( segid " " and resid 80 and name HB3 ))
3.900 1.900 1.900 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.18526E-02 ppm1 6.842 ppm2 2.745 CV 1
ASSI { 1035}
(( segid " " and resid 80 and name HD22))
(( segid " " and resid 80 and name HB2 ))
3.700 1.700 1.700 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.23779E-02 ppm1 6.842 ppm2 2.623 CV 1
ASSI { 1036}
(( segid " " and resid 80 and name HD21))
(( segid " " and resid 80 and name HB3 ))
3.200 1.300 1.300 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.33954E-02 ppm1 7.532 ppm2 2.745 CV 1
ASSI { 1037}
(( segid " " and resid 80 and name HD21))
(( segid " " and resid 80 and name HB2 ))
2.800 1.000 1.000 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.41714E-02 ppm1 7.531 ppm2 2.623 CV 1
ASSI { 1038}
(( segid " " and resid 80 and name HD22))
(( segid " " and resid 80 and name HA ))
5.600 3.900 0.400 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.48504E-03 ppm1 6.841 ppm2 4.633 CV 1
ASSI { 1039}
(( segid " " and resid 80 and name HD21))
(( segid " " and resid 80 and name HA ))
2.700 0.900 0.900 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.77606E-03 ppm1 7.531 ppm2 4.631 CV 1
ASSI { 1040}
(( segid " " and resid 80 and name HD21))
(( segid " " and resid 80 and name HD22))
1.300 0.200 0.900 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.80307E-01 ppm1 7.532 ppm2 6.841 CV 1
ASSI { 1042}
(( segid " " and resid 63 and name HE21))
(( segid " " and resid 63 and name HE22))
1.400 0.200 0.800 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.64670E-01 ppm1 7.391 ppm2 6.806 CV 1
ASSI { 1043}
(( segid " " and resid 63 and name HE21))
(( segid " " and resid 63 and name HA ))
5.500 3.800 0.500 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.42117E-03 ppm1 7.389 ppm2 4.078 CV 1
ASSI { 1044}
(( segid " " and resid 63 and name HE22))
(( segid " " and resid 63 and name HA ))
6.000 6.000 0.000 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.25080E-03 ppm1 6.809 ppm2 4.070 CV 1
ASSI { 1045}
(( segid " " and resid 63 and name HE21))
(( segid " " and resid 63 and name HG2 ))
2.400 0.700 0.700 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.34781E-02 ppm1 7.390 ppm2 2.238 CV 1
ASSI { 1046}
(( segid " " and resid 57 and name HE21))
(( segid " " and resid 57 and name HA ))
4.300 2.300 1.700 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.84942E-03 ppm1 7.550 ppm2 4.499 CV 1
ASSI { 1047}
(( segid " " and resid 57 and name HE21))
(( segid " " and resid 57 and name HG2 ))
2.500 0.800 0.800 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.44530E-02 ppm1 7.550 ppm2 2.391 CV 1
OR { 1047}
(( segid " " and resid 57 and name HE21))
(( segid " " and resid 57 and name HG3 ))
OR { 1047}
(( segid " " and resid 57 and name HE21))
(( segid " " and resid 57 and name HB2 ))
ASSI { 1048}
(( segid " " and resid 57 and name HE22))
(( segid " " and resid 57 and name HG2 ))
3.800 1.800 1.800 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.28156E-02 ppm1 6.848 ppm2 2.393 CV 1
OR { 1048}
(( segid " " and resid 57 and name HE22))
(( segid " " and resid 57 and name HG3 ))
OR { 1048}
(( segid " " and resid 57 and name HE22))
(( segid " " and resid 57 and name HB2 ))
ASSI { 1049}
(( segid " " and resid 57 and name HE22))
(( segid " " and resid 57 and name HB3 ))
4.000 2.000 2.000 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.87307E-03 ppm1 6.845 ppm2 1.979 CV 1
ASSI { 1050}
(( segid " " and resid 57 and name HE22))
(( segid " " and resid 57 and name HA ))
5.900 4.400 0.100 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.55129E-03 ppm1 6.848 ppm2 4.499 CV 1
ASSI { 1051}
(( segid " " and resid 57 and name HE21))
(( segid " " and resid 57 and name HB3 ))
3.400 1.400 1.400 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.10624E-02 ppm1 7.548 ppm2 1.966 CV 1
ASSI { 1052}
(( segid " " and resid 57 and name HE22))
(( segid " " and resid 57 and name HE21))
1.300 0.200 0.900 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.12597E+00 ppm1 6.848 ppm2 7.549 CV 1
ASSI { 1054}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HA ))
4.300 2.300 1.700 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.67433E-03 ppm1 7.517 ppm2 4.449 CV 1
ASSI { 1055}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HG2 ))
2.400 0.700 0.700 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.42518E-02 ppm1 7.517 ppm2 2.269 CV 1
OR { 1055}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HG3 ))
OR { 1055}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HB2 ))
ASSI { 1056}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HB3 ))
4.200 2.200 1.800 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.85652E-03 ppm1 7.519 ppm2 1.912 CV 1
ASSI { 1057}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HE22))
1.200 0.200 1.000 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.10061E+00 ppm1 7.518 ppm2 6.795 CV 1
ASSI { 1059}
(( segid " " and resid 28 and name HE21))
(( segid " " and resid 28 and name HE22))
1.900 0.400 0.400 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.10297E-01 ppm1 7.417 ppm2 6.656 CV 1
ASSI { 1061}
(( segid " " and resid 28 and name HE21))
(( segid " " and resid 28 and name HG2 ))
3.900 1.900 1.900 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.10198E-02 ppm1 7.417 ppm2 2.276 CV 1
ASSI { 1062}
(( segid " " and resid 28 and name HE22))
(( segid " " and resid 28 and name HG2 ))
4.800 2.900 1.200 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.67906E-03 ppm1 6.654 ppm2 2.275 CV 1
ASSI { 1064}
(( segid " " and resid 28 and name HE22))
(( segid " " and resid 28 and name HB3 ))
3.000 1.100 1.100 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.22477E-03 ppm1 6.663 ppm2 1.816 CV 1
ASSI { 1066}
(( segid " " and resid 32 and name HE21))
(( segid " " and resid 32 and name HE22))
2.300 0.700 0.700 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.21531E-02 ppm1 7.894 ppm2 7.075 CV 1
ASSI { 1068}
(( segid " " and resid 32 and name HE22))
(( segid " " and resid 32 and name HA ))
5.400 3.600 0.600 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.45902E-03 ppm1 7.081 ppm2 4.489 CV 1
ASSI { 1069}
(( segid " " and resid 32 and name HE21))
(( segid " " and resid 32 and name HA ))
5.100 3.200 0.900 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.48978E-03 ppm1 7.896 ppm2 4.484 CV 1
ASSI { 1070}
(( segid " " and resid 12 and name HE22))
(( segid " " and resid 12 and name HE21))
1.400 0.200 0.800 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.65354E-01 ppm1 7.452 ppm2 6.816 CV 1
ASSI { 1072}
(( segid " " and resid 58 and name HD21))
(( segid " " and resid 58 and name HD22))
2.600 0.800 0.800 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.20064E-02 ppm1 7.371 ppm2 7.116 CV 1
ASSI { 1074}
(( segid " " and resid 58 and name HD21))
(( segid " " and resid 58 and name HB3 ))
3.200 1.300 1.300 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.67433E-03 ppm1 7.371 ppm2 3.053 CV 1
ASSI { 1075}
(( segid " " and resid 58 and name HD21))
(( segid " " and resid 58 and name HB2 ))
4.400 2.400 1.600 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.43299E-03 ppm1 7.371 ppm2 2.816 CV 1
ASSI { 1076}
(( segid " " and resid 58 and name HD22))
(( segid " " and resid 58 and name HB2 ))
5.700 4.100 0.300 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.25317E-03 ppm1 7.107 ppm2 2.800 CV 1
ASSI { 1077}
(( segid " " and resid 58 and name HD22))
(( segid " " and resid 58 and name HB3 ))
5.200 3.400 0.800 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.39986E-03 ppm1 7.115 ppm2 3.054 CV 1
ASSI { 1078}
(( segid " " and resid 58 and name HD21))
(( segid " " and resid 58 and name HA ))
5.400 3.600 0.600 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.18929E-03 ppm1 7.367 ppm2 4.695 CV 1
ASSI { 1079}
(( segid " " and resid 68 and name HE21))
(( segid " " and resid 68 and name HE22))
1.900 0.400 0.400 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.10896E-01 ppm1 6.448 ppm2 6.774 CV 1
ASSI { 1081}
(( segid " " and resid 41 and name HE22))
(( segid " " and resid 41 and name HE21))
3.000 1.100 1.100 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.76424E-03 ppm1 6.963 ppm2 7.665 CV 1
ASSI { 1083}
(( segid " " and resid 12 and name HE22))
(( segid " " and resid 12 and name HG2 ))
3.300 1.400 1.400 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.36319E-02 ppm1 7.451 ppm2 2.262 CV 1
ASSI { 1084}
(( segid " " and resid 12 and name HE22))
(( segid " " and resid 12 and name HA ))
5.000 3.100 1.000 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.28866E-03 ppm1 7.451 ppm2 4.485 CV 1
ASSI { 1085}
(( segid " " and resid 68 and name HE21))
(( segid " " and resid 68 and name HA ))
5.300 3.500 0.700 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.24608E-03 ppm1 6.446 ppm2 4.000 CV 1
ASSI { 1086}
(( segid " " and resid 68 and name HE21))
(( segid " " and resid 68 and name HG2 ))
4.100 2.100 1.900 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.87781E-03 ppm1 6.447 ppm2 1.864 CV 1
OR { 1086}
(( segid " " and resid 68 and name HE21))
(( segid " " and resid 68 and name HB2 ))
ASSI { 1089}
(( segid " " and resid 32 and name HE21))
(( segid " " and resid 32 and name HG3 ))
4.000 2.000 2.000 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.59389E-03 ppm1 7.897 ppm2 2.120 CV 1
ASSI { 1090}
(( segid " " and resid 32 and name HE21))
(( segid " " and resid 32 and name HG2 ))
2.900 1.000 1.000 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.81156E-03 ppm1 7.894 ppm2 2.270 CV 1
ASSI { 1091}
(( segid " " and resid 85 and name HE ))
(( segid " " and resid 85 and name HD3 ))
3.100 1.200 1.200 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.12706E-02 ppm1 7.181 ppm2 3.091 CV 1
OR { 1091}
(( segid " " and resid 85 and name HE ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 1092}
(( segid " " and resid 70 and name HE ))
(( segid " " and resid 70 and name HD2 ))
3.300 1.400 1.400 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.97246E-03 ppm1 7.201 ppm2 3.071 CV 1
OR { 1092}
(( segid " " and resid 70 and name HE ))
(( segid " " and resid 70 and name HD3 ))
ASSI { 1093}
(( segid " " and resid 50 and name HE ))
(( segid " " and resid 50 and name HG2 ))
4.400 2.400 1.600 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.27684E-03 ppm1 7.075 ppm2 1.472 CV 1
ASSI { 1094}
(( segid " " and resid 50 and name HE ))
(( segid " " and resid 50 and name HG3 ))
5.800 4.200 0.200 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.17272E-03 ppm1 7.092 ppm2 1.237 CV 1
ASSI { 1095}
(( segid " " and resid 72 and name H ))
(( segid " " and resid 71 and name HB2 ))
4.200 2.200 1.800 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.15095E-02 ppm1 8.000 ppm2 1.684 CV 1
ASSI { 1096}
(( segid " " and resid 72 and name H ))
(( segid " " and resid 71 and name HB3 ))
3.500 1.600 1.600 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.14622E-02 ppm1 8.000 ppm2 1.734 CV 1
ASSI { 1097}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 51 and name HB3 ))
2.700 0.900 0.900 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.25128E-02 ppm1 8.726 ppm2 3.385 CV 1
OR { 1097}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 51 and name HB2 ))
ASSI { 1098}
(( segid " " and resid 76 and name H ))
( segid " " and resid 75 and name HG2%)
3.300 1.300 1.300 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.21721E-02 ppm1 8.267 ppm2 1.129 CV 1
ASSI { 1099}
(( segid " " and resid 3 and name H ))
(( segid " " and resid 4 and name HD3 ))
4.600 2.600 1.400 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.55365E-03 ppm1 8.272 ppm2 3.820 CV 1
ASSI { 1100}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 75 and name HB ))
3.700 1.700 1.700 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.31729E-02 ppm1 8.267 ppm2 4.127 CV 1
ASSI { 1101}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 45 and name HA ))
2.900 1.000 1.000 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.30995E-03 ppm1 9.032 ppm2 4.567 CV 1
ASSI { 1102}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 27 and name HA ))
3.300 1.400 1.400 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.76424E-03 ppm1 9.025 ppm2 4.253 CV 1
ASSI { 1103}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 26 and name HA ))
2.300 0.700 0.700 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.30901E-02 ppm1 9.026 ppm2 3.665 CV 1
ASSI { 1104}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 30 and name HB2 ))
3.900 1.900 1.900 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.12895E-02 ppm1 9.034 ppm2 1.960 CV 1
ASSI { 1106}
(( segid " " and resid 49 and name HE22))
(( segid " " and resid 49 and name HA ))
5.800 4.200 0.200 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.51107E-03 ppm1 6.800 ppm2 4.461 CV 1
ASSI { 1107}
(( segid " " and resid 12 and name HE22))
(( segid " " and resid 12 and name HB3 ))
5.600 3.900 0.400 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.36202E-03 ppm1 7.447 ppm2 1.996 CV 1
ASSI { 1108}
(( segid " " and resid 49 and name HE22))
(( segid " " and resid 49 and name HB3 ))
4.000 2.000 2.000 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.10931E-02 ppm1 6.803 ppm2 1.922 CV 1
ASSI { 1109}
(( segid " " and resid 28 and name HE21))
(( segid " " and resid 28 and name HB2 ))
5.200 3.400 0.800 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.28392E-03 ppm1 7.420 ppm2 2.030 CV 1
ASSI { 1110}
(( segid " " and resid 28 and name HE21))
(( segid " " and resid 28 and name HB3 ))
5.900 4.400 0.100 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.20584E-03 ppm1 7.432 ppm2 1.832 CV 1
ASSI { 1115}
(( segid " " and resid 49 and name HE21))
( segid " " and resid 48 and name HB% )
3.900 1.900 1.900 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.15048E-02 ppm1 7.518 ppm2 1.419 CV 1
ASSI { 1116}
(( segid " " and resid 49 and name HE22))
( segid " " and resid 48 and name HB% )
4.400 2.400 1.600 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.11050E-02 ppm1 6.796 ppm2 1.421 CV 1
ASSI { 1119}
(( segid " " and resid 80 and name HD21))
(( segid " " and resid 80 and name H ))
4.400 2.400 1.600 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.92039E-03 ppm1 7.533 ppm2 8.248 CV 1
ASSI { 1120}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 65 and name H ))
4.800 2.900 1.200 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.31469E-03 ppm1 7.861 ppm2 8.154 CV 1
ASSI { 1122}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 44 and name H ))
2.700 0.900 0.900 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.43063E-03 ppm1 9.033 ppm2 9.533 CV 1
ASSI { 1123}
(( segid " " and resid 64 and name HE1 ))
(( segid " " and resid 64 and name HZ2 ))
2.700 0.900 0.900 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.49285E-02 ppm1 9.992 ppm2 7.223 CV 1
ASSI { 1124}
(( segid " " and resid 64 and name HE1 ))
(( segid " " and resid 64 and name HD1 ))
2.600 0.800 0.800 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.70461E-02 ppm1 9.992 ppm2 6.839 CV 1
ASSI { 1125}
(( segid " " and resid 64 and name HE1 ))
(( segid " " and resid 64 and name HA ))
4.700 2.700 1.300 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.56312E-03 ppm1 9.993 ppm2 4.263 CV 1
ASSI { 1126}
(( segid " " and resid 64 and name HE1 ))
(( segid " " and resid 64 and name HB3 ))
4.700 2.700 1.300 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.45665E-03 ppm1 9.995 ppm2 3.045 CV 1
ASSI { 1127}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HE21))
5.300 3.500 0.700 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.17509E-03 ppm1 7.925 ppm2 6.444 CV 1
ASSI { 1128}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 60 and name H ))
2.800 1.000 1.000 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.32178E-03 ppm1 7.643 ppm2 8.695 CV 1
ASSI { 1129}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 47 and name H ))
2.700 0.900 0.900 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.42589E-03 ppm1 8.412 ppm2 8.720 CV 1
ASSI { 1131}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 21 and name H ))
2.600 0.800 0.800 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.58679E-03 ppm1 7.801 ppm2 7.919 CV 1
ASSI { 1132}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 69 and name H ))
4.800 2.900 1.200 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.28392E-03 ppm1 8.023 ppm2 8.315 CV 1
ASSI { 1133}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 64 and name H ))
2.900 1.000 1.000 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.29576E-03 ppm1 8.021 ppm2 7.723 CV 1
ASSI { 1134}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 61 and name H ))
3.000 1.100 1.100 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.23898E-03 ppm1 7.860 ppm2 7.549 CV 1
ASSI { 1137}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 45 and name H ))
3.200 1.300 1.300 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.15616E-03 ppm1 9.763 ppm2 9.074 CV 1
ASSI { 1138}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 58 and name H ))
3.000 1.100 1.100 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.25553E-03 ppm1 7.542 ppm2 8.249 CV 1
ASSI { 1139}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 65 and name H ))
2.800 1.000 1.000 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.35964E-03 ppm1 7.913 ppm2 8.132 CV 1
ASSI { 1140}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 68 and name H ))
2.500 0.800 0.800 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.70273E-03 ppm1 8.029 ppm2 7.909 CV 1
ASSI { 1141}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 51 and name H ))
5.000 3.100 1.000 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.26973E-03 ppm1 8.731 ppm2 8.523 CV 1
ASSI { 1142}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 71 and name HA ))
2.800 1.000 1.000 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.37621E-03 ppm1 8.310 ppm2 4.156 CV 1
ASSI { 1144}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 67 and name HA ))
3.200 1.200 1.200 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.17272E-03 ppm1 7.983 ppm2 4.456 CV 1
ASSI { 1145}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 61 and name HA ))
2.600 0.800 0.800 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.58443E-03 ppm1 7.726 ppm2 4.010 CV 1
ASSI { 1146}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 86 and name HE3 ))
6.000 4.900 0.000 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.22005E-03 ppm1 8.375 ppm2 2.925 CV 1
OR { 1146}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 86 and name HE2 ))
ASSI { 1147}
(( segid " " and resid 72 and name H ))
(( segid " " and resid 73 and name HA ))
5.000 3.200 1.000 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.18455E-03 ppm1 8.001 ppm2 4.594 CV 1
ASSI { 222}
(( segid " " and resid 68 and name HG2 ))
(( segid " " and resid 68 and name HE21))
4.000 2.000 2.000 peak 222 spectrum 1 weight 0.10000E+01 volume 0.98279E-03 ppm1 1.878 ppm2 6.459 CV 1
ASSI { 684}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 23 and name HD2%)
2.400 0.700 0.700 peak 684 spectrum 1 weight 0.10000E+01 volume 0.93282E-03 ppm1 1.499 ppm2 0.243 CV 1
ASSI { 816}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB3 ))
2.300 0.700 0.700 peak 816 spectrum 1 weight 0.10000E+01 volume 0.97003E-02 ppm1 4.472 ppm2 1.926 CV 1
ASSI { 817}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB2 ))
2.100 0.500 0.500 peak 817 spectrum 1 weight 0.10000E+01 volume 0.75792E-02 ppm1 4.474 ppm2 2.063 CV 1
ASSI { 818}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HG2 ))
3.100 1.200 1.200 peak 818 spectrum 1 weight 0.10000E+01 volume 0.12882E-02 ppm1 4.471 ppm2 2.565 CV 1
ASSI { 820}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 87 and name HB2 ))
1.200 0.200 1.000 peak 820 spectrum 1 weight 0.10000E+01 volume 0.82276E-01 ppm1 1.934 ppm2 2.057 CV 1
ASSI { 827}
(( segid " " and resid 87 and name HG3 ))
(( segid " " and resid 87 and name HA ))
3.900 1.900 1.900 peak 827 spectrum 1 weight 0.10000E+01 volume 0.14992E-02 ppm1 2.462 ppm2 4.469 CV 1
ASSI { 829}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HG2 ))
3.100 1.200 1.200 peak 829 spectrum 1 weight 0.10000E+01 volume 0.56635E-02 ppm1 4.239 ppm2 1.355 CV 1
ASSI { 830}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HE2 ))
5.300 3.500 0.700 peak 830 spectrum 1 weight 0.10000E+01 volume 0.49972E-03 ppm1 4.236 ppm2 2.906 CV 1
OR { 830}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HE3 ))
ASSI { 831}
(( segid " " and resid 86 and name HB3 ))
(( segid " " and resid 86 and name HG3 ))
2.200 0.600 0.600 peak 831 spectrum 1 weight 0.10000E+01 volume 0.78178E-02 ppm1 1.773 ppm2 1.361 CV 1
ASSI { 832}
(( segid " " and resid 86 and name HB3 ))
(( segid " " and resid 86 and name HA ))
2.600 0.900 0.900 peak 832 spectrum 1 weight 0.10000E+01 volume 0.72181E-02 ppm1 1.773 ppm2 4.239 CV 1
ASSI { 833}
(( segid " " and resid 86 and name HB2 ))
(( segid " " and resid 86 and name HA ))
2.200 0.600 0.600 peak 833 spectrum 1 weight 0.10000E+01 volume 0.80067E-02 ppm1 1.697 ppm2 4.234 CV 1
ASSI { 834}
(( segid " " and resid 78 and name HB3 ))
(( segid " " and resid 78 and name HA ))
2.400 0.700 0.700 peak 834 spectrum 1 weight 0.10000E+01 volume 0.87341E-02 ppm1 1.664 ppm2 4.179 CV 1
ASSI { 835}
(( segid " " and resid 86 and name HB3 ))
(( segid " " and resid 86 and name H ))
2.500 0.800 0.800 peak 835 spectrum 1 weight 0.10000E+01 volume 0.23321E-02 ppm1 1.778 ppm2 8.232 CV 1
ASSI { 836}
(( segid " " and resid 86 and name HB3 ))
(( segid " " and resid 87 and name H ))
3.000 1.100 1.100 peak 836 spectrum 1 weight 0.10000E+01 volume 0.75514E-03 ppm1 1.773 ppm2 8.372 CV 1
ASSI { 837}
(( segid " " and resid 86 and name HE3 ))
(( segid " " and resid 86 and name H ))
4.700 2.800 1.300 peak 837 spectrum 1 weight 0.10000E+01 volume 0.92727E-03 ppm1 2.919 ppm2 8.228 CV 1
OR { 837}
(( segid " " and resid 86 and name HE2 ))
(( segid " " and resid 86 and name H ))
ASSI { 838}
(( segid " " and resid 21 and name HD2 ))
(( segid " " and resid 21 and name HA ))
2.800 1.000 1.000 peak 838 spectrum 1 weight 0.10000E+01 volume 0.26819E-02 ppm1 1.591 ppm2 3.789 CV 1
OR { 838}
(( segid " " and resid 21 and name HD3 ))
(( segid " " and resid 21 and name HA ))
ASSI { 840}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HE2 ))
3.000 1.100 1.100 peak 840 spectrum 1 weight 0.10000E+01 volume 0.77846E-02 ppm1 1.389 ppm2 2.920 CV 1
OR { 840}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 842}
(( segid " " and resid 85 and name HD2 ))
(( segid " " and resid 85 and name HA ))
3.300 1.400 1.400 peak 842 spectrum 1 weight 0.10000E+01 volume 0.36202E-02 ppm1 3.101 ppm2 4.245 CV 1
OR { 842}
(( segid " " and resid 85 and name HD3 ))
(( segid " " and resid 85 and name HA ))
ASSI { 843}
(( segid " " and resid 85 and name HD3 ))
(( segid " " and resid 85 and name HG2 ))
2.000 0.500 0.500 peak 843 spectrum 1 weight 0.10000E+01 volume 0.19117E-01 ppm1 3.100 ppm2 1.529 CV 1
OR { 843}
(( segid " " and resid 85 and name HD2 ))
(( segid " " and resid 85 and name HG3 ))
OR { 843}
(( segid " " and resid 85 and name HD2 ))
(( segid " " and resid 85 and name HG2 ))
OR { 843}
(( segid " " and resid 85 and name HD3 ))
(( segid " " and resid 85 and name HG3 ))
ASSI { 844}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HG2 ))
1.800 0.400 0.400 peak 844 spectrum 1 weight 0.10000E+01 volume 0.29333E-01 ppm1 1.755 ppm2 1.530 CV 1
OR { 844}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HG3 ))
ASSI { 845}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HG2 ))
2.000 0.500 0.500 peak 845 spectrum 1 weight 0.10000E+01 volume 0.27446E-01 ppm1 1.673 ppm2 1.528 CV 1
OR { 845}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HG3 ))
ASSI { 846}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HD3 ))
2.300 0.700 0.700 peak 846 spectrum 1 weight 0.10000E+01 volume 0.43198E-02 ppm1 1.674 ppm2 3.100 CV 1
OR { 846}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 847}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HD3 ))
3.000 1.100 1.100 peak 847 spectrum 1 weight 0.10000E+01 volume 0.60911E-02 ppm1 1.760 ppm2 3.085 CV 1
OR { 847}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 848}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HA ))
2.700 0.900 0.900 peak 848 spectrum 1 weight 0.10000E+01 volume 0.64576E-02 ppm1 1.755 ppm2 4.252 CV 1
ASSI { 849}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HA ))
2.200 0.600 0.600 peak 849 spectrum 1 weight 0.10000E+01 volume 0.65741E-02 ppm1 1.672 ppm2 4.252 CV 1
ASSI { 852}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 86 and name H ))
4.300 2.300 1.700 peak 852 spectrum 1 weight 0.10000E+01 volume 0.10772E-02 ppm1 1.753 ppm2 8.243 CV 1
ASSI { 853}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 86 and name H ))
3.400 1.400 1.400 peak 853 spectrum 1 weight 0.10000E+01 volume 0.12160E-02 ppm1 1.674 ppm2 8.242 CV 1
ASSI { 857}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HA ))
2.800 1.000 1.000 peak 857 spectrum 1 weight 0.10000E+01 volume 0.78901E-02 ppm1 1.538 ppm2 4.251 CV 1
OR { 857}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HA ))
ASSI { 859}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 84 and name HA ))
2.600 0.900 0.900 peak 859 spectrum 1 weight 0.10000E+01 volume 0.61854E-02 ppm1 1.571 ppm2 4.253 CV 1
ASSI { 860}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 77 and name HD3 ))
3.000 1.100 1.100 peak 860 spectrum 1 weight 0.10000E+01 volume 0.11327E-02 ppm1 0.794 ppm2 3.747 CV 1
ASSI { 861}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HA ))
3.300 1.400 1.400 peak 861 spectrum 1 weight 0.10000E+01 volume 0.54692E-02 ppm1 0.799 ppm2 4.236 CV 1
ASSI { 862}
(( segid " " and resid 83 and name HB3 ))
(( segid " " and resid 83 and name HA ))
2.600 0.900 0.900 peak 862 spectrum 1 weight 0.10000E+01 volume 0.62577E-02 ppm1 2.025 ppm2 4.369 CV 1
ASSI { 863}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HA ))
2.400 0.700 0.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.51693E-02 ppm1 1.949 ppm2 4.368 CV 1
ASSI { 864}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 83 and name HA ))
4.000 2.000 2.000 peak 864 spectrum 1 weight 0.10000E+01 volume 0.23986E-02 ppm1 2.517 ppm2 4.380 CV 1
ASSI { 868}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HB2 ))
2.400 0.700 0.700 peak 868 spectrum 1 weight 0.10000E+01 volume 0.53194E-02 ppm1 4.428 ppm2 3.082 CV 1
ASSI { 869}
(( segid " " and resid 81 and name HA ))
( segid " " and resid 81 and name HD% )
3.500 1.500 1.500 peak 869 spectrum 1 weight 0.10000E+01 volume 0.30539E-02 ppm1 4.426 ppm2 7.098 CV 1
ASSI { 872}
(( segid " " and resid 81 and name HB2 ))
( segid " " and resid 81 and name HD% )
2.500 0.800 0.800 peak 872 spectrum 1 weight 0.10000E+01 volume 0.48252E-02 ppm1 3.081 ppm2 7.098 CV 1
ASSI { 877}
(( segid " " and resid 81 and name HB3 ))
( segid " " and resid 81 and name HD% )
2.800 0.900 0.900 peak 877 spectrum 1 weight 0.10000E+01 volume 0.43420E-02 ppm1 2.890 ppm2 7.099 CV 1
ASSI { 878}
(( segid " " and resid 81 and name HB3 ))
(( segid " " and resid 81 and name HA ))
3.000 1.100 1.100 peak 878 spectrum 1 weight 0.10000E+01 volume 0.45031E-02 ppm1 2.892 ppm2 4.436 CV 1
ASSI { 879}
(( segid " " and resid 9 and name HB3 ))
( segid " " and resid 11 and name HG2%)
4.600 2.600 1.400 peak 879 spectrum 1 weight 0.10000E+01 volume 0.77734E-03 ppm1 2.890 ppm2 1.077 CV 1
ASSI { 880}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB3 ))
2.800 1.000 1.000 peak 880 spectrum 1 weight 0.10000E+01 volume 0.45641E-02 ppm1 4.625 ppm2 2.746 CV 1
ASSI { 889}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HA ))
2.600 0.800 0.800 peak 889 spectrum 1 weight 0.10000E+01 volume 0.31594E-02 ppm1 2.623 ppm2 4.627 CV 1
ASSI { 890}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB3 ))
2.500 0.800 0.800 peak 890 spectrum 1 weight 0.10000E+01 volume 0.52748E-02 ppm1 4.246 ppm2 1.245 CV 1
ASSI { 891}
(( segid " " and resid 79 and name HA ))
( segid " " and resid 79 and name HD1%)
2.700 0.900 0.900 peak 891 spectrum 1 weight 0.10000E+01 volume 0.88729E-02 ppm1 4.246 ppm2 0.687 CV 1
ASSI { 892}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB2 ))
2.300 0.700 0.700 peak 892 spectrum 1 weight 0.10000E+01 volume 0.74737E-02 ppm1 4.245 ppm2 1.434 CV 1
OR { 892}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HG ))
ASSI { 894}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HB3 ))
4.100 2.100 1.900 peak 894 spectrum 1 weight 0.10000E+01 volume 0.70516E-03 ppm1 4.249 ppm2 2.755 CV 1
ASSI { 895}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HB2 ))
3.700 1.700 1.700 peak 895 spectrum 1 weight 0.10000E+01 volume 0.68850E-03 ppm1 4.249 ppm2 2.611 CV 1
ASSI { 896}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 79 and name HB3 ))
1.600 0.300 0.600 peak 896 spectrum 1 weight 0.10000E+01 volume 0.20705E-01 ppm1 1.433 ppm2 1.244 CV 1
ASSI { 897}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 79 and name HA ))
2.500 0.800 0.800 peak 897 spectrum 1 weight 0.10000E+01 volume 0.42477E-02 ppm1 1.433 ppm2 4.238 CV 1
ASSI { 898}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 79 and name H ))
3.000 1.100 1.100 peak 898 spectrum 1 weight 0.10000E+01 volume 0.39645E-02 ppm1 1.433 ppm2 8.093 CV 1
ASSI { 902}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 79 and name HB2 ))
1.600 0.300 0.600 peak 902 spectrum 1 weight 0.10000E+01 volume 0.27130E-01 ppm1 1.245 ppm2 1.436 CV 1
OR { 902}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 79 and name HG ))
ASSI { 903}
(( segid " " and resid 79 and name HG ))
(( segid " " and resid 79 and name H ))
3.300 1.400 1.400 peak 903 spectrum 1 weight 0.10000E+01 volume 0.36758E-02 ppm1 1.444 ppm2 8.091 CV 1
ASSI { 904}
(( segid " " and resid 72 and name HG ))
(( segid " " and resid 72 and name H ))
3.600 1.600 1.600 peak 904 spectrum 1 weight 0.10000E+01 volume 0.23931E-02 ppm1 1.437 ppm2 8.002 CV 1
ASSI { 905}
( segid " " and resid 79 and name HD2%)
(( segid " " and resid 79 and name HB2 ))
1.900 0.400 0.400 peak 905 spectrum 1 weight 0.10000E+01 volume 0.23681E-01 ppm1 0.733 ppm2 1.426 CV 1
OR { 905}
( segid " " and resid 79 and name HD2%)
(( segid " " and resid 79 and name HG ))
ASSI { 906}
( segid " " and resid 79 and name HD2%)
(( segid " " and resid 79 and name HB3 ))
2.900 1.000 1.000 peak 906 spectrum 1 weight 0.10000E+01 volume 0.14753E-01 ppm1 0.730 ppm2 1.243 CV 1
ASSI { 907}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name H ))
3.400 1.500 1.500 peak 907 spectrum 1 weight 0.10000E+01 volume 0.27096E-02 ppm1 0.740 ppm2 7.225 CV 1
ASSI { 908}
( segid " " and resid 79 and name HD1%)
(( segid " " and resid 79 and name HB3 ))
2.700 0.900 0.900 peak 908 spectrum 1 weight 0.10000E+01 volume 0.53915E-02 ppm1 0.675 ppm2 1.250 CV 1
ASSI { 909}
( segid " " and resid 79 and name HD1%)
(( segid " " and resid 79 and name HG ))
2.200 0.600 0.600 peak 909 spectrum 1 weight 0.10000E+01 volume 0.13387E-01 ppm1 0.674 ppm2 1.442 CV 1
OR { 909}
( segid " " and resid 79 and name HD1%)
(( segid " " and resid 79 and name HB2 ))
ASSI { 911}
( segid " " and resid 79 and name HD1%)
(( segid " " and resid 80 and name H ))
3.800 1.800 1.800 peak 911 spectrum 1 weight 0.10000E+01 volume 0.13937E-02 ppm1 0.670 ppm2 8.257 CV 1
ASSI { 912}
( segid " " and resid 79 and name HD1%)
(( segid " " and resid 79 and name H ))
2.700 0.900 0.900 peak 912 spectrum 1 weight 0.10000E+01 volume 0.15380E-02 ppm1 0.674 ppm2 8.091 CV 1
ASSI { 913}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HE2 ))
4.700 2.700 1.300 peak 913 spectrum 1 weight 0.10000E+01 volume 0.73293E-03 ppm1 4.205 ppm2 2.915 CV 1
OR { 913}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HE3 ))
ASSI { 914}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB3 ))
2.700 0.900 0.900 peak 914 spectrum 1 weight 0.10000E+01 volume 0.27041E-02 ppm1 4.219 ppm2 2.460 CV 1
ASSI { 915}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB2 ))
2.800 1.000 1.000 peak 915 spectrum 1 weight 0.10000E+01 volume 0.36480E-02 ppm1 4.214 ppm2 2.604 CV 1
ASSI { 916}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HA ))
2.100 0.600 0.600 peak 916 spectrum 1 weight 0.10000E+01 volume 0.90839E-02 ppm1 1.721 ppm2 4.181 CV 1
ASSI { 917}
(( segid " " and resid 71 and name HB3 ))
(( segid " " and resid 68 and name HA ))
2.100 0.600 0.600 peak 917 spectrum 1 weight 0.10000E+01 volume 0.17324E-02 ppm1 1.708 ppm2 3.997 CV 1
ASSI { 918}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 68 and name HA ))
2.200 0.600 0.600 peak 918 spectrum 1 weight 0.10000E+01 volume 0.16269E-02 ppm1 1.675 ppm2 3.995 CV 1
ASSI { 919}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HG2 ))
2.200 0.600 0.600 peak 919 spectrum 1 weight 0.10000E+01 volume 0.88618E-02 ppm1 1.671 ppm2 1.422 CV 1
OR { 919}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HG2 ))
ASSI { 920}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 20 and name HB3 ))
3.100 1.200 1.200 peak 920 spectrum 1 weight 0.10000E+01 volume 0.12327E-02 ppm1 1.675 ppm2 2.613 CV 1
OR { 920}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 20 and name HB3 ))
OR { 920}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 20 and name HB2 ))
OR { 920}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 923}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name H ))
4.700 2.800 1.300 peak 923 spectrum 1 weight 0.10000E+01 volume 0.10605E-02 ppm1 1.675 ppm2 7.645 CV 1
ASSI { 924}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HA ))
3.300 1.300 1.300 peak 924 spectrum 1 weight 0.10000E+01 volume 0.41866E-02 ppm1 1.387 ppm2 4.337 CV 1
ASSI { 925}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name H ))
2.000 0.500 0.500 peak 925 spectrum 1 weight 0.10000E+01 volume 0.17841E-01 ppm1 4.333 ppm2 8.209 CV 1
ASSI { 926}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HD3 ))
2.900 1.000 1.000 peak 926 spectrum 1 weight 0.10000E+01 volume 0.13270E-02 ppm1 4.332 ppm2 3.740 CV 1
ASSI { 927}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HD2 ))
4.200 2.200 1.800 peak 927 spectrum 1 weight 0.10000E+01 volume 0.79956E-03 ppm1 4.327 ppm2 3.512 CV 1
ASSI { 928}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB3 ))
2.000 0.500 0.500 peak 928 spectrum 1 weight 0.10000E+01 volume 0.14114E-01 ppm1 4.333 ppm2 2.169 CV 1
ASSI { 929}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HG3 ))
2.800 1.000 1.000 peak 929 spectrum 1 weight 0.10000E+01 volume 0.46863E-02 ppm1 4.334 ppm2 1.871 CV 1
OR { 929}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HG2 ))
ASSI { 930}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB2 ))
2.700 0.900 0.900 peak 930 spectrum 1 weight 0.10000E+01 volume 0.77068E-02 ppm1 4.332 ppm2 1.752 CV 1
ASSI { 931}
(( segid " " and resid 77 and name HD3 ))
( segid " " and resid 76 and name HD2%)
1.900 0.500 0.500 peak 931 spectrum 1 weight 0.10000E+01 volume 0.31761E-02 ppm1 3.738 ppm2 0.788 CV 1
ASSI { 932}
(( segid " " and resid 77 and name HD2 ))
( segid " " and resid 76 and name HD2%)
1.900 0.400 0.400 peak 932 spectrum 1 weight 0.10000E+01 volume 0.39201E-02 ppm1 3.501 ppm2 0.788 CV 1
ASSI { 934}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HG3 ))
2.200 0.600 0.600 peak 934 spectrum 1 weight 0.10000E+01 volume 0.82955E-02 ppm1 3.739 ppm2 1.870 CV 1
OR { 934}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HG2 ))
ASSI { 935}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HB2 ))
3.800 1.800 1.800 peak 935 spectrum 1 weight 0.10000E+01 volume 0.17157E-02 ppm1 3.735 ppm2 1.746 CV 1
ASSI { 936}
(( segid " " and resid 77 and name HD2 ))
(( segid " " and resid 76 and name HB3 ))
2.300 0.600 0.600 peak 936 spectrum 1 weight 0.10000E+01 volume 0.33870E-02 ppm1 3.502 ppm2 1.473 CV 1
ASSI { 937}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 76 and name HB3 ))
2.600 0.900 0.900 peak 937 spectrum 1 weight 0.10000E+01 volume 0.21154E-02 ppm1 3.737 ppm2 1.471 CV 1
ASSI { 938}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HB3 ))
3.700 1.800 1.800 peak 938 spectrum 1 weight 0.10000E+01 volume 0.14881E-02 ppm1 3.735 ppm2 2.171 CV 1
ASSI { 939}
(( segid " " and resid 77 and name HD2 ))
(( segid " " and resid 77 and name HB3 ))
4.000 2.000 2.000 peak 939 spectrum 1 weight 0.10000E+01 volume 0.17880E-02 ppm1 3.502 ppm2 2.169 CV 1
ASSI { 940}
(( segid " " and resid 77 and name HD3 ))
(( segid " " and resid 77 and name HD2 ))
1.600 0.300 0.600 peak 940 spectrum 1 weight 0.10000E+01 volume 0.21804E-01 ppm1 3.739 ppm2 3.502 CV 1
ASSI { 943}
(( segid " " and resid 77 and name HD2 ))
(( segid " " and resid 76 and name HA ))
2.600 0.800 0.800 peak 943 spectrum 1 weight 0.10000E+01 volume 0.91560E-02 ppm1 3.504 ppm2 4.534 CV 1
ASSI { 948}
(( segid " " and resid 26 and name HB ))
( segid " " and resid 26 and name HG2%)
2.400 0.700 0.700 peak 948 spectrum 1 weight 0.10000E+01 volume 0.48140E-02 ppm1 2.162 ppm2 0.691 CV 1
ASSI { 950}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HD2 ))
3.100 1.200 1.200 peak 950 spectrum 1 weight 0.10000E+01 volume 0.36147E-02 ppm1 1.751 ppm2 3.510 CV 1
ASSI { 951}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 77 and name HB3 ))
2.300 0.600 0.600 peak 951 spectrum 1 weight 0.10000E+01 volume 0.89117E-02 ppm1 1.869 ppm2 2.172 CV 1
OR { 951}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 77 and name HB3 ))
ASSI { 952}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 77 and name HB2 ))
2.200 0.600 0.600 peak 952 spectrum 1 weight 0.10000E+01 volume 0.11949E-01 ppm1 1.867 ppm2 1.739 CV 1
OR { 952}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 77 and name HB2 ))
ASSI { 953}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 77 and name HD2 ))
2.300 0.600 0.600 peak 953 spectrum 1 weight 0.10000E+01 volume 0.74458E-02 ppm1 1.868 ppm2 3.505 CV 1
OR { 953}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 77 and name HD2 ))
ASSI { 958}
(( segid " " and resid 75 and name HB ))
( segid " " and resid 75 and name HG2%)
1.900 0.500 0.500 peak 958 spectrum 1 weight 0.10000E+01 volume 0.29273E-01 ppm1 4.130 ppm2 1.138 CV 1
ASSI { 960}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HB ))
2.100 0.600 0.600 peak 960 spectrum 1 weight 0.10000E+01 volume 0.16774E-01 ppm1 4.300 ppm2 4.135 CV 1
ASSI { 961}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 75 and name HG2%)
2.500 0.800 0.800 peak 961 spectrum 1 weight 0.10000E+01 volume 0.16374E-01 ppm1 4.299 ppm2 1.119 CV 1
ASSI { 963}
(( segid " " and resid 74 and name HA2 ))
(( segid " " and resid 75 and name H ))
3.100 1.200 1.200 peak 963 spectrum 1 weight 0.10000E+01 volume 0.19934E-02 ppm1 3.956 ppm2 8.008 CV 1
ASSI { 964}
(( segid " " and resid 74 and name HA3 ))
(( segid " " and resid 75 and name H ))
3.200 1.300 1.300 peak 964 spectrum 1 weight 0.10000E+01 volume 0.19545E-02 ppm1 3.918 ppm2 8.002 CV 1
ASSI { 966}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HB3 ))
2.700 0.900 0.900 peak 966 spectrum 1 weight 0.10000E+01 volume 0.73126E-02 ppm1 4.589 ppm2 3.196 CV 1
ASSI { 967}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HB2 ))
2.400 0.700 0.700 peak 967 spectrum 1 weight 0.10000E+01 volume 0.66020E-02 ppm1 4.590 ppm2 3.113 CV 1
ASSI { 970}
(( segid " " and resid 73 and name HB3 ))
(( segid " " and resid 73 and name HD2 ))
3.900 1.900 1.900 peak 970 spectrum 1 weight 0.10000E+01 volume 0.15491E-02 ppm1 3.195 ppm2 7.123 CV 1
ASSI { 972}
(( segid " " and resid 73 and name HB3 ))
(( segid " " and resid 73 and name H ))
3.000 1.100 1.100 peak 972 spectrum 1 weight 0.10000E+01 volume 0.89949E-03 ppm1 3.196 ppm2 8.223 CV 1
ASSI { 973}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name H ))
2.400 0.700 0.700 peak 973 spectrum 1 weight 0.10000E+01 volume 0.39034E-02 ppm1 4.201 ppm2 7.999 CV 1
ASSI { 974}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB3 ))
2.500 0.800 0.800 peak 974 spectrum 1 weight 0.10000E+01 volume 0.66519E-02 ppm1 4.200 ppm2 1.502 CV 1
ASSI { 975}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB2 ))
2.100 0.600 0.600 peak 975 spectrum 1 weight 0.10000E+01 volume 0.85286E-02 ppm1 4.200 ppm2 1.389 CV 1
ASSI { 976}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 72 and name HD1%)
2.900 1.000 1.000 peak 976 spectrum 1 weight 0.10000E+01 volume 0.14026E-01 ppm1 4.200 ppm2 0.743 CV 1
ASSI { 978}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HB3 ))
1.500 0.300 0.700 peak 978 spectrum 1 weight 0.10000E+01 volume 0.28030E-01 ppm1 1.382 ppm2 1.503 CV 1
ASSI { 979}
( segid " " and resid 72 and name HD2%)
(( segid " " and resid 72 and name H ))
3.600 1.600 1.600 peak 979 spectrum 1 weight 0.10000E+01 volume 0.24652E-02 ppm1 0.784 ppm2 8.006 CV 1
ASSI { 980}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 72 and name HG ))
1.900 0.500 0.500 peak 980 spectrum 1 weight 0.10000E+01 volume 0.20906E-01 ppm1 0.734 ppm2 1.431 CV 1
ASSI { 982}
( segid " " and resid 72 and name HD1%)
(( segid " " and resid 72 and name H ))
3.500 1.600 1.600 peak 982 spectrum 1 weight 0.10000E+01 volume 0.24042E-02 ppm1 0.736 ppm2 8.003 CV 1
ASSI { 983}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HE2 ))
4.800 2.900 1.200 peak 983 spectrum 1 weight 0.10000E+01 volume 0.67185E-03 ppm1 4.152 ppm2 2.877 CV 1
OR { 983}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HE3 ))
ASSI { 984}
(( segid " " and resid 71 and name HE3 ))
(( segid " " and resid 71 and name HD2 ))
1.800 0.400 0.400 peak 984 spectrum 1 weight 0.10000E+01 volume 0.36763E-01 ppm1 2.882 ppm2 1.562 CV 1
OR { 984}
(( segid " " and resid 71 and name HE2 ))
(( segid " " and resid 71 and name HD3 ))
OR { 984}
(( segid " " and resid 71 and name HE2 ))
(( segid " " and resid 71 and name HD2 ))
OR { 984}
(( segid " " and resid 71 and name HE3 ))
(( segid " " and resid 71 and name HD3 ))
ASSI { 985}
(( segid " " and resid 71 and name HE2 ))
(( segid " " and resid 71 and name HG2 ))
2.000 0.500 0.500 peak 985 spectrum 1 weight 0.10000E+01 volume 0.11122E-01 ppm1 2.883 ppm2 1.268 CV 1
OR { 985}
(( segid " " and resid 71 and name HE3 ))
(( segid " " and resid 71 and name HG2 ))
ASSI { 986}
(( segid " " and resid 71 and name HE2 ))
(( segid " " and resid 71 and name H ))
4.600 2.700 1.400 peak 986 spectrum 1 weight 0.10000E+01 volume 0.90505E-03 ppm1 2.881 ppm2 7.994 CV 1
OR { 986}
(( segid " " and resid 71 and name HE3 ))
(( segid " " and resid 71 and name H ))
ASSI { 988}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 71 and name HA ))
2.300 0.600 0.600 peak 988 spectrum 1 weight 0.10000E+01 volume 0.39423E-02 ppm1 1.281 ppm2 4.151 CV 1
ASSI { 989}
(( segid " " and resid 1 and name HA ))
( segid " " and resid 1 and name HD% )
2.900 1.000 1.000 peak 989 spectrum 1 weight 0.10000E+01 volume 0.27762E-02 ppm1 4.116 ppm2 7.149 CV 1
ASSI { 990}
(( segid " " and resid 24 and name HD3 ))
(( segid " " and resid 24 and name HB3 ))
2.000 0.500 0.500 peak 990 spectrum 1 weight 0.10000E+01 volume 0.13026E-01 ppm1 3.079 ppm2 1.756 CV 1
OR { 990}
(( segid " " and resid 24 and name HD3 ))
(( segid " " and resid 24 and name HG2 ))
ASSI { 992}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 70 and name H ))
2.800 1.000 1.000 peak 992 spectrum 1 weight 0.10000E+01 volume 0.35369E-02 ppm1 1.762 ppm2 8.009 CV 1
ASSI { 993}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name H ))
2.900 1.000 1.000 peak 993 spectrum 1 weight 0.10000E+01 volume 0.34037E-02 ppm1 1.710 ppm2 8.008 CV 1
ASSI { 994}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HA ))
2.500 0.800 0.800 peak 994 spectrum 1 weight 0.10000E+01 volume 0.50693E-02 ppm1 1.711 ppm2 4.126 CV 1
ASSI { 995}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HD3 ))
3.400 1.400 1.400 peak 995 spectrum 1 weight 0.10000E+01 volume 0.39922E-02 ppm1 1.708 ppm2 3.062 CV 1
OR { 995}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HD2 ))
ASSI { 996}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 70 and name HD3 ))
2.500 0.800 0.800 peak 996 spectrum 1 weight 0.10000E+01 volume 0.65741E-02 ppm1 1.584 ppm2 3.061 CV 1
OR { 996}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 70 and name HD2 ))
ASSI { 997}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 70 and name HA ))
2.400 0.700 0.700 peak 997 spectrum 1 weight 0.10000E+01 volume 0.37146E-02 ppm1 1.586 ppm2 4.127 CV 1
ASSI { 998}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 70 and name HA ))
3.300 1.400 1.400 peak 998 spectrum 1 weight 0.10000E+01 volume 0.38590E-02 ppm1 1.517 ppm2 4.126 CV 1
ASSI { 999}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 70 and name H ))
3.700 1.700 1.700 peak 999 spectrum 1 weight 0.10000E+01 volume 0.21987E-02 ppm1 1.585 ppm2 8.011 CV 1
ASSI { 1000}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name H ))
2.900 1.100 1.100 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.22877E-02 ppm1 4.026 ppm2 8.335 CV 1
ASSI { 1001}
(( segid " " and resid 33 and name HG2 ))
( segid " " and resid 31 and name HD1%)
2.100 0.600 0.600 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.17213E-02 ppm1 2.227 ppm2 0.649 CV 1
ASSI { 1002}
(( segid " " and resid 33 and name HG2 ))
(( segid " " and resid 31 and name HG ))
4.500 2.600 1.500 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.10661E-02 ppm1 2.226 ppm2 1.159 CV 1
ASSI { 1003}
(( segid " " and resid 33 and name HG2 ))
(( segid " " and resid 33 and name HB3 ))
2.400 0.700 0.700 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.39645E-02 ppm1 2.226 ppm2 1.645 CV 1
ASSI { 1004}
(( segid " " and resid 33 and name HG2 ))
(( segid " " and resid 33 and name HA ))
4.000 2.000 2.000 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.19877E-02 ppm1 2.226 ppm2 4.337 CV 1
ASSI { 1007}
(( segid " " and resid 66 and name HG2 ))
(( segid " " and resid 66 and name H ))
3.800 1.900 1.900 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.26652E-02 ppm1 2.124 ppm2 8.010 CV 1
ASSI { 1008}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name H ))
2.600 0.900 0.900 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.47751E-02 ppm1 1.979 ppm2 8.011 CV 1
ASSI { 1009}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name H ))
2.800 1.000 1.000 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.48806E-02 ppm1 1.924 ppm2 8.008 CV 1
ASSI { 1010}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 69 and name H ))
2.900 1.000 1.000 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.29427E-02 ppm1 1.976 ppm2 8.333 CV 1
ASSI { 1011}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 69 and name H ))
3.500 1.500 1.500 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.32315E-02 ppm1 1.916 ppm2 8.334 CV 1
ASSI { 1012}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HB2 ))
2.500 0.800 0.800 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.49750E-02 ppm1 3.989 ppm2 1.870 CV 1
OR { 1012}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 1016}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 69 and name H ))
3.100 1.200 1.200 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.19045E-02 ppm1 3.989 ppm2 8.343 CV 1
ASSI { 1018}
(( segid " " and resid 68 and name HG2 ))
(( segid " " and resid 68 and name H ))
4.200 2.300 1.800 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.80511E-03 ppm1 1.881 ppm2 7.926 CV 1
ASSI { 1019}
(( segid " " and resid 68 and name HG2 ))
(( segid " " and resid 68 and name HA ))
4.600 2.600 1.400 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.10328E-02 ppm1 1.889 ppm2 3.995 CV 1
ASSI { 1020}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HE2 ))
2.500 0.800 0.800 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.64464E-02 ppm1 1.677 ppm2 2.931 CV 1
OR { 1020}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 1021}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HA ))
2.800 1.000 1.000 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.23321E-02 ppm1 1.862 ppm2 3.994 CV 1
ASSI { 1022}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name H ))
4.000 2.000 2.000 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.12549E-02 ppm1 1.866 ppm2 7.916 CV 1
ASSI { 1023}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB3 ))
3.000 1.200 1.200 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.43642E-02 ppm1 4.446 ppm2 3.087 CV 1
ASSI { 1024}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name H ))
3.500 1.600 1.600 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.24320E-02 ppm1 3.160 ppm2 7.913 CV 1
ASSI { 1025}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name H ))
2.900 1.000 1.000 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.25542E-02 ppm1 3.083 ppm2 7.906 CV 1
ASSI { 1026}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HA ))
2.700 0.900 0.900 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.27430E-02 ppm1 3.163 ppm2 4.446 CV 1
ASSI { 1028}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 64 and name HA ))
2.300 0.700 0.700 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.10217E-02 ppm1 3.078 ppm2 4.277 CV 1
ASSI { 1029}
(( segid " " and resid 66 and name HG3 ))
(( segid " " and resid 66 and name HG2 ))
1.500 0.300 0.700 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.34875E-01 ppm1 2.273 ppm2 2.120 CV 1
ASSI { 1030}
(( segid " " and resid 66 and name HG3 ))
(( segid " " and resid 66 and name HA ))
3.000 1.100 1.100 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.35536E-02 ppm1 2.274 ppm2 4.044 CV 1
ASSI { 1031}
(( segid " " and resid 66 and name HG3 ))
(( segid " " and resid 66 and name H ))
3.500 1.500 1.500 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.24042E-02 ppm1 2.272 ppm2 8.011 CV 1
ASSI { 1032}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HA ))
2.700 0.900 0.900 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.53638E-02 ppm1 1.925 ppm2 4.460 CV 1
ASSI { 1036}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HB2 ))
2.900 1.100 1.100 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.16602E-02 ppm1 4.153 ppm2 3.140 CV 1
ASSI { 1037}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 68 and name HG2 ))
3.900 1.900 1.900 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.83287E-03 ppm1 4.137 ppm2 1.886 CV 1
ASSI { 1042}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name H ))
3.900 1.900 1.900 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.10328E-02 ppm1 3.137 ppm2 8.122 CV 1
ASSI { 1043}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 65 and name H ))
3.300 1.400 1.400 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.10938E-02 ppm1 2.997 ppm2 8.122 CV 1
ASSI { 1047}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 65 and name HA ))
3.600 1.600 1.600 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.15658E-02 ppm1 3.002 ppm2 4.152 CV 1
ASSI { 1048}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 65 and name HB2 ))
2.200 0.600 0.600 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.48417E-02 ppm1 3.001 ppm2 3.139 CV 1
ASSI { 1050}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 65 and name H ))
3.600 1.600 1.600 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.79956E-03 ppm1 4.283 ppm2 8.140 CV 1
ASSI { 1052}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HD1 ))
4.200 2.200 1.800 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.81065E-03 ppm1 4.286 ppm2 6.853 CV 1
ASSI { 1053}
(( segid " " and resid 64 and name HB3 ))
( segid " " and resid 61 and name HD1%)
2.500 0.800 0.800 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.69406E-03 ppm1 3.018 ppm2 0.484 CV 1
ASSI { 1054}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HA ))
3.500 1.500 1.500 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.14714E-02 ppm1 3.024 ppm2 4.282 CV 1
ASSI { 1055}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HA ))
3.000 1.100 1.100 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.14714E-02 ppm1 3.113 ppm2 4.278 CV 1
ASSI { 1056}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HD1 ))
3.700 1.700 1.700 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.53860E-03 ppm1 3.018 ppm2 6.835 CV 1
ASSI { 1059}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HG2 ))
2.500 0.800 0.800 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.48252E-02 ppm1 4.079 ppm2 2.239 CV 1
OR { 1059}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HG3 ))
ASSI { 1060}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name H ))
2.800 1.000 1.000 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.26707E-02 ppm1 4.079 ppm2 7.847 CV 1
ASSI { 1061}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name H ))
3.400 1.400 1.400 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.14936E-02 ppm1 4.082 ppm2 7.715 CV 1
ASSI { 1063}
(( segid " " and resid 63 and name HG2 ))
(( segid " " and resid 63 and name H ))
3.700 1.700 1.700 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.18878E-02 ppm1 2.229 ppm2 7.843 CV 1
OR { 1063}
(( segid " " and resid 63 and name HG3 ))
(( segid " " and resid 63 and name H ))
ASSI { 1064}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HG3 ))
2.700 0.900 0.900 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.55747E-02 ppm1 2.013 ppm2 2.227 CV 1
OR { 1064}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HG2 ))
ASSI { 1065}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HG3 ))
2.300 0.700 0.700 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.59689E-02 ppm1 1.945 ppm2 2.226 CV 1
OR { 1065}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HG2 ))
ASSI { 1066}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HA ))
3.000 1.200 1.200 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.35481E-02 ppm1 2.006 ppm2 4.082 CV 1
ASSI { 1067}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
2.600 0.900 0.900 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.35369E-02 ppm1 1.948 ppm2 4.082 CV 1
ASSI { 1068}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 60 and name HA ))
2.300 0.700 0.700 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.10383E-02 ppm1 1.953 ppm2 4.352 CV 1
ASSI { 1069}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 64 and name H ))
3.800 1.800 1.800 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 2.013 ppm2 7.711 CV 1
ASSI { 1070}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name H ))
2.900 1.100 1.100 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.21655E-02 ppm1 2.012 ppm2 7.846 CV 1
ASSI { 1071}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name H ))
3.000 1.100 1.100 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.22211E-02 ppm1 1.951 ppm2 7.835 CV 1
ASSI { 1074}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 64 and name HB3 ))
3.900 1.900 1.900 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.89949E-03 ppm1 4.109 ppm2 3.023 CV 1
ASSI { 1075}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HA ))
2.400 0.700 0.700 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.83843E-02 ppm1 3.930 ppm2 4.117 CV 1
OR { 1075}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HA ))
ASSI { 1076}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 59 and name HA ))
2.100 0.500 0.500 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.20433E-02 ppm1 3.927 ppm2 4.409 CV 1
OR { 1076}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 59 and name HA ))
ASSI { 1078}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name H ))
2.400 0.700 0.700 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.56914E-02 ppm1 3.929 ppm2 7.643 CV 1
OR { 1078}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name H ))
ASSI { 1080}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HG ))
3.900 1.900 1.900 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 4.004 ppm2 1.225 CV 1
ASSI { 1081}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 48 and name HB% )
2.000 0.500 0.500 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.15358E-01 ppm1 3.993 ppm2 1.417 CV 1
ASSI { 1083}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 27 and name HG2%)
2.400 0.700 0.700 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.94392E-03 ppm1 3.997 ppm2 0.867 CV 1
ASSI { 1086}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 52 and name HG12))
2.600 0.800 0.800 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.45697E-02 ppm1 1.500 ppm2 1.255 CV 1
ASSI { 1087}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HG ))
2.700 0.900 0.900 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.23654E-02 ppm1 1.382 ppm2 1.225 CV 1
ASSI { 1091}
(( segid " " and resid 61 and name HG ))
(( segid " " and resid 61 and name H ))
4.300 2.300 1.700 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.11771E-02 ppm1 1.222 ppm2 7.543 CV 1
ASSI { 1093}
(( segid " " and resid 61 and name HG ))
( segid " " and resid 61 and name HD2%)
2.600 0.800 0.800 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.35147E-02 ppm1 1.226 ppm2 0.356 CV 1
ASSI { 1094}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 61 and name HD2%)
2.500 0.800 0.800 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.11438E-01 ppm1 0.466 ppm2 0.340 CV 1
ASSI { 1096}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HB2 ))
3.400 1.400 1.400 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.50860E-02 ppm1 0.475 ppm2 1.387 CV 1
ASSI { 1097}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HB3 ))
2.600 0.800 0.800 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.33870E-02 ppm1 0.468 ppm2 1.518 CV 1
ASSI { 1098}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 20 and name HB3 ))
2.300 0.600 0.600 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.12382E-02 ppm1 0.468 ppm2 2.603 CV 1
OR { 1098}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 20 and name HB2 ))
ASSI { 1100}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HA ))
3.700 1.700 1.700 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.30038E-02 ppm1 0.467 ppm2 4.006 CV 1
ASSI { 1101}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 56 and name HA ))
2.100 0.600 0.600 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.17268E-02 ppm1 0.468 ppm2 4.327 CV 1
ASSI { 1102}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 43 and name HD% )
2.000 0.500 0.500 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.28484E-02 ppm1 0.466 ppm2 6.871 CV 1
ASSI { 1103}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 65 and name HE% )
2.100 0.600 0.600 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.17823E-02 ppm1 0.465 ppm2 7.050 CV 1
ASSI { 1105}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 61 and name HA ))
2.500 0.800 0.800 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.34815E-02 ppm1 0.358 ppm2 4.006 CV 1
ASSI { 1107}
( segid " " and resid 61 and name HD2%)
( segid " " and resid 65 and name HE% )
2.100 0.500 0.500 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.21099E-02 ppm1 0.357 ppm2 7.058 CV 1
ASSI { 1108}
( segid " " and resid 61 and name HD2%)
( segid " " and resid 43 and name HD% )
2.000 0.500 0.500 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.23654E-02 ppm1 0.357 ppm2 6.869 CV 1
ASSI { 1109}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 43 and name HB3 ))
2.200 0.600 0.600 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.16158E-02 ppm1 0.359 ppm2 2.599 CV 1
OR { 1109}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 43 and name HB2 ))
ASSI { 1110}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 61 and name HB3 ))
3.400 1.400 1.400 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.33870E-02 ppm1 0.358 ppm2 1.525 CV 1
ASSI { 1111}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 61 and name HB2 ))
3.200 1.300 1.300 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.26819E-02 ppm1 0.356 ppm2 1.378 CV 1
ASSI { 1113}
( segid " " and resid 61 and name HD2%)
( segid " " and resid 29 and name HG1%)
1.800 0.400 0.400 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.49639E-02 ppm1 0.356 ppm2 0.741 CV 1
ASSI { 1117}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 62 and name H ))
4.600 2.700 1.400 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.63298E-03 ppm1 4.348 ppm2 7.648 CV 1
ASSI { 1118}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB3 ))
3.200 1.300 1.300 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.26986E-02 ppm1 4.357 ppm2 3.912 CV 1
ASSI { 1119}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB2 ))
2.800 1.000 1.000 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.20822E-02 ppm1 4.355 ppm2 3.649 CV 1
ASSI { 1120}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name H ))
4.100 2.100 1.900 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.10328E-02 ppm1 3.642 ppm2 8.716 CV 1
ASSI { 1122}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name H ))
3.800 1.800 1.800 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.75514E-03 ppm1 4.418 ppm2 8.715 CV 1
ASSI { 1124}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 61 and name H ))
4.500 2.500 1.500 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.77734E-03 ppm1 4.420 ppm2 7.535 CV 1
ASSI { 1125}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD3 ))
3.900 1.900 1.900 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.10772E-02 ppm1 4.413 ppm2 4.046 CV 1
ASSI { 1127}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD2 ))
3.800 1.800 1.800 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.82733E-03 ppm1 4.417 ppm2 3.658 CV 1
ASSI { 1128}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB3 ))
2.300 0.700 0.700 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.77512E-02 ppm1 4.415 ppm2 2.391 CV 1
ASSI { 1129}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
2.600 0.800 0.800 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.72460E-02 ppm1 4.416 ppm2 1.994 CV 1
OR { 1129}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 1130}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 58 and name HA ))
2.700 0.900 0.900 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.24709E-02 ppm1 4.040 ppm2 4.693 CV 1
ASSI { 1131}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 58 and name HA ))
4.100 2.100 1.900 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.21433E-02 ppm1 3.658 ppm2 4.691 CV 1
ASSI { 1133}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HD3 ))
2.200 0.600 0.600 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.42809E-02 ppm1 3.655 ppm2 4.039 CV 1
ASSI { 1135}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HB3 ))
3.600 1.600 1.600 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.13715E-02 ppm1 4.039 ppm2 2.390 CV 1
ASSI { 1136}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HG2 ))
3.100 1.200 1.200 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.35369E-02 ppm1 4.039 ppm2 1.994 CV 1
OR { 1136}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 1137}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG3 ))
3.400 1.400 1.400 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.23154E-02 ppm1 3.658 ppm2 2.047 CV 1
ASSI { 1138}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG2 ))
2.600 0.900 0.900 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.30317E-02 ppm1 3.654 ppm2 1.980 CV 1
OR { 1138}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 1140}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HA ))
2.600 0.900 0.900 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.55358E-02 ppm1 1.996 ppm2 4.410 CV 1
ASSI { 1142}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HD3 ))
4.000 2.000 2.000 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.16602E-02 ppm1 1.992 ppm2 4.039 CV 1
ASSI { 1143}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HD2 ))
3.900 1.900 1.900 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.14714E-02 ppm1 2.392 ppm2 3.661 CV 1
ASSI { 1144}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HD2 ))
3.700 1.700 1.700 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.16602E-02 ppm1 1.996 ppm2 3.652 CV 1
ASSI { 1146}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HB2 ))
1.700 0.300 0.500 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.18661E-01 ppm1 2.391 ppm2 1.992 CV 1
ASSI { 1147}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 59 and name HB3 ))
2.500 0.800 0.800 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.38311E-02 ppm1 2.069 ppm2 2.391 CV 1
ASSI { 1148}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HB2 ))
1.900 0.500 0.500 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.12254E-01 ppm1 1.961 ppm2 2.392 CV 1
OR { 1148}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HG2 ))
OR { 1148}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HG3 ))
ASSI { 1149}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 59 and name HD3 ))
2.600 0.800 0.800 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.27819E-02 ppm1 2.072 ppm2 4.039 CV 1
ASSI { 1150}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HD3 ))
3.300 1.400 1.400 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.20156E-02 ppm1 1.974 ppm2 4.039 CV 1
ASSI { 1151}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 59 and name HA ))
3.700 1.700 1.700 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.26874E-02 ppm1 2.074 ppm2 4.425 CV 1
ASSI { 1152}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HA ))
3.600 1.600 1.600 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.24874E-02 ppm1 1.973 ppm2 4.415 CV 1
ASSI { 1153}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 58 and name HA ))
4.500 2.500 1.500 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.74403E-03 ppm1 2.071 ppm2 4.695 CV 1
ASSI { 1154}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 60 and name H ))
5.500 3.800 0.500 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.62743E-03 ppm1 2.072 ppm2 8.714 CV 1
ASSI { 1155}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 60 and name H ))
4.300 2.400 1.700 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.78846E-03 ppm1 1.968 ppm2 8.713 CV 1
ASSI { 1157}
(( segid " " and resid 58 and name HB2 ))
( segid " " and resid 54 and name HG2%)
2.200 0.600 0.600 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.15269E-02 ppm1 2.806 ppm2 1.218 CV 1
ASSI { 1158}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HB2 ))
2.600 0.800 0.800 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.17880E-02 ppm1 3.054 ppm2 2.802 CV 1
ASSI { 1162}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG2 ))
2.200 0.600 0.600 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.10067E-01 ppm1 4.501 ppm2 2.394 CV 1
OR { 1162}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
OR { 1162}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG3 ))
ASSI { 1163}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name H ))
3.000 1.100 1.100 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.18878E-02 ppm1 4.494 ppm2 10.604 CV 1
ASSI { 1164}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name H ))
3.800 1.800 1.800 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.17823E-02 ppm1 2.392 ppm2 10.615 CV 1
OR { 1164}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name H ))
ASSI { 1165}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name HB3 ))
2.600 0.900 0.900 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.66297E-02 ppm1 2.392 ppm2 1.959 CV 1
OR { 1165}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name HB3 ))
ASSI { 1166}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name HA ))
2.400 0.700 0.700 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.50917E-02 ppm1 2.393 ppm2 4.498 CV 1
OR { 1166}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name HA ))
ASSI { 1167}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name HE22))
4.300 2.300 1.700 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.12327E-02 ppm1 2.401 ppm2 6.853 CV 1
OR { 1167}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name HE22))
ASSI { 1168}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name HE21))
2.800 1.000 1.000 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.17324E-02 ppm1 2.388 ppm2 7.555 CV 1
OR { 1168}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name HE21))
ASSI { 1169}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 55 and name HE1 ))
2.000 0.500 0.500 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.24375E-02 ppm1 2.392 ppm2 7.762 CV 1
OR { 1169}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 55 and name HE1 ))
ASSI { 1170}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 58 and name H ))
4.100 2.100 1.900 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.67740E-03 ppm1 2.377 ppm2 8.284 CV 1
OR { 1170}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 58 and name H ))
ASSI { 1171}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name H ))
3.300 1.300 1.300 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.98833E-03 ppm1 2.397 ppm2 10.613 CV 1
ASSI { 1172}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name H ))
3.800 1.800 1.800 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.10994E-02 ppm1 1.955 ppm2 10.615 CV 1
ASSI { 1173}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HB3 ))
2.000 0.500 0.500 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.65963E-02 ppm1 2.393 ppm2 1.959 CV 1
ASSI { 1174}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HA ))
3.000 1.100 1.100 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.30761E-02 ppm1 2.392 ppm2 4.500 CV 1
ASSI { 1175}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HA ))
2.900 1.100 1.100 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.26540E-02 ppm1 1.961 ppm2 4.502 CV 1
ASSI { 1176}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 55 and name HE1 ))
2.200 0.600 0.600 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.14325E-02 ppm1 2.391 ppm2 7.767 CV 1
ASSI { 1177}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 58 and name H ))
5.100 3.300 0.900 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.65519E-03 ppm1 2.397 ppm2 8.261 CV 1
ASSI { 1181}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG3 ))
4.200 2.200 1.800 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.13215E-02 ppm1 4.322 ppm2 1.682 CV 1
ASSI { 1182}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB3 ))
2.700 0.900 0.900 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.30983E-02 ppm1 4.325 ppm2 1.839 CV 1
ASSI { 1183}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB2 ))
2.800 1.000 1.000 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.36536E-02 ppm1 4.324 ppm2 2.054 CV 1
ASSI { 1184}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HD3 ))
4.100 2.100 1.900 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.78290E-03 ppm1 4.324 ppm2 2.321 CV 1
ASSI { 1185}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 43 and name HD% )
1.900 0.500 0.500 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.31095E-02 ppm1 4.328 ppm2 6.881 CV 1
ASSI { 1186}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 43 and name HE% )
2.100 0.500 0.500 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.21822E-02 ppm1 4.328 ppm2 7.171 CV 1
ASSI { 1192}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 56 and name HB3 ))
3.800 1.800 1.800 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.91061E-03 ppm1 2.328 ppm2 1.848 CV 1
ASSI { 1193}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 56 and name HD3 ))
2.400 0.700 0.700 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.25485E-02 ppm1 3.656 ppm2 2.322 CV 1
ASSI { 1197}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HD3 ))
3.600 1.600 1.600 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.23266E-02 ppm1 1.839 ppm2 2.827 CV 1
ASSI { 1198}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HG3 ))
3.000 1.100 1.100 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.29372E-02 ppm1 2.049 ppm2 1.692 CV 1
ASSI { 1199}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HG3 ))
2.000 0.500 0.500 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.60744E-02 ppm1 1.371 ppm2 1.687 CV 1
ASSI { 1200}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HB3 ))
2.900 1.100 1.100 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.57358E-02 ppm1 1.377 ppm2 1.840 CV 1
ASSI { 1201}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HB2 ))
2.700 0.900 0.900 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.18045E-02 ppm1 1.370 ppm2 2.054 CV 1
ASSI { 1202}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HD3 ))
3.400 1.400 1.400 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.17546E-02 ppm1 1.374 ppm2 2.315 CV 1
ASSI { 1203}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 56 and name HD3 ))
2.600 0.900 0.900 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.22488E-02 ppm1 1.686 ppm2 2.313 CV 1
ASSI { 1204}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HD2 ))
2.800 1.000 1.000 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.16213E-02 ppm1 1.377 ppm2 3.650 CV 1
ASSI { 1205}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 56 and name HD2 ))
3.600 1.600 1.600 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.16769E-02 ppm1 1.685 ppm2 3.656 CV 1
ASSI { 1206}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 24 and name HA ))
3.100 1.200 1.200 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.27984E-02 ppm1 1.682 ppm2 4.130 CV 1
ASSI { 1207}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HA ))
3.400 1.400 1.400 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.36424E-02 ppm1 1.374 ppm2 4.342 CV 1
ASSI { 1210}
( segid " " and resid 65 and name HD% )
(( segid " " and resid 65 and name HA ))
3.200 1.200 1.200 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.23820E-02 ppm1 7.169 ppm2 4.141 CV 1
ASSI { 1212}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 43 and name HA ))
3.100 1.200 1.200 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.14603E-02 ppm1 2.604 ppm2 5.119 CV 1
OR { 1212}
(( segid " " and resid 43 and name HB3 ))
(( segid " " and resid 43 and name HA ))
ASSI { 1214}
( segid " " and resid 43 and name HD% )
(( segid " " and resid 43 and name HB2 ))
3.000 1.100 1.100 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.19989E-02 ppm1 6.880 ppm2 2.600 CV 1
OR { 1214}
( segid " " and resid 43 and name HD% )
(( segid " " and resid 43 and name HB3 ))
ASSI { 1217}
( segid " " and resid 43 and name HD% )
( segid " " and resid 43 and name HE% )
2.200 0.600 0.600 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.12715E-01 ppm1 6.879 ppm2 7.170 CV 1
ASSI { 1218}
(( segid " " and resid 1 and name HB3 ))
( segid " " and resid 1 and name HD% )
2.700 0.900 0.900 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.37812E-02 ppm1 3.120 ppm2 7.152 CV 1
ASSI { 1219}
(( segid " " and resid 1 and name HB2 ))
( segid " " and resid 1 and name HD% )
2.600 0.800 0.800 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.35259E-02 ppm1 3.047 ppm2 7.152 CV 1
ASSI { 1220}
( segid " " and resid 1 and name HE% )
( segid " " and resid 1 and name HD% )
1.800 0.400 0.400 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.40600E-01 ppm1 7.285 ppm2 7.158 CV 1
ASSI { 1221}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB3 ))
3.200 1.200 1.200 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.11383E-02 ppm1 4.331 ppm2 2.696 CV 1
ASSI { 1222}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB3 ))
2.600 0.900 0.900 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.25874E-02 ppm1 4.333 ppm2 1.843 CV 1
ASSI { 1223}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 54 and name HG2%)
3.100 1.200 1.200 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.14992E-02 ppm1 4.334 ppm2 1.218 CV 1
ASSI { 1225}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HB3 ))
2.700 0.900 0.900 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.12604E-02 ppm1 2.861 ppm2 2.733 CV 1
ASSI { 1227}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HA ))
3.400 1.500 1.500 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.98833E-03 ppm1 2.858 ppm2 4.342 CV 1
ASSI { 1228}
(( segid " " and resid 54 and name HB ))
( segid " " and resid 45 and name HD1%)
2.400 0.700 0.700 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.84398E-03 ppm1 2.215 ppm2 0.600 CV 1
ASSI { 1231}
(( segid " " and resid 54 and name HB ))
(( segid " " and resid 43 and name HB3 ))
2.200 0.600 0.600 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.14159E-02 ppm1 2.231 ppm2 2.600 CV 1
OR { 1231}
(( segid " " and resid 54 and name HB ))
(( segid " " and resid 43 and name HB2 ))
ASSI { 1232}
(( segid " " and resid 54 and name HB ))
(( segid " " and resid 55 and name H ))
4.500 2.600 1.500 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.74403E-03 ppm1 2.218 ppm2 8.392 CV 1
ASSI { 1233}
(( segid " " and resid 54 and name HG12))
(( segid " " and resid 54 and name HB ))
3.400 1.500 1.500 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.83843E-03 ppm1 1.259 ppm2 2.215 CV 1
OR { 1233}
(( segid " " and resid 54 and name HG13))
(( segid " " and resid 54 and name HB ))
ASSI { 1234}
( segid " " and resid 54 and name HG2%)
( segid " " and resid 61 and name HD1%)
1.900 0.500 0.500 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.34092E-02 ppm1 1.229 ppm2 0.470 CV 1
ASSI { 1235}
( segid " " and resid 54 and name HG2%)
( segid " " and resid 61 and name HD2%)
1.900 0.400 0.400 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.37702E-02 ppm1 1.229 ppm2 0.356 CV 1
ASSI { 1237}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 54 and name HB ))
2.600 0.800 0.800 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.31539E-02 ppm1 1.229 ppm2 2.222 CV 1
ASSI { 1239}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 43 and name HB3 ))
2.200 0.600 0.600 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.13437E-02 ppm1 1.229 ppm2 2.598 CV 1
OR { 1239}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 43 and name HB2 ))
ASSI { 1240}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 58 and name HB3 ))
2.100 0.500 0.500 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.22266E-02 ppm1 1.228 ppm2 3.069 CV 1
ASSI { 1242}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 58 and name HD22))
2.200 0.600 0.600 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.14547E-02 ppm1 1.230 ppm2 7.100 CV 1
ASSI { 1243}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 58 and name HD21))
2.400 0.700 0.700 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.98279E-03 ppm1 1.231 ppm2 7.373 CV 1
ASSI { 1244}
( segid " " and resid 54 and name HG2%)
( segid " " and resid 43 and name HD% )
2.600 0.900 0.900 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.52748E-03 ppm1 1.225 ppm2 6.876 CV 1
ASSI { 1246}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 54 and name HG2%)
2.800 1.000 1.000 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.13309E-01 ppm1 0.783 ppm2 1.235 CV 1
ASSI { 1247}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 54 and name HB ))
2.900 1.100 1.100 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.22211E-02 ppm1 0.784 ppm2 2.217 CV 1
ASSI { 1248}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 54 and name HA ))
3.100 1.200 1.200 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.17157E-02 ppm1 0.782 ppm2 4.790 CV 1
ASSI { 1249}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 14 and name H ))
2.200 0.600 0.600 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.14492E-02 ppm1 0.783 ppm2 8.916 CV 1
ASSI { 1250}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 55 and name H ))
4.800 2.900 1.200 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.96614E-03 ppm1 0.782 ppm2 8.387 CV 1
ASSI { 1253}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 53 and name HB2 ))
2.700 0.900 0.900 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.17435E-02 ppm1 3.635 ppm2 2.666 CV 1
ASSI { 1255}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 53 and name H ))
4.300 2.300 1.700 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.87174E-03 ppm1 3.632 ppm2 8.903 CV 1
ASSI { 1258}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG13))
4.100 2.100 1.900 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.10161E-02 ppm1 4.476 ppm2 0.804 CV 1
ASSI { 1259}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG12))
3.600 1.600 1.600 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.72181E-03 ppm1 4.468 ppm2 1.258 CV 1
ASSI { 1260}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB ))
3.300 1.400 1.400 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.13604E-02 ppm1 4.463 ppm2 1.493 CV 1
ASSI { 1261}
(( segid " " and resid 52 and name HB ))
( segid " " and resid 52 and name HD1%)
3.400 1.400 1.400 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.41089E-02 ppm1 1.503 ppm2 0.472 CV 1
ASSI { 1262}
(( segid " " and resid 52 and name HB ))
( segid " " and resid 52 and name HG2%)
2.400 0.700 0.700 peak 1262 spectrum 1 weight 0.10000E+01 volume 0.66741E-02 ppm1 1.497 ppm2 0.640 CV 1
ASSI { 1266}
(( segid " " and resid 52 and name HG13))
( segid " " and resid 52 and name HD1%)
2.600 0.800 0.800 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.41866E-02 ppm1 0.827 ppm2 0.477 CV 1
ASSI { 1267}
(( segid " " and resid 52 and name HG13))
(( segid " " and resid 52 and name HG12))
1.900 0.400 0.400 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.80122E-02 ppm1 0.826 ppm2 1.259 CV 1
ASSI { 1268}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 40 and name HA ))
3.400 1.400 1.400 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.17213E-02 ppm1 1.263 ppm2 4.425 CV 1
ASSI { 1270}
(( segid " " and resid 52 and name HG13))
(( segid " " and resid 52 and name H ))
4.300 2.300 1.700 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.91617E-03 ppm1 0.820 ppm2 8.757 CV 1
ASSI { 1271}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 52 and name HG12))
3.100 1.200 1.200 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.65686E-02 ppm1 0.644 ppm2 1.250 CV 1
ASSI { 1273}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 14 and name HB2 ))
2.100 0.600 0.600 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.19378E-02 ppm1 0.643 ppm2 3.095 CV 1
OR { 1273}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 14 and name HB3 ))
ASSI { 1274}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 52 and name HA ))
2.600 0.800 0.800 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.41644E-02 ppm1 0.643 ppm2 4.465 CV 1
ASSI { 1275}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 53 and name H ))
3.300 1.400 1.400 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.35870E-02 ppm1 0.644 ppm2 8.892 CV 1
ASSI { 1277}
( segid " " and resid 52 and name HD1%)
( segid " " and resid 18 and name HD1%)
1.500 0.300 0.700 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.15602E-01 ppm1 0.479 ppm2 0.690 CV 1
ASSI { 1278}
( segid " " and resid 52 and name HD1%)
(( segid " " and resid 52 and name HG12))
2.300 0.700 0.700 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.70795E-02 ppm1 0.478 ppm2 1.261 CV 1
ASSI { 1279}
( segid " " and resid 52 and name HD1%)
(( segid " " and resid 45 and name HG ))
2.100 0.600 0.600 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.18434E-02 ppm1 0.476 ppm2 1.602 CV 1
ASSI { 1281}
( segid " " and resid 52 and name HD1%)
(( segid " " and resid 52 and name HA ))
3.300 1.400 1.400 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.10605E-02 ppm1 0.476 ppm2 4.471 CV 1
ASSI { 1282}
( segid " " and resid 52 and name HD1%)
(( segid " " and resid 53 and name H ))
2.500 0.800 0.800 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.66631E-03 ppm1 0.485 ppm2 8.901 CV 1
ASSI { 1283}
( segid " " and resid 52 and name HD1%)
(( segid " " and resid 52 and name H ))
4.200 2.200 1.800 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.90505E-03 ppm1 0.477 ppm2 8.774 CV 1
ASSI { 1284}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 46 and name HA ))
2.400 0.700 0.700 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.81065E-03 ppm1 5.436 ppm2 4.834 CV 1
ASSI { 1285}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
3.000 1.100 1.100 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.16880E-02 ppm1 5.431 ppm2 3.403 CV 1
OR { 1285}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB3 ))
ASSI { 1286}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 18 and name HD1%)
2.300 0.700 0.700 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.10994E-02 ppm1 5.436 ppm2 0.681 CV 1
ASSI { 1287}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 47 and name H ))
1.900 0.500 0.500 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.30761E-02 ppm1 5.433 ppm2 8.762 CV 1
ASSI { 1288}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 44 and name HG1%)
2.100 0.500 0.500 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.21600E-02 ppm1 3.422 ppm2 0.394 CV 1
ASSI { 1289}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HA ))
2.800 1.000 1.000 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.16713E-02 ppm1 3.425 ppm2 5.434 CV 1
ASSI { 1290}
(( segid " " and resid 51 and name HB3 ))
(( segid " " and resid 51 and name HA ))
3.500 1.600 1.600 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.13270E-02 ppm1 3.393 ppm2 5.433 CV 1
ASSI { 1291}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name H ))
3.300 1.400 1.400 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.10272E-02 ppm1 3.426 ppm2 8.533 CV 1
ASSI { 1292}
(( segid " " and resid 51 and name HB3 ))
(( segid " " and resid 51 and name H ))
3.000 1.100 1.100 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.11216E-02 ppm1 3.379 ppm2 8.543 CV 1
ASSI { 1293}
(( segid " " and resid 50 and name HD3 ))
(( segid " " and resid 50 and name H ))
5.000 3.200 1.000 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.64965E-03 ppm1 3.064 ppm2 7.234 CV 1
ASSI { 1294}
(( segid " " and resid 24 and name HD3 ))
(( segid " " and resid 24 and name H ))
4.500 2.500 1.500 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.10550E-02 ppm1 3.078 ppm2 7.716 CV 1
ASSI { 1295}
(( segid " " and resid 24 and name HD2 ))
(( segid " " and resid 24 and name HB2 ))
3.100 1.200 1.200 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.30150E-02 ppm1 3.150 ppm2 1.878 CV 1
ASSI { 1296}
(( segid " " and resid 24 and name HD2 ))
(( segid " " and resid 24 and name HG2 ))
2.700 0.900 0.900 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.71349E-02 ppm1 3.150 ppm2 1.762 CV 1
OR { 1296}
(( segid " " and resid 24 and name HD2 ))
(( segid " " and resid 24 and name HB3 ))
ASSI { 1297}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 50 and name HA ))
3.000 1.100 1.100 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.17601E-02 ppm1 1.865 ppm2 4.629 CV 1
ASSI { 1298}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HA ))
3.100 1.200 1.200 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.15769E-02 ppm1 1.803 ppm2 4.622 CV 1
ASSI { 1300}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HG3 ))
1.800 0.400 0.400 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.99723E-02 ppm1 1.473 ppm2 1.247 CV 1
ASSI { 1302}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HB3 ))
3.200 1.300 1.300 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.24986E-02 ppm1 1.474 ppm2 1.860 CV 1
ASSI { 1303}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HD2 ))
3.000 1.100 1.100 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.24542E-02 ppm1 1.470 ppm2 3.041 CV 1
OR { 1303}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HD3 ))
ASSI { 1304}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 50 and name HD2 ))
2.700 0.900 0.900 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.24819E-02 ppm1 1.246 ppm2 3.047 CV 1
OR { 1304}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 50 and name HD3 ))
ASSI { 1309}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HG2 ))
2.100 0.600 0.600 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.11099E-01 ppm1 4.453 ppm2 2.258 CV 1
OR { 1309}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB2 ))
OR { 1309}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HG3 ))
ASSI { 1310}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 48 and name HB% )
3.300 1.400 1.400 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.18267E-02 ppm1 4.452 ppm2 1.423 CV 1
ASSI { 1312}
(( segid " " and resid 49 and name HG3 ))
( segid " " and resid 27 and name HD1%)
2.000 0.500 0.500 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.23709E-02 ppm1 2.275 ppm2 0.729 CV 1
OR { 1312}
(( segid " " and resid 49 and name HG2 ))
( segid " " and resid 27 and name HD1%)
ASSI { 1313}
(( segid " " and resid 41 and name HG2 ))
( segid " " and resid 34 and name HB% )
2.300 0.600 0.600 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.12271E-02 ppm1 2.297 ppm2 1.192 CV 1
ASSI { 1316}
(( segid " " and resid 49 and name HG3 ))
(( segid " " and resid 49 and name HB3 ))
2.100 0.600 0.600 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.21161E-01 ppm1 2.273 ppm2 1.931 CV 1
OR { 1316}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 1317}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name HA ))
2.200 0.600 0.600 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.10250E-01 ppm1 2.274 ppm2 4.454 CV 1
OR { 1317}
(( segid " " and resid 49 and name HG3 ))
(( segid " " and resid 49 and name HA ))
ASSI { 1318}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 50 and name H ))
3.200 1.300 1.300 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.12549E-02 ppm1 2.276 ppm2 7.234 CV 1
OR { 1318}
(( segid " " and resid 49 and name HG3 ))
(( segid " " and resid 50 and name H ))
ASSI { 1319}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name H ))
3.700 1.700 1.700 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.24264E-02 ppm1 2.275 ppm2 8.408 CV 1
OR { 1319}
(( segid " " and resid 49 and name HG3 ))
(( segid " " and resid 49 and name H ))
ASSI { 1321}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 41 and name HA ))
2.800 1.000 1.000 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.14325E-02 ppm1 2.299 ppm2 4.627 CV 1
ASSI { 1322}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 48 and name HB% )
3.300 1.400 1.400 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.11549E-02 ppm1 2.226 ppm2 1.427 CV 1
ASSI { 1324}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
1.800 0.400 0.400 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.13354E-01 ppm1 2.224 ppm2 1.929 CV 1
ASSI { 1325}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HA ))
2.700 0.900 0.900 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.38590E-02 ppm1 2.225 ppm2 4.453 CV 1
ASSI { 1326}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name H ))
3.200 1.300 1.300 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.91617E-03 ppm1 2.222 ppm2 8.398 CV 1
ASSI { 1327}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HG2 ))
4.200 2.200 1.800 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.11383E-02 ppm1 3.992 ppm2 2.258 CV 1
OR { 1327}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HG3 ))
ASSI { 1328}
( segid " " and resid 48 and name HB% )
(( segid " " and resid 49 and name HB3 ))
3.300 1.400 1.400 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.37812E-02 ppm1 1.419 ppm2 1.914 CV 1
ASSI { 1329}
( segid " " and resid 48 and name HB% )
(( segid " " and resid 49 and name HG2 ))
2.700 0.900 0.900 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.81399E-02 ppm1 1.419 ppm2 2.269 CV 1
OR { 1329}
( segid " " and resid 48 and name HB% )
(( segid " " and resid 49 and name HG3 ))
ASSI { 1336}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 47 and name HD2%)
2.700 0.900 0.900 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.35648E-02 ppm1 1.894 ppm2 0.702 CV 1
OR { 1336}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 47 and name HD1%)
ASSI { 1337}
(( segid " " and resid 47 and name HB2 ))
( segid " " and resid 47 and name HD1%)
2.800 1.000 1.000 peak 1337 spectrum 1 weight 0.10000E+01 volume 0.35314E-02 ppm1 1.730 ppm2 0.701 CV 1
OR { 1337}
(( segid " " and resid 47 and name HB2 ))
( segid " " and resid 47 and name HD2%)
ASSI { 1338}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HG ))
2.800 1.000 1.000 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 1.724 ppm2 1.513 CV 1
ASSI { 1341}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HB3 ))
2.300 0.600 0.600 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.27041E-02 ppm1 1.730 ppm2 1.893 CV 1
ASSI { 1342}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
3.300 1.400 1.400 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.64409E-03 ppm1 1.741 ppm2 4.826 CV 1
ASSI { 1343}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 47 and name HA ))
4.100 2.100 1.900 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.58301E-03 ppm1 1.892 ppm2 4.823 CV 1
ASSI { 1348}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 47 and name HD2%)
2.100 0.600 0.600 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.10267E-01 ppm1 1.527 ppm2 0.699 CV 1
OR { 1348}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 47 and name HD1%)
ASSI { 1349}
(( segid " " and resid 47 and name HG ))
(( segid " " and resid 47 and name HB3 ))
2.900 1.000 1.000 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.25597E-02 ppm1 1.527 ppm2 1.900 CV 1
ASSI { 1350}
(( segid " " and resid 47 and name HG ))
(( segid " " and resid 26 and name HA ))
2.000 0.500 0.500 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.23044E-02 ppm1 1.527 ppm2 3.656 CV 1
ASSI { 1351}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HA ))
3.700 1.800 1.800 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.10827E-02 ppm1 1.538 ppm2 4.301 CV 1
ASSI { 1352}
(( segid " " and resid 47 and name HG ))
(( segid " " and resid 47 and name HA ))
3.200 1.200 1.200 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.14714E-02 ppm1 1.525 ppm2 4.827 CV 1
ASSI { 1353}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HB3 ))
2.000 0.500 0.500 peak 1353 spectrum 1 weight 0.10000E+01 volume 0.13670E-01 ppm1 0.690 ppm2 1.256 CV 1
ASSI { 1354}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 47 and name HA ))
3.700 1.700 1.700 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.24597E-02 ppm1 0.708 ppm2 4.828 CV 1
OR { 1354}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 47 and name HA ))
ASSI { 1355}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 64 and name HZ2 ))
1.900 0.400 0.400 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.37201E-02 ppm1 0.708 ppm2 7.220 CV 1
OR { 1355}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 64 and name HZ2 ))
ASSI { 1358}
(( segid " " and resid 45 and name HB3 ))
( segid " " and resid 45 and name HD2%)
2.800 1.000 1.000 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.30928E-02 ppm1 1.620 ppm2 0.593 CV 1
OR { 1358}
(( segid " " and resid 45 and name HB3 ))
( segid " " and resid 45 and name HD1%)
ASSI { 1359}
(( segid " " and resid 45 and name HB2 ))
( segid " " and resid 45 and name HD1%)
2.600 0.900 0.900 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.29706E-02 ppm1 1.288 ppm2 0.597 CV 1
OR { 1359}
(( segid " " and resid 45 and name HB2 ))
( segid " " and resid 45 and name HD2%)
ASSI { 1360}
(( segid " " and resid 45 and name HB2 ))
( segid " " and resid 52 and name HD1%)
4.700 2.800 1.300 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.92171E-03 ppm1 1.289 ppm2 0.472 CV 1
ASSI { 1361}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HB3 ))
2.100 0.600 0.600 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.32205E-02 ppm1 1.288 ppm2 1.609 CV 1
OR { 1361}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HG ))
ASSI { 1362}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name HB2 ))
2.100 0.500 0.500 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.29372E-02 ppm1 1.622 ppm2 1.279 CV 1
ASSI { 1363}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HA ))
3.300 1.400 1.400 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.81621E-03 ppm1 1.290 ppm2 4.554 CV 1
ASSI { 1364}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 46 and name H ))
4.800 2.900 1.200 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.55525E-03 ppm1 1.626 ppm2 8.912 CV 1
ASSI { 1365}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name H ))
3.600 1.700 1.700 peak 1365 spectrum 1 weight 0.10000E+01 volume 0.90505E-03 ppm1 1.634 ppm2 9.063 CV 1
ASSI { 1367}
(( segid " " and resid 45 and name HG ))
( segid " " and resid 44 and name HG1%)
2.300 0.700 0.700 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.10161E-02 ppm1 1.601 ppm2 0.373 CV 1
ASSI { 1369}
(( segid " " and resid 45 and name HG ))
( segid " " and resid 45 and name HD1%)
2.200 0.600 0.600 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.71904E-02 ppm1 1.593 ppm2 0.594 CV 1
OR { 1369}
(( segid " " and resid 45 and name HG ))
( segid " " and resid 45 and name HD2%)
ASSI { 1370}
(( segid " " and resid 45 and name HG ))
(( segid " " and resid 45 and name HB2 ))
2.700 0.900 0.900 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.40478E-02 ppm1 1.597 ppm2 1.271 CV 1
ASSI { 1371}
(( segid " " and resid 45 and name HG ))
(( segid " " and resid 45 and name H ))
2.800 1.000 1.000 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.12160E-02 ppm1 1.592 ppm2 9.050 CV 1
ASSI { 1372}
( segid " " and resid 45 and name HD1%)
( segid " " and resid 23 and name HD2%)
2.100 0.500 0.500 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.19656E-02 ppm1 0.600 ppm2 0.214 CV 1
ASSI { 1373}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HG ))
2.300 0.700 0.700 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.10178E-01 ppm1 0.599 ppm2 1.602 CV 1
OR { 1373}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HB3 ))
ASSI { 1375}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 43 and name HB3 ))
3.500 1.600 1.600 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.15436E-02 ppm1 0.597 ppm2 2.599 CV 1
OR { 1375}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 43 and name HB2 ))
ASSI { 1376}
( segid " " and resid 45 and name HD1%)
( segid " " and resid 43 and name HD% )
4.400 2.400 1.600 peak 1376 spectrum 1 weight 0.10000E+01 volume 0.97723E-03 ppm1 0.599 ppm2 6.880 CV 1
ASSI { 1377}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name H ))
3.600 1.600 1.600 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.19100E-02 ppm1 0.599 ppm2 9.056 CV 1
ASSI { 1378}
( segid " " and resid 45 and name HD2%)
(( segid " " and resid 45 and name H ))
4.100 2.100 1.900 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.14547E-02 ppm1 0.582 ppm2 9.056 CV 1
ASSI { 1379}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 14 and name H ))
3.100 1.200 1.200 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.24042E-02 ppm1 0.574 ppm2 8.903 CV 1
ASSI { 1381}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 43 and name H ))
2.400 0.700 0.700 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.88840E-03 ppm1 0.570 ppm2 8.374 CV 1
ASSI { 1382}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 55 and name HD2 ))
2.200 0.600 0.600 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.13104E-02 ppm1 0.574 ppm2 7.073 CV 1
ASSI { 1383}
( segid " " and resid 45 and name HD2%)
( segid " " and resid 43 and name HD% )
3.500 1.500 1.500 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.12160E-02 ppm1 0.585 ppm2 6.880 CV 1
ASSI { 1384}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 13 and name HA ))
3.200 1.300 1.300 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.69461E-02 ppm1 0.570 ppm2 4.355 CV 1
ASSI { 1385}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 53 and name HB3 ))
2.000 0.500 0.500 peak 1385 spectrum 1 weight 0.10000E+01 volume 0.29651E-02 ppm1 0.572 ppm2 3.643 CV 1
ASSI { 1386}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 53 and name HB2 ))
1.900 0.500 0.500 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.30317E-02 ppm1 0.570 ppm2 2.654 CV 1
ASSI { 1387}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 12 and name HG3 ))
2.400 0.700 0.700 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.97723E-03 ppm1 0.570 ppm2 2.267 CV 1
OR { 1387}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 12 and name HG2 ))
ASSI { 1388}
( segid " " and resid 13 and name HD2%)
(( segid " " and resid 13 and name HB3 ))
2.700 0.900 0.900 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.24264E-02 ppm1 0.570 ppm2 1.916 CV 1
ASSI { 1389}
( segid " " and resid 13 and name HD2%)
( segid " " and resid 13 and name HD1%)
2.300 0.700 0.700 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.12116E-01 ppm1 0.572 ppm2 0.877 CV 1
ASSI { 1392}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 53 and name HA ))
4.100 2.100 1.900 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.76624E-03 ppm1 4.511 ppm2 5.086 CV 1
ASSI { 1393}
( segid " " and resid 44 and name HG1%)
( segid " " and resid 44 and name HG2%)
2.400 0.700 0.700 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.11222E-01 ppm1 0.398 ppm2 0.773 CV 1
ASSI { 1394}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 44 and name HB ))
2.600 0.900 0.900 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.44809E-02 ppm1 0.398 ppm2 1.930 CV 1
ASSI { 1395}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 30 and name HB3 ))
2.300 0.700 0.700 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.11605E-02 ppm1 0.399 ppm2 2.120 CV 1
ASSI { 1396}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 51 and name HB3 ))
3.600 1.700 1.700 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.26041E-02 ppm1 0.398 ppm2 3.407 CV 1
OR { 1396}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 51 and name HB2 ))
ASSI { 1397}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 44 and name HA ))
3.200 1.300 1.300 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.34426E-02 ppm1 0.397 ppm2 4.510 CV 1
ASSI { 1398}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 53 and name HA ))
2.500 0.800 0.800 peak 1398 spectrum 1 weight 0.10000E+01 volume 0.67740E-03 ppm1 0.394 ppm2 5.087 CV 1
ASSI { 1399}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 45 and name H ))
3.500 1.500 1.500 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.28818E-02 ppm1 0.398 ppm2 9.061 CV 1
ASSI { 1404}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HB ))
2.300 0.700 0.700 peak 1404 spectrum 1 weight 0.10000E+01 volume 0.87229E-02 ppm1 0.771 ppm2 1.919 CV 1
ASSI { 1405}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 32 and name HB3 ))
2.000 0.500 0.500 peak 1405 spectrum 1 weight 0.10000E+01 volume 0.28096E-02 ppm1 0.771 ppm2 1.758 CV 1
ASSI { 1406}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 30 and name HB3 ))
1.900 0.400 0.400 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.35980E-02 ppm1 0.770 ppm2 2.114 CV 1
ASSI { 1407}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HA ))
2.600 0.800 0.800 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.58191E-02 ppm1 0.771 ppm2 4.499 CV 1
ASSI { 1408}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 43 and name HA ))
2.000 0.500 0.500 peak 1408 spectrum 1 weight 0.10000E+01 volume 0.22598E-02 ppm1 0.769 ppm2 5.102 CV 1
ASSI { 1409}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 45 and name H ))
2.900 1.000 1.000 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.22598E-02 ppm1 0.772 ppm2 9.058 CV 1
ASSI { 1410}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name H ))
3.300 1.400 1.400 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.42031E-02 ppm1 0.771 ppm2 9.540 CV 1
ASSI { 1413}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 31 and name HA ))
2.200 0.600 0.600 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.15158E-02 ppm1 5.112 ppm2 4.465 CV 1
ASSI { 1414}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HD% )
3.500 1.500 1.500 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.99945E-03 ppm1 5.123 ppm2 6.882 CV 1
ASSI { 1416}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 32 and name H ))
2.500 0.800 0.800 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.69962E-03 ppm1 5.128 ppm2 8.833 CV 1
ASSI { 1419}
(( segid " " and resid 43 and name HB2 ))
( segid " " and resid 29 and name HG1%)
2.200 0.600 0.600 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.16269E-02 ppm1 2.611 ppm2 0.745 CV 1
OR { 1419}
(( segid " " and resid 43 and name HB3 ))
( segid " " and resid 29 and name HG1%)
ASSI { 1424}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 56 and name HG2 ))
2.300 0.700 0.700 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.10272E-02 ppm1 4.381 ppm2 1.369 CV 1
ASSI { 1425}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 56 and name HD3 ))
2.400 0.700 0.700 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.89949E-03 ppm1 4.376 ppm2 2.327 CV 1
ASSI { 1426}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 56 and name HD2 ))
2.300 0.600 0.600 peak 1426 spectrum 1 weight 0.10000E+01 volume 0.12438E-02 ppm1 4.378 ppm2 3.641 CV 1
ASSI { 1427}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name H ))
2.800 1.000 1.000 peak 1427 spectrum 1 weight 0.10000E+01 volume 0.26485E-02 ppm1 4.374 ppm2 8.367 CV 1
ASSI { 1429}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 32 and name HB2 ))
2.000 0.500 0.500 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.27263E-02 ppm1 1.067 ppm2 1.890 CV 1
ASSI { 1430}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 32 and name HB3 ))
2.100 0.600 0.600 peak 1430 spectrum 1 weight 0.10000E+01 volume 0.18491E-02 ppm1 1.067 ppm2 1.759 CV 1
ASSI { 1431}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 32 and name HG2 ))
2.200 0.600 0.600 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.13048E-02 ppm1 1.066 ppm2 2.283 CV 1
ASSI { 1432}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 32 and name HG3 ))
2.500 0.800 0.800 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.66631E-03 ppm1 1.067 ppm2 2.120 CV 1
ASSI { 1433}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 42 and name HA ))
2.500 0.800 0.800 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.68406E-02 ppm1 1.067 ppm2 4.371 CV 1
ASSI { 1434}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 43 and name HA ))
4.400 2.500 1.600 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.87730E-03 ppm1 1.066 ppm2 5.104 CV 1
ASSI { 1435}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 32 and name HE22))
2.400 0.700 0.700 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.92727E-03 ppm1 1.064 ppm2 7.054 CV 1
ASSI { 1436}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 32 and name HE21))
2.500 0.800 0.800 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.76624E-03 ppm1 1.071 ppm2 7.893 CV 1
ASSI { 1437}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 43 and name H ))
2.900 1.100 1.100 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.39755E-02 ppm1 1.066 ppm2 8.369 CV 1
ASSI { 1438}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 32 and name H ))
2.300 0.700 0.700 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.10161E-02 ppm1 1.069 ppm2 8.844 CV 1
ASSI { 1439}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 42 and name H ))
3.000 1.100 1.100 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.23044E-02 ppm1 1.065 ppm2 8.696 CV 1
ASSI { 1440}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 10 and name H ))
2.500 0.800 0.800 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.62188E-03 ppm1 1.063 ppm2 9.574 CV 1
ASSI { 1442}
(( segid " " and resid 41 and name HG3 ))
( segid " " and resid 34 and name HB% )
2.300 0.600 0.600 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.12771E-02 ppm1 1.860 ppm2 1.195 CV 1
ASSI { 1443}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 41 and name HG2 ))
2.000 0.500 0.500 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.72515E-02 ppm1 1.865 ppm2 2.301 CV 1
ASSI { 1444}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 41 and name HA ))
4.100 2.100 1.900 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.11049E-02 ppm1 1.868 ppm2 4.632 CV 1
ASSI { 1446}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 41 and name H ))
5.000 3.100 1.000 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.73849E-03 ppm1 1.872 ppm2 8.448 CV 1
ASSI { 1448}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HG2 ))
3.000 1.200 1.200 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.29816E-02 ppm1 1.788 ppm2 2.298 CV 1
OR { 1448}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HG2 ))
ASSI { 1449}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HA ))
3.300 1.400 1.400 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.11716E-02 ppm1 1.788 ppm2 4.628 CV 1
OR { 1449}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HA ))
ASSI { 1451}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name H ))
3.300 1.300 1.300 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.17324E-02 ppm1 1.790 ppm2 8.445 CV 1
OR { 1451}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name H ))
ASSI { 1453}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB3 ))
2.500 0.800 0.800 peak 1453 spectrum 1 weight 0.10000E+01 volume 0.34426E-02 ppm1 4.409 ppm2 1.201 CV 1
ASSI { 1454}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB2 ))
3.300 1.300 1.300 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.18491E-02 ppm1 4.409 ppm2 1.408 CV 1
ASSI { 1455}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HB2 ))
3.700 1.700 1.700 peak 1455 spectrum 1 weight 0.10000E+01 volume 0.14436E-02 ppm1 4.420 ppm2 1.785 CV 1
OR { 1455}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HB3 ))
ASSI { 1457}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 41 and name H ))
3.300 1.300 1.300 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.86064E-03 ppm1 1.206 ppm2 8.439 CV 1
ASSI { 1458}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 41 and name H ))
4.400 2.400 1.600 peak 1458 spectrum 1 weight 0.10000E+01 volume 0.64409E-03 ppm1 1.399 ppm2 8.450 CV 1
ASSI { 1461}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HB2 ))
2.100 0.500 0.500 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.49917E-02 ppm1 1.199 ppm2 1.403 CV 1
ASSI { 1463}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HA ))
2.400 0.700 0.700 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.33648E-02 ppm1 1.230 ppm2 4.304 CV 1
OR { 1463}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HA ))
ASSI { 1464}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name H ))
3.900 1.900 1.900 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.23931E-02 ppm1 0.652 ppm2 7.225 CV 1
ASSI { 1465}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 23 and name H ))
4.400 2.500 1.600 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.89395E-03 ppm1 0.741 ppm2 7.786 CV 1
ASSI { 1466}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name HG ))
2.300 0.700 0.700 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.96170E-02 ppm1 0.784 ppm2 1.270 CV 1
ASSI { 1467}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 3 and name HA ))
3.000 1.100 1.100 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.81621E-02 ppm1 0.850 ppm2 4.537 CV 1
ASSI { 1468}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 18 and name HA ))
2.200 0.600 0.600 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.78290E-02 ppm1 0.721 ppm2 4.441 CV 1
ASSI { 1469}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 41 and name H ))
4.000 2.000 2.000 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.20433E-02 ppm1 0.788 ppm2 8.453 CV 1
ASSI { 1470}
( segid " " and resid 2 and name HD1%)
(( segid " " and resid 3 and name H ))
3.400 1.500 1.500 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.37478E-02 ppm1 0.779 ppm2 8.262 CV 1
ASSI { 1471}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 3 and name H ))
3.000 1.100 1.100 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.18324E-02 ppm1 0.849 ppm2 8.263 CV 1
ASSI { 1472}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB3 ))
2.600 0.800 0.800 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.31038E-02 ppm1 4.621 ppm2 3.330 CV 1
ASSI { 1473}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HB2 ))
2.000 0.500 0.500 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.78235E-02 ppm1 3.331 ppm2 3.106 CV 1
ASSI { 1475}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HA ))
3.400 1.400 1.400 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.14436E-02 ppm1 3.104 ppm2 4.621 CV 1
ASSI { 1479}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name H ))
3.900 1.900 1.900 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.65519E-03 ppm1 3.114 ppm2 7.991 CV 1
ASSI { 1481}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 38 and name HB2 ))
2.400 0.700 0.700 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.22099E-02 ppm1 3.164 ppm2 2.904 CV 1
ASSI { 1483}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 38 and name HA ))
3.600 1.600 1.600 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.79956E-03 ppm1 3.166 ppm2 4.635 CV 1
ASSI { 1484}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HA ))
3.100 1.200 1.200 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.10772E-02 ppm1 2.916 ppm2 4.630 CV 1
ASSI { 1488}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB3 ))
1.800 0.400 0.400 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.14836E-01 ppm1 2.604 ppm2 2.464 CV 1
ASSI { 1492}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HA ))
2.400 0.700 0.700 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.95392E-02 ppm1 2.609 ppm2 4.175 CV 1
OR { 1492}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HA ))
ASSI { 1495}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name H ))
2.800 1.000 1.000 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.16769E-02 ppm1 2.550 ppm2 8.011 CV 1
ASSI { 1499}
(( segid " " and resid 36 and name HA2 ))
(( segid " " and resid 36 and name HA3 ))
2.200 0.600 0.600 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.54137E-02 ppm1 3.760 ppm2 4.022 CV 1
ASSI { 1501}
(( segid " " and resid 36 and name HA2 ))
(( segid " " and resid 36 and name H ))
3.400 1.500 1.500 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.69962E-03 ppm1 3.751 ppm2 7.563 CV 1
ASSI { 1504}
( segid " " and resid 81 and name HE% )
(( segid " " and resid 81 and name HB3 ))
4.400 2.500 1.600 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.97168E-03 ppm1 7.162 ppm2 2.898 CV 1
ASSI { 1505}
( segid " " and resid 81 and name HE% )
(( segid " " and resid 81 and name HA ))
4.700 2.700 1.300 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.87730E-03 ppm1 7.157 ppm2 4.434 CV 1
ASSI { 1506}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 35 and name HA ))
2.900 1.000 1.000 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.24208E-02 ppm1 2.669 ppm2 4.625 CV 1
ASSI { 1507}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HA ))
3.100 1.200 1.200 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.26764E-02 ppm1 2.549 ppm2 4.625 CV 1
ASSI { 1511}
( segid " " and resid 34 and name HB% )
(( segid " " and resid 41 and name HB3 ))
1.800 0.400 0.400 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.44532E-02 ppm1 1.193 ppm2 1.792 CV 1
OR { 1511}
( segid " " and resid 34 and name HB% )
(( segid " " and resid 41 and name HB2 ))
ASSI { 1513}
( segid " " and resid 34 and name HB% )
(( segid " " and resid 34 and name HA ))
2.400 0.700 0.700 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.76402E-02 ppm1 1.194 ppm2 3.837 CV 1
ASSI { 1514}
( segid " " and resid 34 and name HB% )
(( segid " " and resid 35 and name H ))
3.600 1.600 1.600 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.33536E-02 ppm1 1.194 ppm2 8.014 CV 1
ASSI { 1515}
( segid " " and resid 34 and name HB% )
(( segid " " and resid 41 and name H ))
2.000 0.500 0.500 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.28262E-02 ppm1 1.195 ppm2 8.453 CV 1
ASSI { 1516}
( segid " " and resid 34 and name HB% )
(( segid " " and resid 34 and name H ))
2.500 0.800 0.800 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.58967E-02 ppm1 1.194 ppm2 8.775 CV 1
ASSI { 1520}
(( segid " " and resid 33 and name HG3 ))
( segid " " and resid 31 and name HD1%)
2.200 0.600 0.600 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.16158E-02 ppm1 2.072 ppm2 0.650 CV 1
ASSI { 1522}
(( segid " " and resid 33 and name HG3 ))
(( segid " " and resid 33 and name HA ))
2.700 0.900 0.900 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.19711E-02 ppm1 2.074 ppm2 4.337 CV 1
ASSI { 1523}
(( segid " " and resid 33 and name HG3 ))
(( segid " " and resid 33 and name HB3 ))
2.800 1.000 1.000 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.36314E-02 ppm1 2.076 ppm2 1.646 CV 1
ASSI { 1524}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HB3 ))
2.100 0.500 0.500 peak 1524 spectrum 1 weight 0.10000E+01 volume 0.44587E-02 ppm1 2.012 ppm2 1.651 CV 1
ASSI { 1527}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HA ))
3.200 1.300 1.300 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.15214E-02 ppm1 2.005 ppm2 4.331 CV 1
ASSI { 1528}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HA ))
3.100 1.200 1.200 peak 1528 spectrum 1 weight 0.10000E+01 volume 0.14603E-02 ppm1 1.649 ppm2 4.330 CV 1
ASSI { 1530}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name H ))
3.700 1.700 1.700 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.19489E-02 ppm1 1.649 ppm2 8.443 CV 1
ASSI { 1532}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 34 and name H ))
4.300 2.400 1.700 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.10272E-02 ppm1 2.010 ppm2 8.772 CV 1
ASSI { 1533}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 34 and name H ))
3.800 1.800 1.800 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.84398E-03 ppm1 1.650 ppm2 8.786 CV 1
ASSI { 1538}
(( segid " " and resid 32 and name HG3 ))
(( segid " " and resid 32 and name HA ))
4.300 2.300 1.700 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.15825E-02 ppm1 2.125 ppm2 4.481 CV 1
ASSI { 1539}
(( segid " " and resid 32 and name HG3 ))
(( segid " " and resid 32 and name HE22))
4.600 2.700 1.400 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.66631E-03 ppm1 2.138 ppm2 7.069 CV 1
ASSI { 1540}
(( segid " " and resid 32 and name HG2 ))
(( segid " " and resid 32 and name HE22))
4.700 2.700 1.300 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.53304E-03 ppm1 2.267 ppm2 7.050 CV 1
ASSI { 1542}
(( segid " " and resid 32 and name HG3 ))
(( segid " " and resid 33 and name H ))
5.000 3.100 1.000 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.56081E-03 ppm1 2.121 ppm2 8.439 CV 1
ASSI { 1544}
(( segid " " and resid 32 and name HB2 ))
( segid " " and resid 44 and name HG2%)
2.400 0.700 0.700 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.94948E-03 ppm1 1.879 ppm2 0.756 CV 1
ASSI { 1547}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HA ))
3.200 1.300 1.300 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.13548E-02 ppm1 1.882 ppm2 4.471 CV 1
ASSI { 1548}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name H ))
3.300 1.300 1.300 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.71072E-03 ppm1 1.767 ppm2 8.856 CV 1
ASSI { 1551}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name H ))
3.600 1.600 1.600 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.29317E-02 ppm1 1.781 ppm2 7.728 CV 1
ASSI { 1553}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB2 ))
3.300 1.300 1.300 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.20211E-02 ppm1 4.498 ppm2 2.631 CV 1
ASSI { 1554}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB3 ))
2.900 1.100 1.100 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.13715E-02 ppm1 4.494 ppm2 2.897 CV 1
ASSI { 1555}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name H ))
3.200 1.300 1.300 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.23209E-02 ppm1 4.503 ppm2 9.601 CV 1
ASSI { 1556}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 31 and name HD2%)
3.200 1.300 1.300 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.14325E-02 ppm1 1.233 ppm2 0.352 CV 1
ASSI { 1558}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 31 and name HD1%)
2.700 0.900 0.900 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.32704E-02 ppm1 1.620 ppm2 0.653 CV 1
ASSI { 1559}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HB3 ))
2.100 0.600 0.600 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.44198E-02 ppm1 1.620 ppm2 1.232 CV 1
ASSI { 1560}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HG ))
2.600 0.800 0.800 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.20600E-02 ppm1 1.236 ppm2 1.137 CV 1
ASSI { 1562}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HA ))
2.900 1.000 1.000 peak 1562 spectrum 1 weight 0.10000E+01 volume 0.13048E-02 ppm1 1.614 ppm2 4.465 CV 1
ASSI { 1563}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HA ))
3.200 1.300 1.300 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.16158E-02 ppm1 1.252 ppm2 4.451 CV 1
ASSI { 1566}
(( segid " " and resid 31 and name HG ))
(( segid " " and resid 31 and name HB2 ))
3.000 1.100 1.100 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.24652E-02 ppm1 1.133 ppm2 1.621 CV 1
ASSI { 1567}
(( segid " " and resid 31 and name HG ))
(( segid " " and resid 33 and name HG3 ))
4.900 3.000 1.100 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.70516E-03 ppm1 1.136 ppm2 2.073 CV 1
ASSI { 1569}
(( segid " " and resid 31 and name HG ))
(( segid " " and resid 31 and name HA ))
3.600 1.600 1.600 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.72737E-03 ppm1 1.142 ppm2 4.478 CV 1
ASSI { 1570}
( segid " " and resid 31 and name HD1%)
( segid " " and resid 31 and name HD2%)
2.100 0.600 0.600 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.11588E-01 ppm1 0.650 ppm2 0.339 CV 1
ASSI { 1571}
( segid " " and resid 31 and name HD1%)
(( segid " " and resid 31 and name HG ))
2.100 0.600 0.600 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.66464E-02 ppm1 0.649 ppm2 1.137 CV 1
ASSI { 1574}
( segid " " and resid 31 and name HD1%)
(( segid " " and resid 31 and name H ))
3.900 1.900 1.900 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.17990E-02 ppm1 0.650 ppm2 8.845 CV 1
ASSI { 1575}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HG ))
2.100 0.500 0.500 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.10622E-01 ppm1 0.694 ppm2 1.746 CV 1
ASSI { 1577}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 31 and name HG ))
2.400 0.700 0.700 peak 1577 spectrum 1 weight 0.10000E+01 volume 0.35648E-02 ppm1 0.349 ppm2 1.137 CV 1
ASSI { 1578}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 31 and name HB2 ))
2.900 1.000 1.000 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.18990E-02 ppm1 0.346 ppm2 1.615 CV 1
ASSI { 1579}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 41 and name HG3 ))
2.300 0.600 0.600 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.12049E-02 ppm1 0.344 ppm2 1.857 CV 1
ASSI { 1580}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 41 and name HG2 ))
2.300 0.600 0.600 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.12771E-02 ppm1 0.343 ppm2 2.285 CV 1
ASSI { 1581}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 31 and name HA ))
3.800 1.800 1.800 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.26208E-02 ppm1 0.348 ppm2 4.465 CV 1
ASSI { 1582}
(( segid " " and resid 33 and name HG3 ))
(( segid " " and resid 31 and name H ))
2.400 0.700 0.700 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.96058E-03 ppm1 2.085 ppm2 8.828 CV 1
ASSI { 1584}
(( segid " " and resid 30 and name HB2 ))
( segid " " and resid 44 and name HG1%)
2.500 0.800 0.800 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.70516E-03 ppm1 1.957 ppm2 0.392 CV 1
ASSI { 1586}
(( segid " " and resid 30 and name HB2 ))
( segid " " and resid 44 and name HG2%)
2.300 0.700 0.700 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.10605E-02 ppm1 1.963 ppm2 0.766 CV 1
ASSI { 1587}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HA ))
3.600 1.600 1.600 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.76624E-03 ppm1 1.967 ppm2 4.832 CV 1
ASSI { 1588}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 31 and name H ))
4.500 2.500 1.500 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.84952E-03 ppm1 2.123 ppm2 8.845 CV 1
ASSI { 1590}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name H ))
3.800 1.800 1.800 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.82733E-03 ppm1 2.120 ppm2 9.064 CV 1
ASSI { 1593}
(( segid " " and resid 29 and name HB ))
(( segid " " and resid 29 and name HA ))
3.700 1.700 1.700 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.59412E-03 ppm1 1.767 ppm2 4.919 CV 1
ASSI { 1594}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 29 and name HG1%)
2.500 0.800 0.800 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.40645E-02 ppm1 1.774 ppm2 0.735 CV 1
ASSI { 1595}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 29 and name HG2%)
2.700 0.900 0.900 peak 1595 spectrum 1 weight 0.10000E+01 volume 0.30539E-02 ppm1 1.774 ppm2 0.515 CV 1
ASSI { 1598}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 29 and name HA ))
3.100 1.200 1.200 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.15325E-02 ppm1 0.735 ppm2 4.915 CV 1
ASSI { 1599}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 29 and name HA ))
3.300 1.300 1.300 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.97168E-03 ppm1 0.512 ppm2 4.910 CV 1
ASSI { 1602}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 30 and name H ))
4.700 2.700 1.300 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.82177E-03 ppm1 0.512 ppm2 9.071 CV 1
ASSI { 1603}
( segid " " and resid 29 and name HG1%)
(( segid " " and resid 30 and name H ))
2.900 1.100 1.100 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.19045E-02 ppm1 0.735 ppm2 9.066 CV 1
ASSI { 1605}
( segid " " and resid 29 and name HG1%)
( segid " " and resid 29 and name HG2%)
2.400 0.700 0.700 peak 1605 spectrum 1 weight 0.10000E+01 volume 0.78956E-02 ppm1 0.734 ppm2 0.510 CV 1
ASSI { 1609}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name HE22))
4.200 2.200 1.800 peak 1609 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 2.161 ppm2 6.673 CV 1
ASSI { 1610}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name HE21))
2.700 0.900 0.900 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.12382E-02 ppm1 2.166 ppm2 7.409 CV 1
ASSI { 1611}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name HB3 ))
2.700 0.900 0.900 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.29594E-02 ppm1 2.162 ppm2 1.851 CV 1
ASSI { 1612}
(( segid " " and resid 28 and name HG3 ))
( segid " " and resid 27 and name HG2%)
4.300 2.300 1.700 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.97723E-03 ppm1 2.166 ppm2 0.877 CV 1
ASSI { 1613}
(( segid " " and resid 28 and name HG2 ))
( segid " " and resid 27 and name HG2%)
4.100 2.100 1.900 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.17490E-02 ppm1 2.280 ppm2 0.860 CV 1
ASSI { 1617}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 27 and name HD1%)
3.700 1.700 1.700 peak 1617 spectrum 1 weight 0.10000E+01 volume 0.29873E-02 ppm1 4.248 ppm2 0.734 CV 1
ASSI { 1619}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HG12))
3.300 1.400 1.400 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.14103E-02 ppm1 4.243 ppm2 1.468 CV 1
ASSI { 1620}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB ))
2.900 1.000 1.000 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.24042E-02 ppm1 4.245 ppm2 1.817 CV 1
ASSI { 1624}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 27 and name HG12))
3.100 1.200 1.200 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.21211E-02 ppm1 1.810 ppm2 1.472 CV 1
ASSI { 1626}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 27 and name H ))
3.100 1.200 1.200 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.15991E-02 ppm1 1.809 ppm2 9.069 CV 1
ASSI { 1627}
(( segid " " and resid 27 and name HG12))
(( segid " " and resid 27 and name H ))
4.300 2.300 1.700 peak 1627 spectrum 1 weight 0.10000E+01 volume 0.14881E-02 ppm1 1.475 ppm2 9.066 CV 1
ASSI { 1629}
(( segid " " and resid 27 and name HG12))
(( segid " " and resid 27 and name HG13))
1.700 0.400 0.500 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.10800E-01 ppm1 1.478 ppm2 1.056 CV 1
ASSI { 1630}
(( segid " " and resid 27 and name HG13))
( segid " " and resid 27 and name HG2%)
3.300 1.300 1.300 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.39590E-02 ppm1 1.055 ppm2 0.879 CV 1
ASSI { 1631}
(( segid " " and resid 27 and name HG13))
( segid " " and resid 27 and name HD1%)
2.200 0.600 0.600 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.66796E-02 ppm1 1.056 ppm2 0.727 CV 1
ASSI { 1633}
(( segid " " and resid 27 and name HG13))
(( segid " " and resid 27 and name HB ))
2.900 1.000 1.000 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.20433E-02 ppm1 1.055 ppm2 1.813 CV 1
ASSI { 1634}
(( segid " " and resid 27 and name HG13))
(( segid " " and resid 27 and name HA ))
3.100 1.200 1.200 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.14881E-02 ppm1 1.055 ppm2 4.237 CV 1
ASSI { 1636}
(( segid " " and resid 27 and name HG13))
(( segid " " and resid 27 and name H ))
2.300 0.700 0.700 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.14936E-02 ppm1 1.056 ppm2 9.063 CV 1
ASSI { 1637}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 27 and name HG12))
2.400 0.700 0.700 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.55525E-02 ppm1 0.881 ppm2 1.469 CV 1
ASSI { 1638}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 27 and name HB ))
2.200 0.600 0.600 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.10405E-01 ppm1 0.881 ppm2 1.816 CV 1
ASSI { 1640}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 27 and name HA ))
2.400 0.700 0.700 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.61799E-02 ppm1 0.882 ppm2 4.239 CV 1
ASSI { 1641}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 28 and name H ))
3.700 1.700 1.700 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.16435E-02 ppm1 0.881 ppm2 7.548 CV 1
ASSI { 1642}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 27 and name H ))
4.100 2.100 1.900 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.20099E-02 ppm1 0.880 ppm2 9.068 CV 1
ASSI { 1643}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 48 and name H ))
2.500 0.800 0.800 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.72181E-03 ppm1 0.880 ppm2 8.828 CV 1
ASSI { 1644}
( segid " " and resid 27 and name HD1%)
(( segid " " and resid 27 and name H ))
3.700 1.800 1.800 peak 1644 spectrum 1 weight 0.10000E+01 volume 0.15658E-02 ppm1 0.730 ppm2 9.066 CV 1
ASSI { 1645}
( segid " " and resid 27 and name HD1%)
(( segid " " and resid 48 and name H ))
2.000 0.500 0.500 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.26430E-02 ppm1 0.732 ppm2 8.827 CV 1
ASSI { 1646}
( segid " " and resid 27 and name HD1%)
(( segid " " and resid 28 and name H ))
2.300 0.600 0.600 peak 1646 spectrum 1 weight 0.10000E+01 volume 0.11882E-02 ppm1 0.731 ppm2 7.536 CV 1
ASSI { 1648}
( segid " " and resid 27 and name HD1%)
(( segid " " and resid 48 and name HA ))
1.700 0.300 0.500 peak 1648 spectrum 1 weight 0.10000E+01 volume 0.81733E-02 ppm1 0.732 ppm2 3.992 CV 1
ASSI { 1650}
( segid " " and resid 27 and name HD1%)
(( segid " " and resid 27 and name HB ))
2.300 0.700 0.700 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.68850E-02 ppm1 0.733 ppm2 1.812 CV 1
ASSI { 1654}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB ))
3.300 1.400 1.400 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.97723E-03 ppm1 3.660 ppm2 2.160 CV 1
ASSI { 1657}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 26 and name HG2%)
2.300 0.700 0.700 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.46419E-02 ppm1 3.661 ppm2 0.699 CV 1
ASSI { 1658}
( segid " " and resid 26 and name HG1%)
( segid " " and resid 23 and name HD2%)
2.000 0.500 0.500 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.25764E-02 ppm1 0.849 ppm2 0.247 CV 1
ASSI { 1659}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 3 and name HG ))
2.100 0.500 0.500 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.13820E-01 ppm1 0.850 ppm2 1.585 CV 1
ASSI { 1660}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 26 and name HB ))
2.400 0.700 0.700 peak 1660 spectrum 1 weight 0.10000E+01 volume 0.56969E-02 ppm1 0.849 ppm2 2.163 CV 1
ASSI { 1661}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 26 and name HA ))
2.700 0.900 0.900 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.71017E-02 ppm1 0.850 ppm2 3.651 CV 1
ASSI { 1663}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 25 and name H ))
2.200 0.600 0.600 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.14992E-02 ppm1 0.847 ppm2 7.648 CV 1
ASSI { 1664}
( segid " " and resid 26 and name HG2%)
( segid " " and resid 26 and name HG1%)
2.400 0.700 0.700 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.69406E-02 ppm1 0.679 ppm2 0.845 CV 1
ASSI { 1671}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HE2 ))
4.900 3.000 1.100 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.74959E-03 ppm1 2.038 ppm2 2.933 CV 1
OR { 1671}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 1672}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HE3 ))
4.700 2.800 1.300 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.58856E-03 ppm1 1.953 ppm2 2.923 CV 1
OR { 1672}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HE2 ))
ASSI { 1673}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 24 and name HA ))
2.500 0.800 0.800 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.29317E-02 ppm1 1.765 ppm2 4.131 CV 1
ASSI { 1674}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HB3 ))
2.700 0.900 0.900 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.27874E-02 ppm1 1.586 ppm2 2.041 CV 1
ASSI { 1675}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HB2 ))
3.200 1.300 1.300 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.27375E-02 ppm1 1.586 ppm2 1.960 CV 1
ASSI { 1676}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HE2 ))
2.500 0.800 0.800 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.27652E-02 ppm1 1.591 ppm2 2.929 CV 1
OR { 1676}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 1677}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HA ))
2.700 0.900 0.900 peak 1677 spectrum 1 weight 0.10000E+01 volume 0.31594E-02 ppm1 1.588 ppm2 4.338 CV 1
ASSI { 1678}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 26 and name H ))
3.400 1.500 1.500 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.73849E-03 ppm1 1.595 ppm2 7.209 CV 1
ASSI { 1680}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name H ))
3.400 1.500 1.500 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.21433E-02 ppm1 1.584 ppm2 7.650 CV 1
ASSI { 1683}
( segid " " and resid 43 and name HD% )
( segid " " and resid 29 and name HG1%)
2.100 0.500 0.500 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.21543E-02 ppm1 6.879 ppm2 0.745 CV 1
ASSI { 1684}
( segid " " and resid 43 and name HD% )
( segid " " and resid 45 and name HD2%)
3.800 1.800 1.800 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.82177E-03 ppm1 6.878 ppm2 0.610 CV 1
OR { 1684}
( segid " " and resid 43 and name HD% )
( segid " " and resid 45 and name HD1%)
ASSI { 1689}
(( segid " " and resid 1 and name HB3 ))
(( segid " " and resid 1 and name HA ))
2.500 0.800 0.800 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.28539E-02 ppm1 3.120 ppm2 4.117 CV 1
ASSI { 1690}
(( segid " " and resid 1 and name HB2 ))
(( segid " " and resid 1 and name HA ))
3.200 1.300 1.300 peak 1690 spectrum 1 weight 0.10000E+01 volume 0.23154E-02 ppm1 3.046 ppm2 4.118 CV 1
ASSI { 1692}
(( segid " " and resid 73 and name HD2 ))
(( segid " " and resid 73 and name HB2 ))
2.800 1.000 1.000 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.29484E-02 ppm1 7.116 ppm2 3.104 CV 1
ASSI { 1693}
(( segid " " and resid 67 and name HD2 ))
(( segid " " and resid 67 and name HA ))
4.300 2.300 1.700 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.94392E-03 ppm1 7.078 ppm2 4.451 CV 1
ASSI { 1694}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 55 and name HA ))
4.500 2.600 1.500 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.10661E-02 ppm1 7.083 ppm2 4.341 CV 1
ASSI { 1695}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 55 and name HB2 ))
3.300 1.300 1.300 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.10272E-02 ppm1 7.082 ppm2 2.843 CV 1
ASSI { 1696}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 55 and name HB3 ))
4.300 2.400 1.700 peak 1696 spectrum 1 weight 0.10000E+01 volume 0.61078E-03 ppm1 7.079 ppm2 2.715 CV 1
ASSI { 1697}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 13 and name HB3 ))
2.400 0.700 0.700 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.97723E-03 ppm1 7.084 ppm2 1.926 CV 1
ASSI { 1698}
(( segid " " and resid 55 and name HD2 ))
( segid " " and resid 13 and name HD1%)
2.000 0.500 0.500 peak 1698 spectrum 1 weight 0.10000E+01 volume 0.26986E-02 ppm1 7.081 ppm2 0.883 CV 1
ASSI { 1701}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HB3 ))
3.200 1.300 1.300 peak 1701 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 7.104 ppm2 3.329 CV 1
ASSI { 1702}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 65 and name H ))
4.900 3.000 1.100 peak 1702 spectrum 1 weight 0.10000E+01 volume 0.60522E-03 ppm1 3.025 ppm2 8.121 CV 1
ASSI { 1707}
(( segid " " and resid 64 and name HZ2 ))
(( segid " " and resid 64 and name HH2 ))
2.600 0.800 0.800 peak 1707 spectrum 1 weight 0.10000E+01 volume 0.62021E-02 ppm1 7.227 ppm2 6.888 CV 1
ASSI { 1709}
(( segid " " and resid 64 and name HH2 ))
(( segid " " and resid 64 and name HZ3 ))
2.700 0.900 0.900 peak 1709 spectrum 1 weight 0.10000E+01 volume 0.47252E-02 ppm1 6.891 ppm2 6.678 CV 1
ASSI { 1711}
(( segid " " and resid 64 and name HZ3 ))
(( segid " " and resid 64 and name HZ2 ))
4.500 2.500 1.500 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.84952E-03 ppm1 6.678 ppm2 7.215 CV 1
ASSI { 1712}
(( segid " " and resid 64 and name HZ3 ))
(( segid " " and resid 64 and name HE3 ))
3.200 1.300 1.300 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.13326E-02 ppm1 6.678 ppm2 7.010 CV 1
ASSI { 1713}
( segid " " and resid 14 and name HD% )
( segid " " and resid 14 and name HE% )
2.300 0.600 0.600 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.71627E-02 ppm1 7.016 ppm2 6.679 CV 1
ASSI { 1714}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 14 and name HB3 ))
3.000 1.100 1.100 peak 1714 spectrum 1 weight 0.10000E+01 volume 0.15991E-02 ppm1 7.015 ppm2 3.101 CV 1
OR { 1714}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 14 and name HB2 ))
ASSI { 1716}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 14 and name HB3 ))
4.500 2.500 1.500 peak 1716 spectrum 1 weight 0.10000E+01 volume 0.76624E-03 ppm1 6.682 ppm2 3.100 CV 1
OR { 1716}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 14 and name HB2 ))
ASSI { 1718}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 16 and name HB3 ))
3.300 1.300 1.300 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.26263E-02 ppm1 6.679 ppm2 1.228 CV 1
OR { 1718}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 16 and name HG3 ))
OR { 1718}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 16 and name HG2 ))
ASSI { 1719}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 16 and name HB2 ))
3.000 1.100 1.100 peak 1719 spectrum 1 weight 0.10000E+01 volume 0.16491E-02 ppm1 6.676 ppm2 1.756 CV 1
ASSI { 1721}
(( segid " " and resid 65 and name HZ ))
( segid " " and resid 65 and name HE% )
2.600 0.800 0.800 peak 1721 spectrum 1 weight 0.10000E+01 volume 0.52359E-02 ppm1 6.856 ppm2 7.064 CV 1
ASSI { 1723}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HG2 ))
2.300 0.700 0.700 peak 1723 spectrum 1 weight 0.10000E+01 volume 0.62910E-02 ppm1 4.128 ppm2 1.772 CV 1
OR { 1723}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB3 ))
ASSI { 1724}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB2 ))
2.800 1.000 1.000 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.47641E-02 ppm1 4.127 ppm2 1.884 CV 1
ASSI { 1727}
(( segid " " and resid 24 and name HD2 ))
(( segid " " and resid 24 and name HA ))
4.400 2.400 1.600 peak 1727 spectrum 1 weight 0.10000E+01 volume 0.18102E-02 ppm1 3.152 ppm2 4.132 CV 1
ASSI { 1728}
(( segid " " and resid 24 and name HD2 ))
(( segid " " and resid 24 and name H ))
4.500 2.500 1.500 peak 1728 spectrum 1 weight 0.10000E+01 volume 0.95502E-03 ppm1 3.155 ppm2 7.727 CV 1
ASSI { 1729}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HD3 ))
2.800 1.000 1.000 peak 1729 spectrum 1 weight 0.10000E+01 volume 0.19877E-02 ppm1 1.880 ppm2 3.092 CV 1
ASSI { 1730}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 21 and name HA ))
2.500 0.800 0.800 peak 1730 spectrum 1 weight 0.10000E+01 volume 0.67185E-03 ppm1 1.874 ppm2 3.794 CV 1
ASSI { 1731}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 21 and name HA ))
2.300 0.700 0.700 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.99389E-03 ppm1 1.772 ppm2 3.788 CV 1
ASSI { 1733}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 21 and name HA ))
2.600 0.800 0.800 peak 1733 spectrum 1 weight 0.10000E+01 volume 0.60522E-03 ppm1 1.763 ppm2 3.792 CV 1
ASSI { 1735}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 22 and name HG ))
2.300 0.700 0.700 peak 1735 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 3.642 ppm2 1.413 CV 1
ASSI { 1736}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB3 ))
2.500 0.800 0.800 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.34204E-02 ppm1 3.641 ppm2 0.846 CV 1
ASSI { 1740}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 23 and name HD2%)
4.700 2.800 1.300 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.73293E-03 ppm1 1.463 ppm2 0.231 CV 1
ASSI { 1742}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 23 and name HD1%)
2.900 1.100 1.100 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.14048E-02 ppm1 1.440 ppm2 0.486 CV 1
ASSI { 1743}
(( segid " " and resid 23 and name HB3 ))
( segid " " and resid 23 and name HD1%)
4.100 2.100 1.900 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.86618E-03 ppm1 0.832 ppm2 0.494 CV 1
ASSI { 1744}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HB3 ))
2.500 0.800 0.800 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.15991E-02 ppm1 1.441 ppm2 0.829 CV 1
ASSI { 1747}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HA ))
3.800 1.800 1.800 peak 1747 spectrum 1 weight 0.10000E+01 volume 0.48307E-03 ppm1 1.444 ppm2 3.630 CV 1
ASSI { 1748}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 20 and name HA ))
2.400 0.700 0.700 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.88284E-03 ppm1 1.439 ppm2 4.171 CV 1
ASSI { 1749}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 20 and name HA ))
2.500 0.800 0.800 peak 1749 spectrum 1 weight 0.10000E+01 volume 0.61632E-03 ppm1 0.836 ppm2 4.190 CV 1
ASSI { 1750}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name H ))
4.200 2.200 1.800 peak 1750 spectrum 1 weight 0.10000E+01 volume 0.93836E-03 ppm1 1.442 ppm2 7.777 CV 1
ASSI { 1752}
(( segid " " and resid 23 and name HG ))
( segid " " and resid 23 and name HD2%)
3.100 1.200 1.200 peak 1752 spectrum 1 weight 0.10000E+01 volume 0.14825E-02 ppm1 1.391 ppm2 0.232 CV 1
ASSI { 1753}
(( segid " " and resid 23 and name HG ))
( segid " " and resid 23 and name HD1%)
3.100 1.200 1.200 peak 1753 spectrum 1 weight 0.10000E+01 volume 0.16380E-02 ppm1 1.379 ppm2 0.482 CV 1
ASSI { 1754}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 23 and name HA ))
4.200 2.200 1.800 peak 1754 spectrum 1 weight 0.10000E+01 volume 0.55525E-03 ppm1 1.388 ppm2 3.636 CV 1
ASSI { 1755}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 23 and name H ))
3.300 1.400 1.400 peak 1755 spectrum 1 weight 0.10000E+01 volume 0.12771E-02 ppm1 1.378 ppm2 7.800 CV 1
ASSI { 1756}
( segid " " and resid 3 and name HD2%)
(( segid " " and resid 3 and name HG ))
2.100 0.600 0.600 peak 1756 spectrum 1 weight 0.10000E+01 volume 0.13504E-01 ppm1 0.841 ppm2 1.580 CV 1
ASSI { 1757}
( segid " " and resid 23 and name HD1%)
( segid " " and resid 23 and name HD2%)
2.600 0.900 0.900 peak 1757 spectrum 1 weight 0.10000E+01 volume 0.45586E-02 ppm1 0.485 ppm2 0.232 CV 1
ASSI { 1758}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 23 and name HA ))
4.800 2.900 1.200 peak 1758 spectrum 1 weight 0.10000E+01 volume 0.11938E-02 ppm1 0.488 ppm2 3.644 CV 1
ASSI { 1759}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 20 and name HA ))
2.200 0.600 0.600 peak 1759 spectrum 1 weight 0.10000E+01 volume 0.16213E-02 ppm1 0.484 ppm2 4.166 CV 1
ASSI { 1760}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 23 and name H ))
4.700 2.800 1.300 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.11216E-02 ppm1 0.491 ppm2 7.785 CV 1
ASSI { 1762}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 23 and name HB3 ))
2.600 0.800 0.800 peak 1762 spectrum 1 weight 0.10000E+01 volume 0.31038E-02 ppm1 0.229 ppm2 0.835 CV 1
ASSI { 1763}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 23 and name HA ))
3.700 1.700 1.700 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.22987E-02 ppm1 0.228 ppm2 3.648 CV 1
ASSI { 1764}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 23 and name H ))
3.500 1.500 1.500 peak 1764 spectrum 1 weight 0.10000E+01 volume 0.77180E-03 ppm1 0.221 ppm2 7.778 CV 1
ASSI { 1765}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG ))
2.500 0.800 0.800 peak 1765 spectrum 1 weight 0.10000E+01 volume 0.36868E-02 ppm1 3.984 ppm2 1.412 CV 1
ASSI { 1766}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB3 ))
2.400 0.700 0.700 peak 1766 spectrum 1 weight 0.10000E+01 volume 0.68907E-02 ppm1 3.984 ppm2 1.567 CV 1
OR { 1766}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 1769}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name H ))
2.800 1.000 1.000 peak 1769 spectrum 1 weight 0.10000E+01 volume 0.42976E-02 ppm1 1.564 ppm2 7.236 CV 1
OR { 1769}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name H ))
ASSI { 1770}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HA ))
3.300 1.300 1.300 peak 1770 spectrum 1 weight 0.10000E+01 volume 0.65853E-02 ppm1 0.743 ppm2 3.983 CV 1
ASSI { 1771}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HA ))
3.200 1.200 1.200 peak 1771 spectrum 1 weight 0.10000E+01 volume 0.32593E-02 ppm1 0.655 ppm2 3.981 CV 1
ASSI { 1772}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 23 and name H ))
4.500 2.500 1.500 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.12271E-02 ppm1 0.654 ppm2 7.792 CV 1
ASSI { 1773}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 23 and name HA ))
4.200 2.200 1.800 peak 1773 spectrum 1 weight 0.10000E+01 volume 0.17213E-02 ppm1 0.655 ppm2 3.647 CV 1
ASSI { 1774}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HB3 ))
2.200 0.600 0.600 peak 1774 spectrum 1 weight 0.10000E+01 volume 0.98334E-02 ppm1 0.654 ppm2 1.569 CV 1
OR { 1774}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HB2 ))
ASSI { 1775}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HG ))
2.300 0.600 0.600 peak 1775 spectrum 1 weight 0.10000E+01 volume 0.86508E-02 ppm1 0.654 ppm2 1.422 CV 1
ASSI { 1776}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG2 ))
3.600 1.700 1.700 peak 1776 spectrum 1 weight 0.10000E+01 volume 0.25764E-02 ppm1 3.789 ppm2 1.428 CV 1
ASSI { 1777}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG3 ))
2.800 1.000 1.000 peak 1777 spectrum 1 weight 0.10000E+01 volume 0.28539E-02 ppm1 3.787 ppm2 1.296 CV 1
ASSI { 1778}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
2.200 0.600 0.600 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.93948E-02 ppm1 3.787 ppm2 1.671 CV 1
OR { 1778}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 1780}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 20 and name HB3 ))
3.800 1.900 1.900 peak 1780 spectrum 1 weight 0.10000E+01 volume 0.65519E-03 ppm1 3.790 ppm2 2.614 CV 1
OR { 1780}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 1781}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HE3 ))
4.700 2.800 1.300 peak 1781 spectrum 1 weight 0.10000E+01 volume 0.72737E-03 ppm1 3.789 ppm2 2.925 CV 1
OR { 1781}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HE2 ))
ASSI { 1789}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 22 and name H ))
5.000 3.100 1.000 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.55525E-03 ppm1 1.422 ppm2 7.229 CV 1
ASSI { 1790}
(( segid " " and resid 21 and name HG3 ))
(( segid " " and resid 22 and name H ))
2.900 1.100 1.100 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.79956E-03 ppm1 1.293 ppm2 7.235 CV 1
ASSI { 1796}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name H ))
3.100 1.200 1.200 peak 1796 spectrum 1 weight 0.10000E+01 volume 0.99389E-03 ppm1 4.176 ppm2 8.879 CV 1
ASSI { 1801}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 19 and name HA ))
3.400 1.500 1.500 peak 1801 spectrum 1 weight 0.10000E+01 volume 0.14381E-02 ppm1 2.609 ppm2 4.364 CV 1
OR { 1801}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 19 and name HA ))
ASSI { 1803}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 22 and name HB2 ))
4.000 2.000 2.000 peak 1803 spectrum 1 weight 0.10000E+01 volume 0.94392E-03 ppm1 4.356 ppm2 1.573 CV 1
OR { 1803}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 1806}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB2 ))
2.500 0.800 0.800 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.46529E-02 ppm1 4.359 ppm2 4.155 CV 1
ASSI { 1809}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HB3 ))
1.800 0.400 0.400 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.12238E-01 ppm1 4.152 ppm2 3.843 CV 1
ASSI { 1812}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name H ))
3.100 1.200 1.200 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.14770E-02 ppm1 4.149 ppm2 8.156 CV 1
ASSI { 1813}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name H ))
2.800 1.000 1.000 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.17880E-02 ppm1 3.844 ppm2 8.148 CV 1
ASSI { 1814}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 20 and name H ))
4.400 2.400 1.600 peak 1814 spectrum 1 weight 0.10000E+01 volume 0.11716E-02 ppm1 4.149 ppm2 8.879 CV 1
ASSI { 1816}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HA ))
3.000 1.100 1.100 peak 1816 spectrum 1 weight 0.10000E+01 volume 0.36979E-02 ppm1 3.845 ppm2 4.358 CV 1
ASSI { 1817}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 18 and name HD2%)
2.400 0.700 0.700 peak 1817 spectrum 1 weight 0.10000E+01 volume 0.58191E-02 ppm1 4.436 ppm2 0.716 CV 1
OR { 1817}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 18 and name HD1%)
ASSI { 1819}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB2 ))
3.100 1.200 1.200 peak 1819 spectrum 1 weight 0.10000E+01 volume 0.11105E-02 ppm1 4.437 ppm2 1.484 CV 1
ASSI { 1824}
(( segid " " and resid 18 and name HG ))
( segid " " and resid 18 and name HD1%)
2.100 0.600 0.600 peak 1824 spectrum 1 weight 0.10000E+01 volume 0.88618E-02 ppm1 1.756 ppm2 0.708 CV 1
OR { 1824}
(( segid " " and resid 18 and name HG ))
( segid " " and resid 18 and name HD2%)
ASSI { 1825}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 18 and name HB3 ))
3.100 1.200 1.200 peak 1825 spectrum 1 weight 0.10000E+01 volume 0.20099E-02 ppm1 1.756 ppm2 1.259 CV 1
ASSI { 1826}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 18 and name HA ))
2.900 1.100 1.100 peak 1826 spectrum 1 weight 0.10000E+01 volume 0.19711E-02 ppm1 1.755 ppm2 4.448 CV 1
ASSI { 1827}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 18 and name H ))
3.400 1.400 1.400 peak 1827 spectrum 1 weight 0.10000E+01 volume 0.21488E-02 ppm1 1.757 ppm2 8.444 CV 1
ASSI { 1828}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HA ))
3.900 1.900 1.900 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.28429E-02 ppm1 0.691 ppm2 4.455 CV 1
ASSI { 1830}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name H ))
3.900 1.900 1.900 peak 1830 spectrum 1 weight 0.10000E+01 volume 0.16269E-02 ppm1 0.692 ppm2 8.439 CV 1
ASSI { 1831}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 18 and name HG ))
2.200 0.600 0.600 peak 1831 spectrum 1 weight 0.10000E+01 volume 0.82010E-02 ppm1 0.723 ppm2 1.756 CV 1
ASSI { 1832}
( segid " " and resid 18 and name HD2%)
( segid " " and resid 14 and name HE% )
1.900 0.400 0.400 peak 1832 spectrum 1 weight 0.10000E+01 volume 0.41366E-02 ppm1 0.721 ppm2 6.678 CV 1
ASSI { 1833}
( segid " " and resid 18 and name HD2%)
( segid " " and resid 14 and name HD% )
1.900 0.500 0.500 peak 1833 spectrum 1 weight 0.10000E+01 volume 0.31205E-02 ppm1 0.722 ppm2 7.031 CV 1
ASSI { 1834}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 19 and name H ))
2.600 0.800 0.800 peak 1834 spectrum 1 weight 0.10000E+01 volume 0.14881E-02 ppm1 0.724 ppm2 8.147 CV 1
ASSI { 1835}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 18 and name H ))
3.800 1.800 1.800 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.16769E-02 ppm1 0.722 ppm2 8.445 CV 1
ASSI { 1836}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB3 ))
2.600 0.800 0.800 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.30706E-02 ppm1 4.479 ppm2 1.743 CV 1
ASSI { 1837}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HG2 ))
3.800 1.800 1.800 peak 1837 spectrum 1 weight 0.10000E+01 volume 0.12549E-02 ppm1 4.476 ppm2 1.860 CV 1
ASSI { 1838}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HG3 ))
3.900 1.900 1.900 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.14770E-02 ppm1 4.479 ppm2 2.047 CV 1
ASSI { 1840}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HD3 ))
3.500 1.500 1.500 peak 1840 spectrum 1 weight 0.10000E+01 volume 0.10050E-02 ppm1 4.478 ppm2 3.668 CV 1
ASSI { 1841}
(( segid " " and resid 17 and name HD3 ))
(( segid " " and resid 16 and name HG2 ))
3.500 1.500 1.500 peak 1841 spectrum 1 weight 0.10000E+01 volume 0.19656E-02 ppm1 3.670 ppm2 1.230 CV 1
OR { 1841}
(( segid " " and resid 17 and name HD3 ))
(( segid " " and resid 16 and name HB3 ))
OR { 1841}
(( segid " " and resid 17 and name HD3 ))
(( segid " " and resid 16 and name HG3 ))
ASSI { 1842}
(( segid " " and resid 17 and name HD2 ))
(( segid " " and resid 16 and name HG2 ))
2.200 0.600 0.600 peak 1842 spectrum 1 weight 0.10000E+01 volume 0.25819E-02 ppm1 3.521 ppm2 1.227 CV 1
OR { 1842}
(( segid " " and resid 17 and name HD2 ))
(( segid " " and resid 16 and name HG3 ))
OR { 1842}
(( segid " " and resid 17 and name HD2 ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 1844}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 4 and name HB3 ))
3.000 1.100 1.100 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.47863E-02 ppm1 3.544 ppm2 2.259 CV 1
ASSI { 1845}
(( segid " " and resid 5 and name HD3 ))
(( segid " " and resid 5 and name HD2 ))
1.400 0.200 0.800 peak 1845 spectrum 1 weight 0.10000E+01 volume 0.29466E-01 ppm1 3.541 ppm2 3.689 CV 1
ASSI { 1847}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 4 and name HA ))
2.200 0.600 0.600 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.17252E-01 ppm1 3.546 ppm2 4.553 CV 1
ASSI { 1850}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HA ))
2.800 0.900 0.900 peak 1850 spectrum 1 weight 0.10000E+01 volume 0.32538E-02 ppm1 2.196 ppm2 4.489 CV 1
ASSI { 1851}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HD2 ))
2.900 1.000 1.000 peak 1851 spectrum 1 weight 0.10000E+01 volume 0.39368E-02 ppm1 2.198 ppm2 3.679 CV 1
ASSI { 1852}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HD3 ))
2.800 0.900 0.900 peak 1852 spectrum 1 weight 0.10000E+01 volume 0.22154E-02 ppm1 1.752 ppm2 3.672 CV 1
ASSI { 1853}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HD3 ))
3.400 1.400 1.400 peak 1853 spectrum 1 weight 0.10000E+01 volume 0.32760E-02 ppm1 2.198 ppm2 3.531 CV 1
ASSI { 1854}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 5 and name HD2 ))
3.300 1.400 1.400 peak 1854 spectrum 1 weight 0.10000E+01 volume 0.25707E-02 ppm1 1.847 ppm2 3.683 CV 1
ASSI { 1855}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 5 and name HD3 ))
3.100 1.200 1.200 peak 1855 spectrum 1 weight 0.10000E+01 volume 0.27819E-02 ppm1 1.852 ppm2 3.540 CV 1
ASSI { 1856}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HG3 ))
2.200 0.600 0.600 peak 1856 spectrum 1 weight 0.10000E+01 volume 0.52860E-02 ppm1 1.743 ppm2 2.038 CV 1
ASSI { 1857}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 5 and name HB2 ))
1.500 0.300 0.700 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.27874E-01 ppm1 1.849 ppm2 2.200 CV 1
ASSI { 1858}
(( segid " " and resid 17 and name HG3 ))
(( segid " " and resid 18 and name H ))
5.100 3.200 0.900 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.72737E-03 ppm1 2.048 ppm2 8.441 CV 1
ASSI { 1859}
(( segid " " and resid 17 and name HG3 ))
(( segid " " and resid 17 and name HD3 ))
2.200 0.600 0.600 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.39201E-02 ppm1 2.050 ppm2 3.665 CV 1
ASSI { 1860}
(( segid " " and resid 17 and name HG3 ))
(( segid " " and resid 17 and name HD2 ))
2.600 0.900 0.900 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.37478E-02 ppm1 2.048 ppm2 3.520 CV 1
ASSI { 1861}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 17 and name HG3 ))
1.700 0.400 0.500 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.10938E-01 ppm1 1.862 ppm2 2.042 CV 1
ASSI { 1864}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG2 ))
2.400 0.700 0.700 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.47195E-02 ppm1 4.303 ppm2 1.229 CV 1
OR { 1864}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB3 ))
OR { 1864}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG3 ))
ASSI { 1865}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB2 ))
2.500 0.800 0.800 peak 1865 spectrum 1 weight 0.10000E+01 volume 0.25375E-02 ppm1 4.306 ppm2 1.767 CV 1
ASSI { 1867}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 14 and name HE% )
4.000 2.000 2.000 peak 1867 spectrum 1 weight 0.10000E+01 volume 0.68296E-03 ppm1 1.228 ppm2 6.697 CV 1
ASSI { 1868}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HA ))
3.300 1.300 1.300 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.12382E-02 ppm1 1.221 ppm2 4.300 CV 1
ASSI { 1869}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HD3 ))
4.500 2.500 1.500 peak 1869 spectrum 1 weight 0.10000E+01 volume 0.89949E-03 ppm1 1.216 ppm2 3.674 CV 1
ASSI { 1870}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HD2 ))
4.100 2.100 1.900 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.10383E-02 ppm1 1.225 ppm2 3.526 CV 1
ASSI { 1871}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HE2 ))
5.100 3.300 0.900 peak 1871 spectrum 1 weight 0.10000E+01 volume 0.58301E-03 ppm1 1.778 ppm2 2.897 CV 1
OR { 1871}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HE3 ))
ASSI { 1872}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HE2 ))
4.600 2.600 1.400 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.69962E-03 ppm1 1.216 ppm2 2.899 CV 1
OR { 1872}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HE3 ))
ASSI { 1873}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HB2 ))
2.000 0.500 0.500 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.34870E-02 ppm1 1.223 ppm2 1.774 CV 1
ASSI { 1874}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HB3 ))
1.900 0.400 0.400 peak 1874 spectrum 1 weight 0.10000E+01 volume 0.87840E-02 ppm1 1.772 ppm2 1.225 CV 1
OR { 1874}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HG3 ))
OR { 1874}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HG2 ))
ASSI { 1875}
(( segid " " and resid 16 and name HG3 ))
( segid " " and resid 14 and name HE% )
4.100 2.100 1.900 peak 1875 spectrum 1 weight 0.10000E+01 volume 0.87730E-03 ppm1 1.234 ppm2 6.684 CV 1
OR { 1875}
(( segid " " and resid 16 and name HG2 ))
( segid " " and resid 14 and name HE% )
ASSI { 1876}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 17 and name HD3 ))
3.500 1.600 1.600 peak 1876 spectrum 1 weight 0.10000E+01 volume 0.16102E-02 ppm1 1.237 ppm2 3.664 CV 1
OR { 1876}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 17 and name HD3 ))
ASSI { 1877}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 17 and name HD2 ))
2.300 0.700 0.700 peak 1877 spectrum 1 weight 0.10000E+01 volume 0.18713E-02 ppm1 1.229 ppm2 3.520 CV 1
OR { 1877}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 17 and name HD2 ))
ASSI { 1878}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HE2 ))
2.600 0.800 0.800 peak 1878 spectrum 1 weight 0.10000E+01 volume 0.33925E-02 ppm1 1.232 ppm2 2.884 CV 1
OR { 1878}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HE3 ))
OR { 1878}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HE3 ))
OR { 1878}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HE2 ))
ASSI { 1879}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HB2 ))
2.300 0.600 0.600 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.54580E-02 ppm1 1.234 ppm2 1.771 CV 1
OR { 1879}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 1880}
(( segid " " and resid 15 and name HD2 ))
(( segid " " and resid 15 and name HA ))
3.700 1.700 1.700 peak 1880 spectrum 1 weight 0.10000E+01 volume 0.94392E-03 ppm1 2.798 ppm2 4.335 CV 1
ASSI { 1881}
(( segid " " and resid 15 and name HD3 ))
(( segid " " and resid 15 and name HA ))
4.500 2.600 1.500 peak 1881 spectrum 1 weight 0.10000E+01 volume 0.10494E-02 ppm1 2.834 ppm2 4.323 CV 1
ASSI { 1883}
(( segid " " and resid 15 and name HD2 ))
(( segid " " and resid 15 and name HB3 ))
3.600 1.600 1.600 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.20989E-02 ppm1 2.810 ppm2 1.841 CV 1
ASSI { 1884}
(( segid " " and resid 15 and name HD2 ))
(( segid " " and resid 15 and name HB2 ))
2.100 0.600 0.600 peak 1884 spectrum 1 weight 0.10000E+01 volume 0.49195E-02 ppm1 2.828 ppm2 1.435 CV 1
OR { 1884}
(( segid " " and resid 15 and name HD3 ))
(( segid " " and resid 15 and name HB2 ))
ASSI { 1885}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HB3 ))
1.800 0.400 0.400 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.58246E-02 ppm1 1.426 ppm2 1.842 CV 1
ASSI { 1887}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HA ))
2.500 0.800 0.800 peak 1887 spectrum 1 weight 0.10000E+01 volume 0.15269E-02 ppm1 1.428 ppm2 4.331 CV 1
ASSI { 1888}
(( segid " " and resid 15 and name HG2 ))
(( segid " " and resid 15 and name HA ))
3.900 1.900 1.900 peak 1888 spectrum 1 weight 0.10000E+01 volume 0.14214E-02 ppm1 1.475 ppm2 4.325 CV 1
ASSI { 1889}
(( segid " " and resid 15 and name HG2 ))
(( segid " " and resid 15 and name HB3 ))
2.400 0.700 0.700 peak 1889 spectrum 1 weight 0.10000E+01 volume 0.27208E-02 ppm1 1.472 ppm2 1.848 CV 1
ASSI { 1890}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 14 and name HD% )
3.200 1.300 1.300 peak 1890 spectrum 1 weight 0.10000E+01 volume 0.10161E-02 ppm1 4.525 ppm2 7.018 CV 1
ASSI { 1893}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB2 ))
2.900 1.100 1.100 peak 1893 spectrum 1 weight 0.10000E+01 volume 0.12826E-02 ppm1 4.354 ppm2 1.099 CV 1
ASSI { 1897}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name H ))
3.500 1.500 1.500 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.68296E-03 ppm1 1.929 ppm2 8.545 CV 1
ASSI { 1898}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HA ))
3.500 1.500 1.500 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.13159E-02 ppm1 1.920 ppm2 4.353 CV 1
ASSI { 1900}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HB3 ))
2.500 0.800 0.800 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.15103E-02 ppm1 1.130 ppm2 1.921 CV 1
ASSI { 1904}
(( segid " " and resid 13 and name HB2 ))
( segid " " and resid 13 and name HD2%)
4.500 2.500 1.500 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.10161E-02 ppm1 1.126 ppm2 0.566 CV 1
ASSI { 1905}
(( segid " " and resid 13 and name HB2 ))
( segid " " and resid 13 and name HD1%)
2.900 1.100 1.100 peak 1905 spectrum 1 weight 0.10000E+01 volume 0.15158E-02 ppm1 1.123 ppm2 0.885 CV 1
ASSI { 1907}
(( segid " " and resid 13 and name HG ))
(( segid " " and resid 13 and name HB2 ))
3.100 1.200 1.200 peak 1907 spectrum 1 weight 0.10000E+01 volume 0.12715E-02 ppm1 1.576 ppm2 1.128 CV 1
ASSI { 1909}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 13 and name HG ))
2.300 0.600 0.600 peak 1909 spectrum 1 weight 0.10000E+01 volume 0.64409E-02 ppm1 0.886 ppm2 1.572 CV 1
ASSI { 1910}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 13 and name HB3 ))
3.200 1.300 1.300 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.40144E-02 ppm1 0.883 ppm2 1.920 CV 1
ASSI { 1911}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 56 and name HD3 ))
2.100 0.600 0.600 peak 1911 spectrum 1 weight 0.10000E+01 volume 0.17157E-02 ppm1 0.886 ppm2 2.313 CV 1
ASSI { 1912}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 55 and name HB3 ))
2.300 0.700 0.700 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.11327E-02 ppm1 0.880 ppm2 2.707 CV 1
ASSI { 1913}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 55 and name HB2 ))
2.400 0.700 0.700 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.83843E-03 ppm1 0.883 ppm2 2.837 CV 1
ASSI { 1914}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 56 and name HD2 ))
2.000 0.500 0.500 peak 1914 spectrum 1 weight 0.10000E+01 volume 0.23488E-02 ppm1 0.885 ppm2 3.649 CV 1
ASSI { 1915}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 12 and name HA ))
2.300 0.700 0.700 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.11716E-02 ppm1 0.885 ppm2 4.480 CV 1
ASSI { 1916}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 13 and name HA ))
3.100 1.200 1.200 peak 1916 spectrum 1 weight 0.10000E+01 volume 0.59023E-02 ppm1 0.884 ppm2 4.353 CV 1
ASSI { 1918}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 13 and name H ))
4.000 2.000 2.000 peak 1918 spectrum 1 weight 0.10000E+01 volume 0.20321E-02 ppm1 0.882 ppm2 8.552 CV 1
ASSI { 1919}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 14 and name H ))
5.100 3.300 0.900 peak 1919 spectrum 1 weight 0.10000E+01 volume 0.61632E-03 ppm1 0.891 ppm2 8.915 CV 1
ASSI { 1920}
(( segid " " and resid 12 and name HG3 ))
(( segid " " and resid 13 and name H ))
3.000 1.100 1.100 peak 1920 spectrum 1 weight 0.10000E+01 volume 0.15602E-02 ppm1 2.256 ppm2 8.546 CV 1
OR { 1920}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 13 and name H ))
ASSI { 1921}
(( segid " " and resid 12 and name HG3 ))
( segid " " and resid 11 and name HG2%)
2.200 0.600 0.600 peak 1921 spectrum 1 weight 0.10000E+01 volume 0.14325E-02 ppm1 2.252 ppm2 1.097 CV 1
OR { 1921}
(( segid " " and resid 12 and name HG2 ))
( segid " " and resid 11 and name HG2%)
ASSI { 1923}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 13 and name H ))
4.400 2.400 1.600 peak 1923 spectrum 1 weight 0.10000E+01 volume 0.56635E-03 ppm1 1.898 ppm2 8.540 CV 1
ASSI { 1927}
( segid " " and resid 11 and name HG2%)
(( segid " " and resid 10 and name HA ))
2.200 0.600 0.600 peak 1927 spectrum 1 weight 0.10000E+01 volume 0.16047E-02 ppm1 1.088 ppm2 4.523 CV 1
ASSI { 1928}
( segid " " and resid 11 and name HG2%)
(( segid " " and resid 11 and name HB ))
2.200 0.600 0.600 peak 1928 spectrum 1 weight 0.10000E+01 volume 0.14997E-01 ppm1 1.087 ppm2 4.247 CV 1
ASSI { 1932}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HA ))
3.700 1.700 1.700 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.79956E-03 ppm1 2.740 ppm2 4.519 CV 1
ASSI { 1933}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HA ))
3.700 1.800 1.800 peak 1933 spectrum 1 weight 0.10000E+01 volume 0.72737E-03 ppm1 2.527 ppm2 4.511 CV 1
ASSI { 1935}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 8 and name HB% )
2.000 0.500 0.500 peak 1935 spectrum 1 weight 0.10000E+01 volume 0.13054E-01 ppm1 4.291 ppm2 1.302 CV 1
ASSI { 1937}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 8 and name H ))
2.200 0.600 0.600 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.14670E-01 ppm1 1.303 ppm2 8.245 CV 1
ASSI { 1938}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 7 and name HG2%)
2.100 0.600 0.600 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.11199E-01 ppm1 4.262 ppm2 1.147 CV 1
ASSI { 1939}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 7 and name HG2%)
3.800 1.800 1.800 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.13104E-02 ppm1 4.379 ppm2 1.149 CV 1
ASSI { 1940}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB3 ))
2.200 0.600 0.600 peak 1940 spectrum 1 weight 0.10000E+01 volume 0.10966E-01 ppm1 4.381 ppm2 3.825 CV 1
OR { 1940}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB2 ))
ASSI { 1942}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name H ))
2.500 0.800 0.800 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.39368E-02 ppm1 4.380 ppm2 8.355 CV 1
ASSI { 1943}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name H ))
3.200 1.300 1.300 peak 1943 spectrum 1 weight 0.10000E+01 volume 0.25764E-02 ppm1 3.841 ppm2 8.354 CV 1
ASSI { 1944}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name H ))
3.100 1.200 1.200 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.26041E-02 ppm1 3.811 ppm2 8.358 CV 1
ASSI { 1945}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HA ))
2.200 0.600 0.600 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.75293E-02 ppm1 3.840 ppm2 4.381 CV 1
ASSI { 1946}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HA ))
2.600 0.800 0.800 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.84398E-02 ppm1 3.810 ppm2 4.380 CV 1
ASSI { 1947}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HD2 ))
3.200 1.300 1.300 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.14936E-02 ppm1 4.375 ppm2 3.693 CV 1
ASSI { 1948}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HD3 ))
3.300 1.400 1.400 peak 1948 spectrum 1 weight 0.10000E+01 volume 0.17990E-02 ppm1 4.374 ppm2 3.538 CV 1
ASSI { 1949}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB2 ))
2.300 0.700 0.700 peak 1949 spectrum 1 weight 0.10000E+01 volume 0.11982E-01 ppm1 4.375 ppm2 2.200 CV 1
ASSI { 1950}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB3 ))
2.200 0.600 0.600 peak 1950 spectrum 1 weight 0.10000E+01 volume 0.83399E-02 ppm1 4.376 ppm2 1.861 CV 1
ASSI { 1951}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 4 and name HD3 ))
1.500 0.300 0.700 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.22660E-01 ppm1 3.550 ppm2 3.834 CV 1
ASSI { 1952}
(( segid " " and resid 4 and name HD2 ))
( segid " " and resid 3 and name HD2%)
3.700 1.700 1.700 peak 1952 spectrum 1 weight 0.10000E+01 volume 0.60023E-02 ppm1 3.549 ppm2 0.842 CV 1
ASSI { 1954}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HA ))
3.300 1.300 1.300 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.26874E-02 ppm1 1.997 ppm2 4.555 CV 1
ASSI { 1955}
(( segid " " and resid 4 and name HG3 ))
(( segid " " and resid 4 and name HA ))
2.400 0.700 0.700 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.41921E-02 ppm1 1.937 ppm2 4.560 CV 1
ASSI { 1956}
(( segid " " and resid 5 and name HG3 ))
(( segid " " and resid 5 and name HA ))
3.400 1.500 1.500 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.36646E-02 ppm1 1.921 ppm2 4.374 CV 1
OR { 1956}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HA ))
ASSI { 1957}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HD2 ))
2.100 0.600 0.600 peak 1957 spectrum 1 weight 0.10000E+01 volume 0.85563E-02 ppm1 1.919 ppm2 3.692 CV 1
OR { 1957}
(( segid " " and resid 5 and name HG3 ))
(( segid " " and resid 5 and name HD2 ))
ASSI { 1958}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HB2 ))
2.100 0.600 0.600 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.95170E-02 ppm1 1.918 ppm2 2.204 CV 1
OR { 1958}
(( segid " " and resid 5 and name HG3 ))
(( segid " " and resid 5 and name HB2 ))
ASSI { 1959}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB2 ))
2.500 0.800 0.800 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.61021E-02 ppm1 4.573 ppm2 1.828 CV 1
ASSI { 1961}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB3 ))
1.800 0.400 0.400 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.10300E-01 ppm1 4.574 ppm2 2.267 CV 1
ASSI { 1963}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HD2 ))
2.300 0.600 0.600 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.14486E-01 ppm1 4.574 ppm2 3.690 CV 1
ASSI { 1965}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 4 and name HA ))
2.000 0.500 0.500 peak 1965 spectrum 1 weight 0.10000E+01 volume 0.83509E-02 ppm1 3.839 ppm2 4.539 CV 1
ASSI { 1967}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 4 and name HG3 ))
2.000 0.500 0.500 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.52693E-02 ppm1 3.839 ppm2 1.964 CV 1
ASSI { 1969}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 3 and name HB2 ))
2.500 0.800 0.800 peak 1969 spectrum 1 weight 0.10000E+01 volume 0.23654E-02 ppm1 3.842 ppm2 1.478 CV 1
OR { 1969}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 3 and name HB3 ))
ASSI { 1970}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 3 and name HB2 ))
2.500 0.800 0.800 peak 1970 spectrum 1 weight 0.10000E+01 volume 0.54637E-02 ppm1 3.549 ppm2 1.481 CV 1
OR { 1970}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 3 and name HB3 ))
ASSI { 1971}
(( segid " " and resid 4 and name HD3 ))
( segid " " and resid 3 and name HD2%)
4.000 2.000 2.000 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.34426E-02 ppm1 3.840 ppm2 0.843 CV 1
ASSI { 1975}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 4 and name HD3 ))
3.500 1.500 1.500 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.15658E-02 ppm1 2.271 ppm2 3.831 CV 1
ASSI { 1976}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HD3 ))
3.500 1.500 1.500 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.20543E-02 ppm1 1.823 ppm2 3.834 CV 1
ASSI { 1977}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 5 and name HD2 ))
3.400 1.500 1.500 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.25597E-02 ppm1 2.271 ppm2 3.688 CV 1
ASSI { 1978}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 5 and name HD2 ))
4.200 2.200 1.800 peak 1978 spectrum 1 weight 0.10000E+01 volume 0.18823E-02 ppm1 1.823 ppm2 3.685 CV 1
ASSI { 1980}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HD2 ))
2.600 0.800 0.800 peak 1980 spectrum 1 weight 0.10000E+01 volume 0.55635E-02 ppm1 1.823 ppm2 3.544 CV 1
ASSI { 1981}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HB3 ))
1.400 0.300 0.800 peak 1981 spectrum 1 weight 0.10000E+01 volume 0.25725E-01 ppm1 1.824 ppm2 2.268 CV 1
ASSI { 1983}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HB2 ))
2.000 0.500 0.500 peak 1983 spectrum 1 weight 0.10000E+01 volume 0.10672E-01 ppm1 1.990 ppm2 1.826 CV 1
ASSI { 1984}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HB3 ))
2.500 0.800 0.800 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.53359E-02 ppm1 1.994 ppm2 2.266 CV 1
ASSI { 1985}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HD2 ))
2.000 0.500 0.500 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.59911E-02 ppm1 1.991 ppm2 3.548 CV 1
ASSI { 1986}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HD3 ))
2.700 0.900 0.900 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.46419E-02 ppm1 1.994 ppm2 3.832 CV 1
ASSI { 1988}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 77 and name HD3 ))
2.800 1.000 1.000 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.13143E-01 ppm1 4.533 ppm2 3.742 CV 1
ASSI { 1991}
( segid " " and resid 3 and name HD2%)
(( segid " " and resid 3 and name HA ))
3.200 1.300 1.300 peak 1991 spectrum 1 weight 0.10000E+01 volume 0.62799E-02 ppm1 0.841 ppm2 4.536 CV 1
ASSI { 1992}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB3 ))
2.200 0.600 0.600 peak 1992 spectrum 1 weight 0.10000E+01 volume 0.11755E-01 ppm1 4.355 ppm2 1.468 CV 1
OR { 1992}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB2 ))
OR { 1992}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HG ))
ASSI { 1993}
(( segid " " and resid 2 and name HB3 ))
(( segid " " and resid 2 and name HA ))
2.300 0.600 0.600 peak 1993 spectrum 1 weight 0.10000E+01 volume 0.75514E-02 ppm1 1.469 ppm2 4.355 CV 1
OR { 1993}
(( segid " " and resid 2 and name HB2 ))
(( segid " " and resid 2 and name HA ))
ASSI { 1994}
(( segid " " and resid 2 and name HG ))
(( segid " " and resid 2 and name HA ))
3.300 1.400 1.400 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.28983E-02 ppm1 1.462 ppm2 4.356 CV 1
ASSI { 1995}
( segid " " and resid 2 and name HD2%)
(( segid " " and resid 2 and name HA ))
3.400 1.400 1.400 peak 1995 spectrum 1 weight 0.10000E+01 volume 0.41587E-02 ppm1 0.825 ppm2 4.353 CV 1
ASSI { 1998}
( segid " " and resid 2 and name HD1%)
(( segid " " and resid 2 and name HG ))
1.900 0.500 0.500 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.30555E-01 ppm1 0.777 ppm2 1.469 CV 1
OR { 1998}
( segid " " and resid 2 and name HD1%)
(( segid " " and resid 2 and name HB3 ))
OR { 1998}
( segid " " and resid 2 and name HD1%)
(( segid " " and resid 2 and name HB2 ))
ASSI { 2002}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 48 and name HB% )
4.000 2.000 2.000 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.11771E-02 ppm1 1.893 ppm2 1.418 CV 1
ASSI { 2004}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 45 and name HD1%)
4.000 2.000 2.000 peak 2004 spectrum 1 weight 0.10000E+01 volume 0.26764E-02 ppm1 4.551 ppm2 0.587 CV 1
OR { 2004}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 45 and name HD2%)
ASSI { 2005}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HD1 ))
4.700 2.800 1.300 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.47751E-03 ppm1 3.132 ppm2 6.837 CV 1
ASSI { 2006}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HD2 ))
3.200 1.300 1.300 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.16769E-02 ppm1 4.588 ppm2 7.121 CV 1
ASSI { 2008}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HD2 ))
4.200 2.300 1.800 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.97168E-03 ppm1 3.164 ppm2 7.075 CV 1
ASSI { 2009}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HD2 ))
3.300 1.400 1.400 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.94948E-03 ppm1 3.080 ppm2 7.074 CV 1
ASSI { 2010}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HB2 ))
3.400 1.400 1.400 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.25707E-02 ppm1 7.104 ppm2 3.106 CV 1
ASSI { 2011}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HA ))
4.400 2.400 1.600 peak 2011 spectrum 1 weight 0.10000E+01 volume 0.10328E-02 ppm1 7.104 ppm2 4.620 CV 1
ASSI { 2013}
(( segid " " and resid 64 and name HE3 ))
(( segid " " and resid 64 and name HA ))
4.600 2.700 1.400 peak 2013 spectrum 1 weight 0.10000E+01 volume 0.68850E-03 ppm1 6.993 ppm2 4.282 CV 1
ASSI { 2014}
(( segid " " and resid 64 and name HE3 ))
(( segid " " and resid 64 and name HB3 ))
4.900 3.000 1.100 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.85508E-03 ppm1 6.993 ppm2 3.036 CV 1
ASSI { 2015}
( segid " " and resid 65 and name HD% )
(( segid " " and resid 65 and name HB3 ))
3.000 1.100 1.100 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.18768E-02 ppm1 7.168 ppm2 3.001 CV 1
ASSI { 2016}
( segid " " and resid 65 and name HD% )
(( segid " " and resid 65 and name HB2 ))
3.000 1.100 1.100 peak 2016 spectrum 1 weight 0.10000E+01 volume 0.24208E-02 ppm1 7.167 ppm2 3.137 CV 1
ASSI { 2020}
(( segid " " and resid 55 and name HE1 ))
(( segid " " and resid 57 and name HA ))
2.500 0.800 0.800 peak 2020 spectrum 1 weight 0.10000E+01 volume 0.66631E-03 ppm1 7.771 ppm2 4.498 CV 1
ASSI { 2021}
(( segid " " and resid 55 and name HE1 ))
(( segid " " and resid 57 and name HG3 ))
1.800 0.400 0.400 peak 2021 spectrum 1 weight 0.10000E+01 volume 0.47030E-02 ppm1 7.761 ppm2 2.390 CV 1
OR { 2021}
(( segid " " and resid 55 and name HE1 ))
(( segid " " and resid 57 and name HB2 ))
OR { 2021}
(( segid " " and resid 55 and name HE1 ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 2022}
(( segid " " and resid 55 and name HE1 ))
(( segid " " and resid 57 and name HB3 ))
2.100 0.500 0.500 peak 2022 spectrum 1 weight 0.10000E+01 volume 0.19822E-02 ppm1 7.764 ppm2 1.954 CV 1
ASSI { 2025}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 65 and name H ))
4.500 2.500 1.500 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.48307E-03 ppm1 4.118 ppm2 8.133 CV 1
ASSI { 2027}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 70 and name HB2 ))
3.600 1.700 1.700 peak 2027 spectrum 1 weight 0.10000E+01 volume 0.10883E-02 ppm1 4.443 ppm2 1.715 CV 1
ASSI { 2028}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 65 and name HA ))
2.300 0.700 0.700 peak 2028 spectrum 1 weight 0.10000E+01 volume 0.10494E-02 ppm1 1.859 ppm2 4.143 CV 1
ASSI { 2029}
(( segid " " and resid 68 and name HB3 ))
(( segid " " and resid 65 and name HA ))
2.500 0.800 0.800 peak 2029 spectrum 1 weight 0.10000E+01 volume 0.71072E-03 ppm1 1.673 ppm2 4.146 CV 1
ASSI { 2030}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 64 and name HA ))
2.300 0.700 0.700 peak 2030 spectrum 1 weight 0.10000E+01 volume 0.11438E-02 ppm1 3.166 ppm2 4.279 CV 1
ASSI { 2031}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 65 and name HB2 ))
4.200 2.200 1.800 peak 2031 spectrum 1 weight 0.10000E+01 volume 0.56635E-03 ppm1 4.105 ppm2 3.142 CV 1
ASSI { 2032}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 64 and name HB2 ))
4.200 2.200 1.800 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.79956E-03 ppm1 3.986 ppm2 3.125 CV 1
ASSI { 2034}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 61 and name HA ))
2.600 0.800 0.800 peak 2034 spectrum 1 weight 0.10000E+01 volume 0.54414E-03 ppm1 3.009 ppm2 4.008 CV 1
ASSI { 2036}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 77 and name HD2 ))
4.100 2.100 1.900 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.13548E-02 ppm1 0.798 ppm2 3.498 CV 1
ASSI { 2037}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name HA ))
3.200 1.300 1.300 peak 2037 spectrum 1 weight 0.10000E+01 volume 0.65075E-02 ppm1 0.786 ppm2 4.413 CV 1
ASSI { 2038}
(( segid " " and resid 24 and name HD2 ))
(( segid " " and resid 21 and name HA ))
2.200 0.600 0.600 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.14714E-02 ppm1 3.150 ppm2 3.784 CV 1
ASSI { 2039}
(( segid " " and resid 24 and name HD3 ))
(( segid " " and resid 21 and name HA ))
2.200 0.600 0.600 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.14159E-02 ppm1 3.089 ppm2 3.783 CV 1
ASSI { 2041}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 20 and name HB3 ))
2.600 0.800 0.800 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.56635E-03 ppm1 1.427 ppm2 2.602 CV 1
OR { 2041}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 2042}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 77 and name HG2 ))
3.700 1.700 1.700 peak 2042 spectrum 1 weight 0.10000E+01 volume 0.27041E-02 ppm1 4.531 ppm2 1.872 CV 1
OR { 2042}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 77 and name HG3 ))
ASSI { 2043}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 22 and name H ))
3.400 1.400 1.400 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.18379E-02 ppm1 1.415 ppm2 7.234 CV 1
ASSI { 2044}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 23 and name H ))
4.500 2.500 1.500 peak 2044 spectrum 1 weight 0.10000E+01 volume 0.88840E-03 ppm1 1.422 ppm2 7.801 CV 1
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