NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
274274 |
2k9d   |
cing | 1-original | 1 | XPLOR/CNS | peak |
ASSI { 1} ((( segid " " and resid 497 and name HN )) ((( segid " " and resid 497 and name HB3 )) 2.600 0.900 0.900 peak 1 spectrum 1 weight 0.11000E+01 volume 0.31123E-02 ppm1 8.413 ppm2 3.393 CV 1
ASSI { 1} ((( segid " " and resid 488 and name HN )) ((( segid " " and resid 488 and name HA )) 3.100 1.200 1.200 peak 1 spectrum 1 weight 0.11000E+01 volume 0.12413E-02 ppm1 7.488 ppm2 4.109 CV 1
ASSI { 2} ((( segid " " and resid 489 and name HN )) ((( segid " " and resid 488 and name HA )) 2.900 1.000 1.000 peak 2 spectrum 1 weight 0.11000E+01 volume 0.21285E-02 ppm1 9.165 ppm2 4.102 CV 1
ASSI { 6} ((( segid " " and resid 499 and name HN )) ((( segid " " and resid 498 and name HA )) 3.500 1.500 1.500 peak 6 spectrum 1 weight 0.11000E+01 volume 0.10840E-02 ppm1 8.031 ppm2 4.200 CV 1
ASSI { 7} ((( segid " " and resid 499 and name HN )) ((( segid " " and resid 499 and name HA )) 3.100 1.200 1.200 peak 7 spectrum 1 weight 0.11000E+01 volume 0.10723E-02 ppm1 8.030 ppm2 3.933 CV 1
ASSI { 11} ((( segid " " and resid 496 and name HN )) ((( segid " " and resid 497 and name HN )) 3.300 1.400 1.400 peak 11 spectrum 1 weight 0.11000E+01 volume 0.76971E-03 ppm1 7.978 ppm2 8.416 CV 1
ASSI { 12} ((( segid " " and resid 499 and name HN )) ((( segid " " and resid 500 and name HN )) 2.700 0.900 0.900 peak 12 spectrum 1 weight 0.11000E+01 volume 0.21502E-02 ppm1 8.037 ppm2 7.882 CV 1
ASSI { 14} ((( segid " " and resid 500 and name HN )) ((( segid " " and resid 499 and name HA )) 3.400 1.500 1.500 peak 14 spectrum 1 weight 0.11000E+01 volume 0.77479E-03 ppm1 7.886 ppm2 3.934 CV 1
ASSI { 16} ((( segid " " and resid 501 and name HN )) ((( segid " " and resid 500 and name HN )) 2.800 1.000 1.000 peak 16 spectrum 1 weight 0.11000E+01 volume 0.23525E-02 ppm1 8.584 ppm2 7.882 CV 1
ASSI { 17} ((( segid " " and resid 501 and name HN )) ((( segid " " and resid 498 and name HA )) 3.200 1.300 1.300 peak 17 spectrum 1 weight 0.11000E+01 volume 0.98927E-03 ppm1 8.581 ppm2 4.209 CV 1
ASSI { 19} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 501 and name HN )) 2.700 0.900 0.900 peak 19 spectrum 1 weight 0.11000E+01 volume 0.23568E-02 ppm1 8.228 ppm2 8.593 CV 1
ASSI { 20} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 503 and name HN )) 2.900 1.100 1.100 peak 20 spectrum 1 weight 0.11000E+01 volume 0.15501E-02 ppm1 8.235 ppm2 7.369 CV 1
ASSI { 22} ((( segid " " and resid 503 and name HN )) ((( segid " " and resid 504 and name HN )) 2.900 1.100 1.100 peak 22 spectrum 1 weight 0.11000E+01 volume 0.15033E-02 ppm1 7.370 ppm2 8.099 CV 1
ASSI { 25} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 504 and name HN )) 2.700 0.900 0.900 peak 25 spectrum 1 weight 0.11000E+01 volume 0.23010E-02 ppm1 8.454 ppm2 8.098 CV 1
ASSI { 26} ((( segid " " and resid 494 and name HN )) ((( segid " " and resid 495 and name HN )) 2.800 2.800 3.200 peak 26 spectrum 1 weight 0.11000E+01 volume 0.23445E-02 ppm1 8.337 ppm2 8.033 CV 1
ASSI { 28} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 485 and name HN )) 3.100 1.200 1.200 peak 28 spectrum 1 weight 0.11000E+01 volume 0.11651E-02 ppm1 7.647 ppm2 7.938 CV 1
ASSI { 30} ((( segid " " and resid 490 and name HN )) ((( segid " " and resid 489 and name HN )) 3.000 1.200 1.200 peak 30 spectrum 1 weight 0.11000E+01 volume 0.17828E-02 ppm1 8.417 ppm2 9.161 CV 1
ASSI { 32} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 487 and name HN )) 2.400 0.700 0.700 peak 32 spectrum 1 weight 0.11000E+01 volume 0.50085E-02 ppm1 7.648 ppm2 7.407 CV 1
ASSI { 34} ((( segid " " and resid 488 and name HN )) ((( segid " " and resid 487 and name HN )) 2.100 0.500 0.500 peak 34 spectrum 1 weight 0.11000E+01 volume 0.99523E-02 ppm1 7.491 ppm2 7.406 CV 1
ASSI { 37} ((( segid " " and resid 484 and name HN )) ((( segid " " and resid 485 and name HN )) 2.200 0.600 0.600 peak 37 spectrum 1 weight 0.11000E+01 volume 0.83990E-02 ppm1 7.729 ppm2 7.954 CV 1
ASSI { 38} ((( segid " " and resid 483 and name HN )) ((( segid " " and resid 484 and name HN )) 2.300 0.600 0.600 peak 38 spectrum 1 weight 0.11000E+01 volume 0.71238E-02 ppm1 7.975 ppm2 7.731 CV 1
ASSI { 41} ((( segid " " and resid 483 and name HN )) ((( segid " " and resid 482 and name HN )) 2.200 0.600 0.600 peak 41 spectrum 1 weight 0.11000E+01 volume 0.85414E-02 ppm1 7.976 ppm2 8.609 CV 1
ASSI { 43} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 478 and name HN )) 2.300 0.600 0.600 peak 43 spectrum 1 weight 0.11000E+01 volume 0.68015E-02 ppm1 8.139 ppm2 8.362 CV 1
ASSI { 44} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 480 and name HN )) 2.300 0.600 0.600 peak 44 spectrum 1 weight 0.11000E+01 volume 0.71442E-02 ppm1 8.138 ppm2 7.929 CV 1
ASSI { 46} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 480 and name HN )) 2.400 0.700 0.700 peak 46 spectrum 1 weight 0.11000E+01 volume 0.58166E-02 ppm1 8.592 ppm2 7.926 CV 1
ASSI { 48} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 477 and name HN )) 2.200 0.600 0.600 peak 48 spectrum 1 weight 0.11000E+01 volume 0.77981E-02 ppm1 8.366 ppm2 7.384 CV 1
ASSI { 51} ((( segid " " and resid 476 and name HN )) ((( segid " " and resid 477 and name HN )) 2.400 0.700 0.700 peak 51 spectrum 1 weight 0.11000E+01 volume 0.51412E-02 ppm1 9.116 ppm2 7.385 CV 1
ASSI { 52} ((( segid " " and resid 476 and name HN )) ((( segid " " and resid 476 and name HA )) 2.400 0.700 0.700 peak 52 spectrum 1 weight 0.11000E+01 volume 0.67386E-02 ppm1 9.115 ppm2 4.452 CV 1
ASSI { 53} ((( segid " " and resid 475 and name HN )) ((( segid " " and resid 475 and name HA )) 2.000 2.000 4.000 peak 53 spectrum 1 weight 0.11000E+01 volume 0.19282E-01 ppm1 9.127 ppm2 4.297 CV 1
ASSI { 54} ((( segid " " and resid 489 and name HN )) ((( segid " " and resid 489 and name HA )) 2.900 1.100 1.100 peak 54 spectrum 1 weight 0.11000E+01 volume 0.19463E-02 ppm1 9.163 ppm2 4.582 CV 1
ASSI { 55} ((( segid " " and resid 476 and name HN )) ((( segid " " and resid 476 and name HB2 )) 2.700 0.900 0.900 peak 55 spectrum 1 weight 0.11000E+01 volume 0.39744E-02 ppm1 9.114 ppm2 2.757 CV 1
ASSI { 56} ((( segid " " and resid 473 and name HN )) ((( segid " " and resid 473 and name HA )) 2.700 0.900 0.900 peak 56 spectrum 1 weight 0.11000E+01 volume 0.31192E-02 ppm1 6.977 ppm2 3.954 CV 1
ASSI { 57} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 471 and name HN )) 2.400 0.700 0.700 peak 57 spectrum 1 weight 0.11000E+01 volume 0.60478E-02 ppm1 8.203 ppm2 7.542 CV 1
ASSI { 59} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 470 and name HN )) 2.400 0.700 0.700 peak 59 spectrum 1 weight 0.11000E+01 volume 0.56113E-02 ppm1 8.603 ppm2 8.201 CV 1
ASSI { 61} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 468 and name HN )) 2.300 0.700 0.700 peak 61 spectrum 1 weight 0.11000E+01 volume 0.62525E-02 ppm1 8.603 ppm2 8.052 CV 1
ASSI { 63} ((( segid " " and resid 468 and name HN )) ((( segid " " and resid 467 and name HN )) 2.300 0.700 0.700 peak 63 spectrum 1 weight 0.11000E+01 volume 0.72463E-02 ppm1 8.053 ppm2 8.274 CV 1
ASSI { 65} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 466 and name HN )) 2.300 0.600 0.600 peak 65 spectrum 1 weight 0.11000E+01 volume 0.71525E-02 ppm1 8.271 ppm2 7.860 CV 1
ASSI { 68} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 466 and name HN )) 2.300 0.600 0.600 peak 68 spectrum 1 weight 0.11000E+01 volume 0.75012E-02 ppm1 8.645 ppm2 7.860 CV 1
ASSI { 69} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 464 and name HN )) 2.300 0.600 0.600 peak 69 spectrum 1 weight 0.11000E+01 volume 0.67596E-02 ppm1 8.643 ppm2 8.233 CV 1
ASSI { 72} ((( segid " " and resid 464 and name HN )) ((( segid " " and resid 463 and name HN )) 2.400 0.700 0.700 peak 72 spectrum 1 weight 0.11000E+01 volume 0.62039E-02 ppm1 8.231 ppm2 7.607 CV 1
ASSI { 73} ((( segid " " and resid 462 and name HN )) ((( segid " " and resid 462 and name HB2 )) 2.500 0.800 0.800 peak 73 spectrum 1 weight 0.11000E+01 volume 0.52191E-02 ppm1 8.474 ppm2 3.996 CV 1
ASSI { 74} ((( segid " " and resid 463 and name HN )) ((( segid " " and resid 462 and name HB3 )) 2.700 0.900 0.900 peak 74 spectrum 1 weight 0.11000E+01 volume 0.30174E-02 ppm1 7.604 ppm2 3.997 CV 1
ASSI { 75} ((( segid " " and resid 463 and name HN )) ((( segid " " and resid 463 and name HA )) 2.500 0.800 0.800 peak 75 spectrum 1 weight 0.11000E+01 volume 0.52613E-02 ppm1 7.604 ppm2 3.822 CV 1
ASSI { 76} ((( segid " " and resid 463 and name HN )) ((( segid " " and resid 463 and name HB )) 2.200 0.600 0.600 peak 76 spectrum 1 weight 0.11000E+01 volume 0.92052E-02 ppm1 7.604 ppm2 2.254 CV 1
ASSI { 79} ((( segid " " and resid 462 and name HN )) ((( segid " " and resid 462 and name HA )) 2.600 0.900 0.900 peak 79 spectrum 1 weight 0.11000E+01 volume 0.36146E-02 ppm1 8.473 ppm2 4.221 CV 1
ASSI { 80} ((( segid " " and resid 462 and name HN )) ((( segid " " and resid 463 and name HN )) 2.800 1.000 1.000 peak 80 spectrum 1 weight 0.11000E+01 volume 0.21235E-02 ppm1 8.475 ppm2 7.608 CV 1
ASSI { 81} ((( segid " " and resid 463 and name HN )) ((( segid " " and resid 462 and name HA )) 3.100 1.200 1.200 peak 81 spectrum 1 weight 0.11000E+01 volume 0.11691E-02 ppm1 7.603 ppm2 4.221 CV 1
ASSI { 82} ((( segid " " and resid 471 and name HN )) ((( segid " " and resid 471 and name HA )) 2.200 0.600 0.600 peak 82 spectrum 1 weight 0.11000E+01 volume 0.90159E-02 ppm1 7.539 ppm2 4.528 CV 1
ASSI { 83} ((( segid " " and resid 472 and name HN )) ((( segid " " and resid 471 and name HA )) 2.400 0.700 0.700 peak 83 spectrum 1 weight 0.11000E+01 volume 0.58629E-02 ppm1 9.248 ppm2 4.535 CV 1
ASSI { 84} ((( segid " " and resid 472 and name HN )) ((( segid " " and resid 472 and name HA )) 2.900 1.100 1.100 peak 84 spectrum 1 weight 0.11000E+01 volume 0.20657E-02 ppm1 9.243 ppm2 4.645 CV 1
ASSI { 85} ((( segid " " and resid 494 and name HN )) ((( segid " " and resid 493 and name HN )) 2.300 0.700 0.700 peak 85 spectrum 1 weight 0.11000E+01 volume 0.65372E-02 ppm1 8.337 ppm2 8.459 CV 1
ASSI { 87} ((( segid " " and resid 493 and name HN )) ((( segid " " and resid 492 and name HN )) 2.300 0.600 0.600 peak 87 spectrum 1 weight 0.11000E+01 volume 0.80939E-02 ppm1 8.455 ppm2 8.267 CV 1
ASSI { 89} ((( segid " " and resid 493 and name HN )) ((( segid " " and resid 493 and name HA )) 2.500 2.500 3.500 peak 89 spectrum 1 weight 0.11000E+01 volume 0.55113E-02 ppm1 8.456 ppm2 4.661 CV 1
ASSI { 91} ((( segid " " and resid 494 and name HN )) ((( segid " " and resid 494 and name HA )) 2.300 2.300 3.700 peak 91 spectrum 1 weight 0.11000E+01 volume 0.74151E-02 ppm1 8.338 ppm2 4.188 CV 1
ASSI { 92} ((( segid " " and resid 492 and name HN )) ((( segid " " and resid 492 and name HA )) 2.400 0.700 0.700 peak 92 spectrum 1 weight 0.11000E+01 volume 0.74499E-02 ppm1 8.272 ppm2 4.387 CV 1
ASSI { 93} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 467 and name HA )) 2.200 0.600 0.600 peak 93 spectrum 1 weight 0.11000E+01 volume 0.88747E-02 ppm1 8.269 ppm2 3.823 CV 1
ASSI { 94} ((( segid " " and resid 490 and name HN )) ((( segid " " and resid 490 and name HA1 )) 2.400 0.700 0.700 peak 94 spectrum 1 weight 0.11000E+01 volume 0.71872E-02 ppm1 8.411 ppm2 4.380 CV 1
ASSI { 95} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 502 and name HB )) 2.100 0.600 0.600 peak 95 spectrum 1 weight 0.11000E+01 volume 0.10903E-01 ppm1 8.235 ppm2 2.124 CV 1
ASSI { 96} ((( segid " " and resid 502 and name HN )) (( segid " " and resid 502 and name HG2%)) 2.100 0.600 0.600 peak 96 spectrum 1 weight 0.11000E+01 volume 0.17038E-01 ppm1 8.235 ppm2 0.964 CV 1
ASSI { 97} ((( segid " " and resid 474 and name HN )) ((( segid " " and resid 474 and name HA )) 2.000 2.000 4.000 peak 97 spectrum 1 weight 0.11000E+01 volume 0.18203E-01 ppm1 9.123 ppm2 3.948 CV 1
ASSI { 99} ((( segid " " and resid 474 and name HN )) ((( segid " " and resid 474 and name HB2 )) 2.300 0.700 0.700 peak 99 spectrum 1 weight 0.11000E+01 volume 0.93641E-02 ppm1 9.122 ppm2 2.102 CV 1
ASSI { 100} ((( segid " " and resid 466 and name HN )) ((( segid " " and resid 466 and name HA )) 2.400 0.700 0.700 peak 100 spectrum 1 weight 0.11000E+01 volume 0.58359E-02 ppm1 7.858 ppm2 4.333 CV 1
ASSI { 101} ((( segid " " and resid 466 and name HN )) ((( segid " " and resid 466 and name HB2 )) 2.200 0.600 0.600 peak 101 spectrum 1 weight 0.11000E+01 volume 0.11596E-01 ppm1 7.859 ppm2 4.168 CV 1
ASSI { 102} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 466 and name HB3 )) 2.500 0.800 0.800 peak 102 spectrum 1 weight 0.11000E+01 volume 0.62006E-02 ppm1 8.272 ppm2 4.164 CV 1
ASSI { 103} ((( segid " " and resid 464 and name HN )) ((( segid " " and resid 463 and name HB )) 2.300 0.700 0.700 peak 103 spectrum 1 weight 0.11000E+01 volume 0.49897E-02 ppm1 8.230 ppm2 2.254 CV 1
ASSI { 104} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 465 and name HA )) 2.500 0.800 0.800 peak 104 spectrum 1 weight 0.11000E+01 volume 0.47905E-02 ppm1 8.642 ppm2 3.807 CV 1
ASSI { 105} ((( segid " " and resid 466 and name HN )) ((( segid " " and resid 465 and name HA )) 2.700 0.900 0.900 peak 105 spectrum 1 weight 0.11000E+01 volume 0.35743E-02 ppm1 7.858 ppm2 3.814 CV 1
ASSI { 106} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 465 and name HB2 )) 2.100 0.500 0.500 peak 106 spectrum 1 weight 0.11000E+01 volume 0.12618E-01 ppm1 8.644 ppm2 1.987 CV 1
ASSI { 107} ((( segid " " and resid 466 and name HN )) ((( segid " " and resid 465 and name HB3 )) 2.400 0.700 0.700 peak 107 spectrum 1 weight 0.11000E+01 volume 0.51879E-02 ppm1 7.859 ppm2 1.988 CV 1
ASSI { 109} ((( segid " " and resid 492 and name HN )) ((( segid " " and resid 492 and name HB2 )) 2.900 1.100 1.100 peak 109 spectrum 1 weight 0.11000E+01 volume 0.16993E-02 ppm1 8.267 ppm2 2.710 CV 1
ASSI { 110} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 467 and name HG13)) 2.200 0.600 0.600 peak 110 spectrum 1 weight 0.11000E+01 volume 0.98618E-02 ppm1 8.271 ppm2 2.190 CV 1
ASSI { 111} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 467 and name HB )) 2.400 0.700 0.700 peak 111 spectrum 1 weight 0.11000E+01 volume 0.43340E-02 ppm1 8.271 ppm2 2.265 CV 1
ASSI { 113} ((( segid " " and resid 497 and name HN )) ((( segid " " and resid 497 and name HA )) 2.500 0.800 0.800 peak 113 spectrum 1 weight 0.11000E+01 volume 0.38782E-02 ppm1 8.410 ppm2 4.161 CV 1
ASSI { 116} ((( segid " " and resid 480 and name HN )) ((( segid " " and resid 480 and name HB2 )) 2.200 0.600 0.600 peak 116 spectrum 1 weight 0.11000E+01 volume 0.78748E-02 ppm1 7.928 ppm2 3.445 CV 1
ASSI { 120} ((( segid " " and resid 480 and name HN )) ((( segid " " and resid 480 and name HA )) 1.900 1.900 4.100 peak 120 spectrum 1 weight 0.11000E+01 volume 0.22614E-01 ppm1 7.933 ppm2 4.447 CV 1
ASSI { 125} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 466 and name HA )) 2.900 1.100 1.100 peak 125 spectrum 1 weight 0.11000E+01 volume 0.19660E-02 ppm1 8.610 ppm2 4.340 CV 1
ASSI { 126} ((( segid " " and resid 501 and name HN )) ((( segid " " and resid 501 and name HA )) 2.300 0.700 0.700 peak 126 spectrum 1 weight 0.11000E+01 volume 0.59451E-02 ppm1 8.584 ppm2 3.890 CV 1
ASSI { 127} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 495 and name HA )) 2.700 2.700 3.300 peak 127 spectrum 1 weight 0.11000E+01 volume 0.39079E-02 ppm1 8.955 ppm2 4.399 CV 1
ASSI { 128} ((( segid " " and resid 483 and name HN )) ((( segid " " and resid 483 and name HA )) 2.200 0.600 0.600 peak 128 spectrum 1 weight 0.11000E+01 volume 0.10674E-01 ppm1 7.975 ppm2 4.398 CV 1
ASSI { 129} ((( segid " " and resid 483 and name HN )) ((( segid " " and resid 483 and name HB )) 2.200 0.600 0.600 peak 129 spectrum 1 weight 0.11000E+01 volume 0.95396E-02 ppm1 7.975 ppm2 4.092 CV 1
ASSI { 130} ((( segid " " and resid 483 and name HN )) (( segid " " and resid 483 and name HG2%)) 2.800 2.800 3.200 peak 130 spectrum 1 weight 0.11000E+01 volume 0.56908E-02 ppm1 7.977 ppm2 1.360 CV 1
ASSI { 131} ((( segid " " and resid 484 and name HN )) ((( segid " " and resid 484 and name HA )) 2.300 0.600 0.600 peak 131 spectrum 1 weight 0.11000E+01 volume 0.85806E-02 ppm1 7.729 ppm2 4.036 CV 1
ASSI { 133} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 479 and name HA )) 2.300 0.600 0.600 peak 133 spectrum 1 weight 0.11000E+01 volume 0.80348E-02 ppm1 8.138 ppm2 4.067 CV 1
ASSI { 134} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 479 and name HB2 )) 1.900 0.500 0.500 peak 134 spectrum 1 weight 0.11000E+01 volume 0.14314E-01 ppm1 8.138 ppm2 2.055 CV 1
ASSI { 136} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 479 and name HG3 )) 2.600 0.800 0.800 peak 136 spectrum 1 weight 0.11000E+01 volume 0.39934E-02 ppm1 8.137 ppm2 1.721 CV 1
ASSI { 137} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 478 and name HA )) 2.400 0.700 0.700 peak 137 spectrum 1 weight 0.11000E+01 volume 0.58116E-02 ppm1 8.366 ppm2 3.762 CV 1
ASSI { 138} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 478 and name HA )) 2.600 0.900 0.900 peak 138 spectrum 1 weight 0.11000E+01 volume 0.39483E-02 ppm1 8.140 ppm2 3.758 CV 1
ASSI { 139} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 478 and name HB2 )) 2.300 0.700 0.700 peak 139 spectrum 1 weight 0.11000E+01 volume 0.64920E-02 ppm1 8.364 ppm2 2.118 CV 1
ASSI { 140} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 478 and name HB3 )) 2.600 0.800 0.800 peak 140 spectrum 1 weight 0.11000E+01 volume 0.52697E-02 ppm1 8.138 ppm2 2.140 CV 1
ASSI { 141} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 478 and name HD2 )) 3.000 1.100 1.100 peak 141 spectrum 1 weight 0.11000E+01 volume 0.36875E-02 ppm1 8.364 ppm2 1.705 CV 1
ASSI { 142} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 477 and name HA )) 2.700 0.900 0.900 peak 142 spectrum 1 weight 0.11000E+01 volume 0.26130E-02 ppm1 7.383 ppm2 4.372 CV 1
ASSI { 143} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 477 and name HA )) 3.000 1.100 1.100 peak 143 spectrum 1 weight 0.11000E+01 volume 0.18835E-02 ppm1 8.365 ppm2 4.371 CV 1
ASSI { 144} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 476 and name HA )) 3.100 1.200 1.200 peak 144 spectrum 1 weight 0.11000E+01 volume 0.14767E-02 ppm1 7.385 ppm2 4.452 CV 1
ASSI { 145} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 476 and name HB2 )) 3.100 1.200 1.200 peak 145 spectrum 1 weight 0.11000E+01 volume 0.14884E-02 ppm1 7.385 ppm2 2.754 CV 1
ASSI { 147} ((( segid " " and resid 484 and name HN )) (( segid " " and resid 483 and name HG2%)) 2.900 1.100 1.100 peak 147 spectrum 1 weight 0.11000E+01 volume 0.28864E-02 ppm1 7.734 ppm2 1.363 CV 1
ASSI { 149} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 470 and name HA )) 2.500 0.800 0.800 peak 149 spectrum 1 weight 0.11000E+01 volume 0.58370E-02 ppm1 8.202 ppm2 4.617 CV 1
ASSI { 153} ((( segid " " and resid 468 and name HN )) ((( segid " " and resid 468 and name HG12)) 2.200 0.600 0.600 peak 153 spectrum 1 weight 0.11000E+01 volume 0.10420E-01 ppm1 8.048 ppm2 2.154 CV 1
ASSI { 154} ((( segid " " and resid 468 and name HN )) ((( segid " " and resid 468 and name HA )) 2.500 0.800 0.800 peak 154 spectrum 1 weight 0.11000E+01 volume 0.42440E-02 ppm1 8.056 ppm2 3.491 CV 1
ASSI { 155} ((( segid " " and resid 468 and name HN )) ((( segid " " and resid 467 and name HA )) 2.700 0.900 0.900 peak 155 spectrum 1 weight 0.11000E+01 volume 0.37409E-02 ppm1 8.054 ppm2 3.816 CV 1
ASSI { 156} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 469 and name HA )) 2.300 0.700 0.700 peak 156 spectrum 1 weight 0.11000E+01 volume 0.70747E-02 ppm1 8.603 ppm2 4.013 CV 1
ASSI { 157} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 468 and name HA )) 2.800 1.000 1.000 peak 157 spectrum 1 weight 0.11000E+01 volume 0.24685E-02 ppm1 8.603 ppm2 3.484 CV 1
ASSI { 160} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 469 and name HB2 )) 2.400 0.700 0.700 peak 160 spectrum 1 weight 0.11000E+01 volume 0.48036E-02 ppm1 8.602 ppm2 2.056 CV 1
ASSI { 161} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 469 and name HA )) 3.000 1.100 1.100 peak 161 spectrum 1 weight 0.11000E+01 volume 0.19950E-02 ppm1 8.200 ppm2 4.016 CV 1
ASSI { 162} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 469 and name HB2 )) 2.700 0.900 0.900 peak 162 spectrum 1 weight 0.11000E+01 volume 0.29363E-02 ppm1 8.196 ppm2 2.061 CV 1
ASSI { 163} ((( segid " " and resid 472 and name HN )) ((( segid " " and resid 471 and name HB3 )) 3.000 1.100 1.100 peak 163 spectrum 1 weight 0.11000E+01 volume 0.27858E-02 ppm1 9.246 ppm2 4.197 CV 1
ASSI { 164} ((( segid " " and resid 472 and name HN )) ((( segid " " and resid 472 and name HG2 )) 2.900 1.000 1.000 peak 164 spectrum 1 weight 0.11000E+01 volume 0.25560E-02 ppm1 9.241 ppm2 1.774 CV 1
ASSI { 165} ((( segid " " and resid 472 and name HN )) ((( segid " " and resid 473 and name HN )) 3.200 1.300 1.300 peak 165 spectrum 1 weight 0.11000E+01 volume 0.10240E-02 ppm1 9.247 ppm2 6.971 CV 1
ASSI { 166} ((( segid " " and resid 473 and name HN )) ((( segid " " and resid 472 and name HA )) 2.800 1.000 1.000 peak 166 spectrum 1 weight 0.11000E+01 volume 0.27000E-02 ppm1 6.979 ppm2 4.646 CV 1
ASSI { 167} ((( segid " " and resid 473 and name HN )) ((( segid " " and resid 473 and name HG )) 3.000 1.100 1.100 peak 167 spectrum 1 weight 0.11000E+01 volume 0.17257E-02 ppm1 6.976 ppm2 1.401 CV 1
ASSI { 169} ((( segid " " and resid 473 and name HN )) ((( segid " " and resid 473 and name HB2 )) 2.700 0.900 0.900 peak 169 spectrum 1 weight 0.11000E+01 volume 0.51170E-02 ppm1 6.985 ppm2 1.683 CV 1
ASSI { 170} ((( segid " " and resid 474 and name HN )) ((( segid " " and resid 473 and name HG )) 2.400 0.700 0.700 peak 170 spectrum 1 weight 0.11000E+01 volume 0.51542E-02 ppm1 9.123 ppm2 1.398 CV 1
ASSI { 171} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 477 and name HB2 )) 2.900 1.100 1.100 peak 171 spectrum 1 weight 0.11000E+01 volume 0.84459E-03 ppm1 7.387 ppm2 1.915 CV 1
ASSI { 172} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 478 and name HG3 )) 2.400 0.700 0.700 peak 172 spectrum 1 weight 0.11000E+01 volume 0.55914E-02 ppm1 8.367 ppm2 1.517 CV 1
ASSI { 173} ((( segid " " and resid 480 and name HN )) (( segid " " and resid 480 and name HD% )) 3.600 1.700 1.700 peak 173 spectrum 1 weight 0.11000E+01 volume 0.22207E-02 ppm1 7.932 ppm2 7.205 CV 1
ASSI { 174} ((( segid " " and resid 482 and name HN )) ((( segid " " and resid 482 and name HA )) 2.400 0.700 0.700 peak 174 spectrum 1 weight 0.11000E+01 volume 0.66619E-02 ppm1 8.608 ppm2 4.110 CV 1
ASSI { 176} ((( segid " " and resid 482 and name HN )) ((( segid " " and resid 482 and name HB2 )) 2.300 0.700 0.700 peak 176 spectrum 1 weight 0.11000E+01 volume 0.70603E-02 ppm1 8.610 ppm2 2.422 CV 1
ASSI { 177} ((( segid " " and resid 483 and name HN )) ((( segid " " and resid 482 and name HB2 )) 3.100 1.200 1.200 peak 177 spectrum 1 weight 0.11000E+01 volume 0.31186E-02 ppm1 7.977 ppm2 2.423 CV 1
ASSI { 178} ((( segid " " and resid 484 and name HN )) ((( segid " " and resid 484 and name HG )) 2.100 0.500 0.500 peak 178 spectrum 1 weight 0.11000E+01 volume 0.11000E-01 ppm1 7.733 ppm2 1.482 CV 1
ASSI { 179} ((( segid " " and resid 484 and name HN )) ((( segid " " and resid 484 and name HB2 )) 2.300 0.700 0.700 peak 179 spectrum 1 weight 0.11000E+01 volume 0.77137E-02 ppm1 7.731 ppm2 1.904 CV 1
ASSI { 180} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 484 and name HB2 )) 2.500 0.800 0.800 peak 180 spectrum 1 weight 0.11000E+01 volume 0.44564E-02 ppm1 7.938 ppm2 1.902 CV 1
ASSI { 181} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 484 and name HG )) 3.000 3.000 3.000 peak 181 spectrum 1 weight 0.11000E+01 volume 0.42594E-02 ppm1 7.933 ppm2 1.491 CV 1
ASSI { 182} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 485 and name HA )) 2.400 0.700 0.700 peak 182 spectrum 1 weight 0.11000E+01 volume 0.54226E-02 ppm1 7.938 ppm2 3.353 CV 1
ASSI { 183} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 486 and name HA )) 2.400 0.700 0.700 peak 183 spectrum 1 weight 0.11000E+01 volume 0.67966E-02 ppm1 7.649 ppm2 4.423 CV 1
ASSI { 184} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 486 and name HB3 )) 2.400 0.700 0.700 peak 184 spectrum 1 weight 0.11000E+01 volume 0.63535E-02 ppm1 7.648 ppm2 2.796 CV 1
ASSI { 185} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 482 and name HA )) 2.600 0.800 0.800 peak 185 spectrum 1 weight 0.11000E+01 volume 0.38684E-02 ppm1 7.646 ppm2 4.093 CV 1
ASSI { 186} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 485 and name HB3 )) 2.500 0.800 0.800 peak 186 spectrum 1 weight 0.11000E+01 volume 0.48144E-02 ppm1 7.649 ppm2 2.035 CV 1
ASSI { 187} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 485 and name HB2 )) 2.100 0.600 0.600 peak 187 spectrum 1 weight 0.11000E+01 volume 0.11382E-01 ppm1 7.933 ppm2 2.043 CV 1
ASSI { 188} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 485 and name HA )) 3.100 1.200 1.200 peak 188 spectrum 1 weight 0.11000E+01 volume 0.13894E-02 ppm1 7.644 ppm2 3.357 CV 1
ASSI { 190} ((( segid " " and resid 487 and name HN )) ((( segid " " and resid 487 and name HB2 )) 2.400 0.700 0.700 peak 190 spectrum 1 weight 0.11000E+01 volume 0.51338E-02 ppm1 7.403 ppm2 2.661 CV 1
ASSI { 191} ((( segid " " and resid 488 and name HN )) ((( segid " " and resid 488 and name HB )) 2.100 0.600 0.600 peak 191 spectrum 1 weight 0.11000E+01 volume 0.91875E-02 ppm1 7.493 ppm2 1.957 CV 1
ASSI { 192} ((( segid " " and resid 488 and name HN )) ((( segid " " and resid 488 and name HG12)) 2.300 0.700 0.700 peak 192 spectrum 1 weight 0.11000E+01 volume 0.43551E-02 ppm1 7.493 ppm2 1.555 CV 1
ASSI { 195} ((( segid " " and resid 493 and name HN )) ((( segid " " and resid 493 and name HB3 )) 2.500 0.800 0.800 peak 195 spectrum 1 weight 0.11000E+01 volume 0.54056E-02 ppm1 8.456 ppm2 2.808 CV 1
ASSI { 196} ((( segid " " and resid 494 and name HN )) ((( segid " " and resid 494 and name HB3 )) 2.300 0.700 0.700 peak 196 spectrum 1 weight 0.11000E+01 volume 0.81777E-02 ppm1 8.339 ppm2 1.760 CV 1
ASSI { 197} ((( segid " " and resid 494 and name HN )) ((( segid " " and resid 494 and name HG )) 2.200 0.600 0.600 peak 197 spectrum 1 weight 0.11000E+01 volume 0.73440E-02 ppm1 8.340 ppm2 1.857 CV 1
ASSI { 199} ((( segid " " and resid 494 and name HN )) ((( segid " " and resid 493 and name HB3 )) 2.800 2.800 3.200 peak 199 spectrum 1 weight 0.11000E+01 volume 0.25883E-02 ppm1 8.342 ppm2 2.803 CV 1
ASSI { 201} ((( segid " " and resid 495 and name HN )) ((( segid " " and resid 495 and name HA )) 2.300 2.300 3.700 peak 201 spectrum 1 weight 0.11000E+01 volume 0.85844E-02 ppm1 8.031 ppm2 4.402 CV 1
ASSI { 202} ((( segid " " and resid 495 and name HN )) ((( segid " " and resid 494 and name HG )) 2.800 2.800 3.200 peak 202 spectrum 1 weight 0.11000E+01 volume 0.30293E-02 ppm1 8.034 ppm2 1.853 CV 1
ASSI { 203} ((( segid " " and resid 488 and name HN )) ((( segid " " and resid 485 and name HA )) 6.000 4.500 0.000 peak 203 spectrum 1 weight 0.11000E+01 volume 0.22196E-04 ppm1 7.490 ppm2 3.352 CV 1
ASSI { 205} ((( segid " " and resid 488 and name HN )) ((( segid " " and resid 487 and name HB2 )) 6.000 6.000 0.000 peak 205 spectrum 1 weight 0.11000E+01 volume 0.23313E-04 ppm1 7.493 ppm2 2.666 CV 1
ASSI { 207} (( segid " " and resid 497 and name HE% ) ((( segid " " and resid 497 and name HA )) 6.000 6.000 0.000 peak 207 spectrum 1 weight 0.11000E+01 volume 0.18635E-04 ppm1 4.375 ppm2 4.012 CV 1
ASSI { 211} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 485 and name HG )) 4.900 3.000 1.100 peak 211 spectrum 1 weight 0.11000E+01 volume 0.11589E-03 ppm1 7.936 ppm2 1.263 CV 1
ASSI { 214} ((( segid " " and resid 482 and name HN )) ((( segid " " and resid 482 and name HG2 )) 6.000 4.500 0.000 peak 214 spectrum 1 weight 0.11000E+01 volume 0.54761E-04 ppm1 8.608 ppm2 2.905 CV 1
ASSI { 215} ((( segid " " and resid 481 and name HN )) (( segid " " and resid 480 and name HD% )) 6.000 4.600 0.000 peak 215 spectrum 1 weight 0.11000E+01 volume 0.39427E-04 ppm1 8.594 ppm2 7.201 CV 1
ASSI { 216} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 478 and name HA )) 5.900 4.300 0.100 peak 216 spectrum 1 weight 0.11000E+01 volume 0.27264E-04 ppm1 8.599 ppm2 3.771 CV 1
ASSI { 217} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 482 and name HA )) 5.400 3.600 0.600 peak 217 spectrum 1 weight 0.11000E+01 volume 0.48420E-04 ppm1 7.934 ppm2 4.093 CV 1
ASSI { 221} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 477 and name HG2 )) 6.000 4.900 0.000 peak 221 spectrum 1 weight 0.11000E+01 volume 0.75399E-04 ppm1 7.387 ppm2 1.496 CV 1
ASSI { 227} ((( segid " " and resid 473 and name HN )) ((( segid " " and resid 471 and name HB3 )) 6.000 4.800 0.000 peak 227 spectrum 1 weight 0.11000E+01 volume 0.25210E-04 ppm1 6.979 ppm2 4.196 CV 1
ASSI { 231} ((( segid " " and resid 499 and name HN )) ((( segid " " and resid 499 and name HG2 )) 5.700 4.100 0.300 peak 231 spectrum 1 weight 0.11000E+01 volume 0.43170E-04 ppm1 8.029 ppm2 2.663 CV 1
ASSI { 232} ((( segid " " and resid 499 and name HN )) ((( segid " " and resid 499 and name HB2 )) 4.600 2.600 1.400 peak 232 spectrum 1 weight 0.11000E+01 volume 0.11165E-03 ppm1 8.031 ppm2 2.308 CV 1
ASSI { 234} ((( segid " " and resid 499 and name HN )) ((( segid " " and resid 498 and name HB2 )) 6.000 5.400 0.000 peak 234 spectrum 1 weight 0.11000E+01 volume 0.73423E-04 ppm1 8.031 ppm2 3.635 CV 1
ASSI { 237} ((( segid " " and resid 500 and name HN )) ((( segid " " and resid 500 and name HB2 )) 4.300 2.400 1.700 peak 237 spectrum 1 weight 0.11000E+01 volume 0.14372E-03 ppm1 7.881 ppm2 2.211 CV 1
ASSI { 238} ((( segid " " and resid 500 and name HN )) ((( segid " " and resid 500 and name HG2 )) 5.400 3.600 0.600 peak 238 spectrum 1 weight 0.11000E+01 volume 0.14822E-03 ppm1 7.880 ppm2 2.313 CV 1
ASSI { 239} ((( segid " " and resid 500 and name HN )) ((( segid " " and resid 500 and name HA )) 4.900 3.000 1.100 peak 239 spectrum 1 weight 0.11000E+01 volume 0.88421E-04 ppm1 7.881 ppm2 4.110 CV 1
ASSI { 241} ((( segid " " and resid 496 and name HN )) ((( segid " " and resid 496 and name HA )) 4.700 2.800 1.300 peak 241 spectrum 1 weight 0.11000E+01 volume 0.10812E-03 ppm1 7.979 ppm2 4.212 CV 1
ASSI { 242} ((( segid " " and resid 496 and name HN )) ((( segid " " and resid 496 and name HB3 )) 4.400 2.400 1.600 peak 242 spectrum 1 weight 0.11000E+01 volume 0.13866E-03 ppm1 7.978 ppm2 2.108 CV 1
ASSI { 243} ((( segid " " and resid 496 and name HN )) ((( segid " " and resid 496 and name HD2 )) 6.000 6.000 0.000 peak 243 spectrum 1 weight 0.11000E+01 volume 0.24690E-04 ppm1 7.978 ppm2 1.814 CV 1
ASSI { 244} ((( segid " " and resid 496 and name HN )) ((( segid " " and resid 496 and name HG2 )) 6.000 6.000 0.000 peak 244 spectrum 1 weight 0.11000E+01 volume 0.20064E-04 ppm1 7.977 ppm2 1.630 CV 1
ASSI { 246} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 466 and name HA )) 6.000 5.400 0.000 peak 246 spectrum 1 weight 0.11000E+01 volume 0.15750E-04 ppm1 8.201 ppm2 4.333 CV 1
ASSI { 247} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 467 and name HA )) 6.000 4.500 0.000 peak 247 spectrum 1 weight 0.11000E+01 volume 0.25678E-04 ppm1 8.199 ppm2 3.826 CV 1
ASSI { 248} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 469 and name HG2 )) 5.500 3.700 0.500 peak 248 spectrum 1 weight 0.11000E+01 volume 0.54346E-04 ppm1 8.599 ppm2 1.494 CV 1
ASSI { 249} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 469 and name HD2 )) 6.000 4.900 0.000 peak 249 spectrum 1 weight 0.11000E+01 volume 0.44495E-04 ppm1 8.603 ppm2 1.747 CV 1
ASSI { 251} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 465 and name HB3 )) 5.100 3.200 0.900 peak 251 spectrum 1 weight 0.11000E+01 volume 0.13767E-03 ppm1 8.268 ppm2 1.988 CV 1
ASSI { 253} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 462 and name HA )) 5.800 4.300 0.200 peak 253 spectrum 1 weight 0.11000E+01 volume 0.40726E-04 ppm1 8.641 ppm2 4.222 CV 1
ASSI { 254} ((( segid " " and resid 464 and name HN )) ((( segid " " and resid 464 and name HA )) 5.000 3.100 1.000 peak 254 spectrum 1 weight 0.11000E+01 volume 0.60974E-04 ppm1 8.231 ppm2 3.550 CV 1
ASSI { 255} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 464 and name HA )) 5.900 4.400 0.100 peak 255 spectrum 1 weight 0.11000E+01 volume 0.34957E-04 ppm1 8.270 ppm2 3.553 CV 1
ASSI { 258} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 505 and name HB )) 4.600 2.600 1.400 peak 258 spectrum 1 weight 0.11000E+01 volume 0.13827E-03 ppm1 8.454 ppm2 2.045 CV 1
ASSI { 259} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 505 and name HA )) 4.900 3.000 1.100 peak 259 spectrum 1 weight 0.11000E+01 volume 0.86650E-04 ppm1 8.454 ppm2 3.822 CV 1
ASSI { 261} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 504 and name HB )) 4.900 3.000 1.100 peak 261 spectrum 1 weight 0.11000E+01 volume 0.69003E-04 ppm1 8.454 ppm2 2.165 CV 1
ASSI { 262} ((( segid " " and resid 504 and name HN )) ((( segid " " and resid 504 and name HB )) 4.300 2.300 1.700 peak 262 spectrum 1 weight 0.11000E+01 volume 0.13603E-03 ppm1 8.096 ppm2 2.164 CV 1
ASSI { 265} ((( segid " " and resid 504 and name HN )) ((( segid " " and resid 504 and name HG12)) 5.600 3.900 0.400 peak 265 spectrum 1 weight 0.11000E+01 volume 0.43819E-04 ppm1 8.094 ppm2 1.311 CV 1
ASSI { 266} ((( segid " " and resid 504 and name HN )) ((( segid " " and resid 504 and name HA )) 4.700 2.700 1.300 peak 266 spectrum 1 weight 0.11000E+01 volume 0.10955E-03 ppm1 8.096 ppm2 3.904 CV 1
ASSI { 269} ((( segid " " and resid 503 and name HN )) ((( segid " " and resid 503 and name HG3 )) 5.500 3.700 0.500 peak 269 spectrum 1 weight 0.11000E+01 volume 0.48731E-04 ppm1 7.367 ppm2 1.704 CV 1
ASSI { 270} ((( segid " " and resid 503 and name HN )) ((( segid " " and resid 503 and name HD3 )) 6.000 4.500 0.000 peak 270 spectrum 1 weight 0.11000E+01 volume 0.58480E-04 ppm1 7.371 ppm2 0.958 CV 1
ASSI { 271} ((( segid " " and resid 503 and name HN )) ((( segid " " and resid 503 and name HA )) 4.900 3.000 1.100 peak 271 spectrum 1 weight 0.11000E+01 volume 0.83609E-04 ppm1 7.370 ppm2 4.144 CV 1
ASSI { 273} ((( segid " " and resid 504 and name HN )) ((( segid " " and resid 503 and name HB3 )) 5.300 3.500 0.700 peak 273 spectrum 1 weight 0.11000E+01 volume 0.60009E-04 ppm1 8.096 ppm2 2.047 CV 1
ASSI { 274} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 502 and name HA )) 4.700 2.700 1.300 peak 274 spectrum 1 weight 0.11000E+01 volume 0.11267E-03 ppm1 8.233 ppm2 3.632 CV 1
ASSI { 275} ((( segid " " and resid 503 and name HN )) ((( segid " " and resid 502 and name HA )) 6.000 5.000 0.000 peak 275 spectrum 1 weight 0.11000E+01 volume 0.21883E-04 ppm1 7.366 ppm2 3.635 CV 1
ASSI { 276} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 477 and name HA )) 6.000 4.900 0.000 peak 276 spectrum 1 weight 0.11000E+01 volume 0.20974E-04 ppm1 8.602 ppm2 4.376 CV 1
ASSI { 277} ((( segid " " and resid 464 and name HN )) ((( segid " " and resid 463 and name HA )) 5.900 4.300 0.100 peak 277 spectrum 1 weight 0.11000E+01 volume 0.41636E-04 ppm1 8.229 ppm2 3.821 CV 1
ASSI { 279} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 501 and name HA )) 5.400 3.600 0.600 peak 279 spectrum 1 weight 0.11000E+01 volume 0.50525E-04 ppm1 8.233 ppm2 3.895 CV 1
ASSI { 280} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 502 and name HA )) 5.700 4.100 0.300 peak 280 spectrum 1 weight 0.11000E+01 volume 0.34307E-04 ppm1 8.455 ppm2 3.632 CV 1
ASSI { 281} ((( segid " " and resid 464 and name HN )) ((( segid " " and resid 464 and name HB )) 4.200 2.200 1.800 peak 281 spectrum 1 weight 0.11000E+01 volume 0.17156E-03 ppm1 8.230 ppm2 1.976 CV 1
ASSI { 283} ((( segid " " and resid 464 and name HN )) ((( segid " " and resid 464 and name HG12)) 6.000 4.500 0.000 peak 283 spectrum 1 weight 0.11000E+01 volume 0.35269E-04 ppm1 8.232 ppm2 1.157 CV 1
ASSI { 284} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 501 and name HB3 )) 5.600 3.900 0.400 peak 284 spectrum 1 weight 0.11000E+01 volume 0.37504E-04 ppm1 8.231 ppm2 1.333 CV 1
ASSI { 291} ((( segid " " and resid 495 and name HN )) ((( segid " " and resid 493 and name HA )) 5.900 5.900 0.100 peak 291 spectrum 1 weight 0.11000E+01 volume 0.42624E-04 ppm1 8.030 ppm2 4.649 CV 1
ASSI { 292} ((( segid " " and resid 493 and name HN )) ((( segid " " and resid 492 and name HA )) 6.000 5.300 0.000 peak 292 spectrum 1 weight 0.11000E+01 volume 0.20558E-04 ppm1 8.458 ppm2 4.383 CV 1
ASSI { 293} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 466 and name HA )) 6.000 5.300 0.000 peak 293 spectrum 1 weight 0.11000E+01 volume 0.18869E-04 ppm1 8.272 ppm2 4.333 CV 1
ASSI { 295} ((( segid " " and resid 489 and name HN )) ((( segid " " and resid 489 and name HB2 )) 6.000 4.900 0.000 peak 295 spectrum 1 weight 0.11000E+01 volume 0.22690E-04 ppm1 9.162 ppm2 1.955 CV 1
ASSI { 297} ((( segid " " and resid 489 and name HN )) ((( segid " " and resid 488 and name HN )) 6.000 5.100 0.000 peak 297 spectrum 1 weight 0.11000E+01 volume 0.19623E-04 ppm1 9.162 ppm2 7.494 CV 1
ASSI { 298} ((( segid " " and resid 488 and name HN )) ((( segid " " and resid 487 and name HA )) 6.000 5.500 0.000 peak 298 spectrum 1 weight 0.11000E+01 volume 0.19155E-04 ppm1 7.499 ppm2 4.425 CV 1
ASSI { 299} ((( segid " " and resid 487 and name HN )) ((( segid " " and resid 487 and name HA )) 6.000 4.800 0.000 peak 299 spectrum 1 weight 0.11000E+01 volume 0.21988E-04 ppm1 7.410 ppm2 4.423 CV 1
ASSI { 300} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 481 and name HB3 )) 5.900 4.400 0.100 peak 300 spectrum 1 weight 0.11000E+01 volume 0.20532E-04 ppm1 7.931 ppm2 2.187 CV 1
ASSI { 302} ((( segid " " and resid 487 and name HN )) ((( segid " " and resid 484 and name HA )) 6.000 4.400 0.000 peak 302 spectrum 1 weight 0.11000E+01 volume 0.24509E-04 ppm1 7.405 ppm2 4.034 CV 1
ASSI { 303} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 484 and name HA )) 5.900 4.300 0.100 peak 303 spectrum 1 weight 0.11000E+01 volume 0.34697E-04 ppm1 7.934 ppm2 4.034 CV 1
ASSI { 304} ((( segid " " and resid 484 and name HN )) ((( segid " " and resid 482 and name HA )) 6.000 5.000 0.000 peak 304 spectrum 1 weight 0.11000E+01 volume 0.22300E-04 ppm1 7.732 ppm2 4.091 CV 1
ASSI { 305} ((( segid " " and resid 501 and name HN )) ((( segid " " and resid 500 and name HG3 )) 6.000 4.600 0.000 peak 305 spectrum 1 weight 0.11000E+01 volume 0.55280E-04 ppm1 8.583 ppm2 2.318 CV 1
ASSI { 307} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 480 and name HA )) 6.000 5.000 0.000 peak 307 spectrum 1 weight 0.11000E+01 volume 0.29759E-04 ppm1 8.601 ppm2 4.450 CV 1
ASSI { 308} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 481 and name HB2 )) 3.800 1.800 1.800 peak 308 spectrum 1 weight 0.11000E+01 volume 0.31238E-03 ppm1 8.598 ppm2 2.189 CV 1
ASSI { 311} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 480 and name HB2 )) 6.000 6.000 0.000 peak 311 spectrum 1 weight 0.11000E+01 volume 0.30045E-04 ppm1 8.588 ppm2 3.446 CV 1
ASSI { 314} ((( segid " " and resid 472 and name HN )) ((( segid " " and resid 472 and name HB2 )) 6.000 5.000 0.000 peak 314 spectrum 1 weight 0.11000E+01 volume 0.15360E-04 ppm1 9.246 ppm2 2.275 CV 1
ASSI { 316} ((( segid " " and resid 471 and name HN )) ((( segid " " and resid 471 and name HB2 )) 5.900 4.400 0.100 peak 316 spectrum 1 weight 0.11000E+01 volume 0.29993E-04 ppm1 7.536 ppm2 4.175 CV 1
ASSI { 317} ((( segid " " and resid 471 and name HN )) ((( segid " " and resid 470 and name HA )) 6.000 5.400 0.000 peak 317 spectrum 1 weight 0.11000E+01 volume 0.19207E-04 ppm1 7.542 ppm2 4.624 CV 1
ASSI { 320} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 467 and name HB )) 6.000 4.500 0.000 peak 320 spectrum 1 weight 0.11000E+01 volume 0.13047E-04 ppm1 8.200 ppm2 2.249 CV 1
ASSI { 322} ((( segid " " and resid 468 and name HN )) ((( segid " " and resid 468 and name HB )) 4.900 3.000 1.100 peak 322 spectrum 1 weight 0.11000E+01 volume 0.14495E-03 ppm1 8.050 ppm2 2.228 CV 1
ASSI { 327} ((( segid " " and resid 501 and name HN )) ((( segid " " and resid 501 and name HB3 )) 4.700 2.800 1.300 peak 327 spectrum 1 weight 0.11000E+01 volume 0.10357E-03 ppm1 8.584 ppm2 1.333 CV 1
ASSI { 331} ((( segid " " and resid 464 and name HA )) ((( segid " " and resid 467 and name HG12)) 6.000 4.500 0.000 peak 331 spectrum 1 weight 0.11000E+01 volume 0.33787E-04 ppm1 3.556 ppm2 2.193 CV 1
ASSI { 332} ((( segid " " and resid 464 and name HA )) ((( segid " " and resid 464 and name HB )) 5.100 3.300 0.900 peak 332 spectrum 1 weight 0.11000E+01 volume 0.53955E-04 ppm1 3.556 ppm2 1.967 CV 1
ASSI { 333} ((( segid " " and resid 497 and name HN )) ((( segid " " and resid 493 and name HA )) 6.000 6.000 0.000 peak 333 spectrum 1 weight 0.11000E+01 volume 0.13463E-04 ppm1 8.412 ppm2 4.666 CV 1
ASSI { 334} ((( segid " " and resid 497 and name HN )) ((( segid " " and resid 493 and name HB3 )) 6.000 4.700 0.000 peak 334 spectrum 1 weight 0.11000E+01 volume 0.19778E-04 ppm1 8.412 ppm2 2.812 CV 1
ASSI { 335} ((( segid " " and resid 497 and name HN )) ((( segid " " and resid 496 and name HB2 )) 4.900 3.000 1.100 peak 335 spectrum 1 weight 0.11000E+01 volume 0.70719E-04 ppm1 8.411 ppm2 2.111 CV 1
ASSI { 347} ((( segid " " and resid 497 and name HN )) ((( segid " " and resid 496 and name HD2 )) 6.000 4.500 0.000 peak 347 spectrum 1 weight 0.11000E+01 volume 0.33709E-04 ppm1 8.412 ppm2 1.871 CV 1
ASSI { 349} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 505 and name HG12)) 5.200 5.200 0.800 peak 349 spectrum 1 weight 0.11000E+01 volume 0.42988E-04 ppm1 8.453 ppm2 1.197 CV 1
ASSI { 355} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 464 and name HG12)) 6.000 4.700 0.000 peak 355 spectrum 1 weight 0.11000E+01 volume 0.34203E-04 ppm1 8.642 ppm2 1.166 CV 1
ASSI { 356} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 465 and name HG2 )) 6.000 6.000 0.000 peak 356 spectrum 1 weight 0.11000E+01 volume 0.31058E-04 ppm1 8.642 ppm2 1.780 CV 1
ASSI { 377} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 466 and name HB2 )) 6.000 6.000 0.000 peak 377 spectrum 1 weight 0.11000E+01 volume 0.17024E-04 ppm1 8.643 ppm2 4.167 CV 1
ASSI { 380} ((( segid " " and resid 499 and name HA )) (( segid " " and resid 502 and name HG1%)) 6.000 6.000 0.000 peak 380 spectrum 1 weight 0.11000E+01 volume 0.14659E-04 ppm1 3.937 ppm2 0.964 CV 1
ASSI { 382} ((( segid " " and resid 500 and name HN )) ((( segid " " and resid 496 and name HB2 )) 5.800 4.200 0.200 peak 382 spectrum 1 weight 0.11000E+01 volume 0.15776E-04 ppm1 7.878 ppm2 2.108 CV 1
ASSI { 383} ((( segid " " and resid 467 and name HN )) ((( segid " " and resid 469 and name HB2 )) 6.000 5.800 0.000 peak 383 spectrum 1 weight 0.11000E+01 volume 0.17024E-04 ppm1 8.270 ppm2 2.058 CV 1
ASSI { 387} ((( segid " " and resid 473 and name HA )) ((( segid " " and resid 473 and name HG )) 6.000 5.200 0.000 peak 387 spectrum 1 weight 0.11000E+01 volume 0.28641E-04 ppm1 3.966 ppm2 1.394 CV 1
ASSI { 392} ((( segid " " and resid 493 and name HA )) ((( segid " " and resid 493 and name HB2 )) 6.000 6.000 0.000 peak 392 spectrum 1 weight 0.11000E+01 volume 0.19804E-04 ppm1 4.671 ppm2 2.785 CV 1
ASSI { 406} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 500 and name HA )) 6.000 6.000 0.000 peak 406 spectrum 1 weight 0.11000E+01 volume 0.20662E-04 ppm1 8.573 ppm2 4.129 CV 1
ASSI { 412} (( segid " " and resid 497 and name HD% ) ((( segid " " and resid 496 and name HD2 )) 5.400 5.400 0.600 peak 412 spectrum 1 weight 0.11000E+01 volume 0.57023E-04 ppm1 7.257 ppm2 1.840 CV 1
ASSI { 424} ((( segid " " and resid 494 and name HA )) ((( segid " " and resid 494 and name HB2 )) 5.600 5.600 0.400 peak 424 spectrum 1 weight 0.11000E+01 volume 0.37530E-04 ppm1 4.187 ppm2 1.758 CV 1
ASSI { 425} ((( segid " " and resid 494 and name HA )) ((( segid " " and resid 494 and name HG )) 6.000 6.000 0.000 peak 425 spectrum 1 weight 0.11000E+01 volume 0.21468E-04 ppm1 4.188 ppm2 1.855 CV 1
ASSI { 430} ((( segid " " and resid 466 and name HA )) ((( segid " " and resid 466 and name HB2 )) 4.700 2.700 1.300 peak 430 spectrum 1 weight 0.11000E+01 volume 0.12070E-03 ppm1 4.334 ppm2 4.168 CV 1
ASSI { 431} ((( segid " " and resid 462 and name HA )) ((( segid " " and resid 462 and name HB2 )) 4.800 2.900 1.200 peak 431 spectrum 1 weight 0.11000E+01 volume 0.10074E-03 ppm1 4.226 ppm2 3.997 CV 1
ASSI { 433} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 471 and name HA )) 6.000 6.000 0.000 peak 433 spectrum 1 weight 0.11000E+01 volume 0.18661E-04 ppm1 8.206 ppm2 4.539 CV 1
ASSI { 435} ((( segid " " and resid 469 and name HA )) ((( segid " " and resid 470 and name HB3 )) 6.000 6.000 0.000 peak 435 spectrum 1 weight 0.11000E+01 volume 0.32670E-04 ppm1 4.149 ppm2 4.001 CV 1
ASSI { 437} ((( segid " " and resid 498 and name HA )) ((( segid " " and resid 498 and name HB2 )) 5.500 3.800 0.500 peak 437 spectrum 1 weight 0.11000E+01 volume 0.33293E-04 ppm1 4.230 ppm2 3.643 CV 1
ASSI { 439} ((( segid " " and resid 480 and name HA )) ((( segid " " and resid 476 and name HB3 )) 6.000 5.200 0.000 peak 439 spectrum 1 weight 0.11000E+01 volume 0.36620E-04 ppm1 4.440 ppm2 2.761 CV 1
ASSI { 445} ((( segid " " and resid 483 and name HB )) (( segid " " and resid 483 and name HG2%)) 5.100 3.300 0.900 peak 445 spectrum 1 weight 0.11000E+01 volume 0.64848E-04 ppm1 4.093 ppm2 1.363 CV 1
ASSI { 446} ((( segid " " and resid 484 and name HA )) ((( segid " " and resid 484 and name HG )) 5.200 3.400 0.800 peak 446 spectrum 1 weight 0.11000E+01 volume 0.77501E-04 ppm1 4.055 ppm2 1.481 CV 1
ASSI { 449} ((( segid " " and resid 479 and name HA )) ((( segid " " and resid 479 and name HB2 )) 5.500 3.700 0.500 peak 449 spectrum 1 weight 0.11000E+01 volume 0.67756E-04 ppm1 4.078 ppm2 2.058 CV 1
ASSI { 450} ((( segid " " and resid 462 and name HA )) ((( segid " " and resid 465 and name HB3 )) 5.300 3.500 0.700 peak 450 spectrum 1 weight 0.11000E+01 volume 0.47328E-04 ppm1 4.227 ppm2 1.986 CV 1
ASSI { 451} ((( segid " " and resid 484 and name HA )) ((( segid " " and resid 484 and name HB3 )) 5.500 3.800 0.500 peak 451 spectrum 1 weight 0.11000E+01 volume 0.39219E-04 ppm1 4.050 ppm2 1.910 CV 1
ASSI { 452} ((( segid " " and resid 499 and name HA )) ((( segid " " and resid 503 and name HG3 )) 5.800 4.200 0.200 peak 452 spectrum 1 weight 0.11000E+01 volume 0.38699E-04 ppm1 3.940 ppm2 1.707 CV 1
ASSI { 455} ((( segid " " and resid 496 and name HA )) ((( segid " " and resid 496 and name HB3 )) 5.900 4.400 0.100 peak 455 spectrum 1 weight 0.11000E+01 volume 0.26484E-04 ppm1 4.217 ppm2 2.123 CV 1
ASSI { 456} ((( segid " " and resid 469 and name HA )) ((( segid " " and resid 469 and name HB2 )) 5.800 4.200 0.200 peak 456 spectrum 1 weight 0.11000E+01 volume 0.31292E-04 ppm1 4.027 ppm2 2.062 CV 1
ASSI { 457} ((( segid " " and resid 504 and name HA )) ((( segid " " and resid 504 and name HB )) 5.100 3.200 0.900 peak 457 spectrum 1 weight 0.11000E+01 volume 0.68589E-04 ppm1 3.909 ppm2 2.161 CV 1
ASSI { 458} ((( segid " " and resid 474 and name HA )) ((( segid " " and resid 475 and name HB2 )) 5.500 5.500 0.500 peak 458 spectrum 1 weight 0.11000E+01 volume 0.15378E-03 ppm1 3.941 ppm2 2.224 CV 1
ASSI { 461} ((( segid " " and resid 481 and name HA )) ((( segid " " and resid 482 and name HB2 )) 6.000 5.700 0.000 peak 461 spectrum 1 weight 0.11000E+01 volume 0.30460E-04 ppm1 4.067 ppm2 2.427 CV 1
ASSI { 464} ((( segid " " and resid 469 and name HA )) ((( segid " " and resid 478 and name HD3 )) 6.000 4.600 0.000 peak 464 spectrum 1 weight 0.11000E+01 volume 0.24197E-04 ppm1 4.007 ppm2 1.708 CV 1
ASSI { 465} ((( segid " " and resid 504 and name HA )) ((( segid " " and resid 501 and name HB2 )) 6.000 5.000 0.000 peak 465 spectrum 1 weight 0.11000E+01 volume 0.66641E-04 ppm1 3.898 ppm2 1.339 CV 1
ASSI { 466} ((( segid " " and resid 504 and name HA )) ((( segid " " and resid 504 and name HG12)) 5.100 3.300 0.900 peak 466 spectrum 1 weight 0.11000E+01 volume 0.62768E-04 ppm1 3.897 ppm2 1.298 CV 1
ASSI { 480} ((( segid " " and resid 468 and name HB )) ((( segid " " and resid 478 and name HA )) 4.400 2.400 1.600 peak 480 spectrum 1 weight 0.11000E+01 volume 0.12387E-03 ppm1 2.221 ppm2 3.771 CV 1
ASSI { 482} ((( segid " " and resid 478 and name HG2 )) ((( segid " " and resid 478 and name HA )) 6.000 4.800 0.000 peak 482 spectrum 1 weight 0.11000E+01 volume 0.33475E-04 ppm1 1.515 ppm2 3.767 CV 1
ASSI { 483} ((( segid " " and resid 479 and name HG3 )) ((( segid " " and resid 478 and name HA )) 6.000 6.000 0.000 peak 483 spectrum 1 weight 0.11000E+01 volume 0.22975E-04 ppm1 1.717 ppm2 3.760 CV 1
ASSI { 509} ((( segid " " and resid 474 and name HB2 )) ((( segid " " and resid 473 and name HG )) 6.000 4.700 0.000 peak 509 spectrum 1 weight 0.11000E+01 volume 0.38829E-04 ppm1 2.103 ppm2 1.403 CV 1
ASSI { 510} ((( segid " " and resid 484 and name HB2 )) ((( segid " " and resid 484 and name HG )) 3.700 1.700 1.700 peak 510 spectrum 1 weight 0.11000E+01 volume 0.44792E-03 ppm1 1.903 ppm2 1.485 CV 1
ASSI { 511} ((( segid " " and resid 481 and name HB2 )) ((( segid " " and resid 484 and name HG )) 4.600 2.600 1.400 peak 511 spectrum 1 weight 0.11000E+01 volume 0.29566E-03 ppm1 2.202 ppm2 1.497 CV 1
ASSI { 513} ((( segid " " and resid 473 and name HB2 )) ((( segid " " and resid 473 and name HG )) 4.800 2.900 1.200 peak 513 spectrum 1 weight 0.11000E+01 volume 0.72982E-04 ppm1 1.702 ppm2 1.403 CV 1
ASSI { 516} ((( segid " " and resid 474 and name HG2 )) ((( segid " " and resid 474 and name HB2 )) 5.500 3.800 0.500 peak 516 spectrum 1 weight 0.11000E+01 volume 0.51487E-04 ppm1 2.667 ppm2 2.106 CV 1
ASSI { 518} ((( segid " " and resid 482 and name HB2 )) ((( segid " " and resid 482 and name HA )) 4.600 2.600 1.400 peak 518 spectrum 1 weight 0.11000E+01 volume 0.10016E-03 ppm1 2.428 ppm2 4.080 CV 1
ASSI { 528} ((( segid " " and resid 472 and name HG2 )) ((( segid " " and resid 472 and name HB2 )) 6.000 4.500 0.000 peak 528 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.772 ppm2 2.285 CV 1
ASSI { 534} (( segid " " and resid 483 and name HG2%) ((( segid " " and resid 483 and name HA )) 5.800 4.200 0.200 peak 534 spectrum 1 weight 0.11000E+01 volume 0.38777E-04 ppm1 1.357 ppm2 4.398 CV 1
ASSI { 538} (( segid " " and resid 480 and name HE% ) ((( segid " " and resid 480 and name HA )) 6.000 6.000 0.000 peak 538 spectrum 1 weight 0.11000E+01 volume 0.16660E-04 ppm1 6.905 ppm2 4.447 CV 1
ASSI { 541} ((( segid " " and resid 496 and name HA )) ((( segid " " and resid 496 and name HG2 )) 6.000 5.400 0.000 peak 541 spectrum 1 weight 0.11000E+01 volume 0.19337E-04 ppm1 4.219 ppm2 1.839 CV 1
ASSI { 544} ((( segid " " and resid 500 and name HA )) ((( segid " " and resid 500 and name HB2 )) 4.800 2.900 1.200 peak 544 spectrum 1 weight 0.11000E+01 volume 0.93592E-04 ppm1 4.103 ppm2 2.213 CV 1
ASSI { 545} ((( segid " " and resid 481 and name HA )) ((( segid " " and resid 481 and name HB2 )) 5.200 3.300 0.800 peak 545 spectrum 1 weight 0.11000E+01 volume 0.60765E-04 ppm1 4.067 ppm2 2.199 CV 1
ASSI { 547} ((( segid " " and resid 500 and name HA )) ((( segid " " and resid 500 and name HG2 )) 6.000 4.600 0.000 peak 547 spectrum 1 weight 0.11000E+01 volume 0.28199E-04 ppm1 4.117 ppm2 2.321 CV 1
ASSI { 551} ((( segid " " and resid 502 and name HA )) ((( segid " " and resid 503 and name HB3 )) 6.000 4.800 0.000 peak 551 spectrum 1 weight 0.11000E+01 volume 0.53150E-04 ppm1 3.627 ppm2 2.045 CV 1
ASSI { 577} ((( segid " " and resid 473 and name HG )) ((( segid " " and resid 501 and name HB2 )) 4.300 4.300 1.700 peak 577 spectrum 1 weight 0.11000E+01 volume 0.91119E-04 ppm1 1.327 ppm2 0.714 CV 1
ASSI { 578} ((( segid " " and resid 482 and name HG2 )) ((( segid " " and resid 482 and name HB2 )) 5.900 4.300 0.100 peak 578 spectrum 1 weight 0.11000E+01 volume 0.37868E-04 ppm1 2.906 ppm2 2.427 CV 1
ASSI { 583} ((( segid " " and resid 499 and name HG2 )) ((( segid " " and resid 499 and name HB2 )) 5.200 3.400 0.800 peak 583 spectrum 1 weight 0.11000E+01 volume 0.58894E-04 ppm1 2.652 ppm2 2.308 CV 1
ASSI { 585} ((( segid " " and resid 475 and name HG2 )) ((( segid " " and resid 475 and name HB2 )) 6.000 4.500 0.000 peak 585 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.524 ppm2 2.209 CV 1
ASSI { 588} ((( segid " " and resid 481 and name HB3 )) ((( segid " " and resid 482 and name HG2 )) 6.000 5.500 0.000 peak 588 spectrum 1 weight 0.11000E+01 volume 0.28693E-04 ppm1 2.204 ppm2 2.911 CV 1
ASSI { 603} (( segid " " and resid 497 and name HD% ) ((( segid " " and resid 464 and name HG12)) 5.200 5.200 0.800 peak 603 spectrum 1 weight 0.11000E+01 volume 0.88598E-04 ppm1 7.260 ppm2 1.166 CV 1
ASSI { 615} ((( segid " " and resid 478 and name HD2 )) ((( segid " " and resid 478 and name HB2 )) 4.200 2.200 1.800 peak 615 spectrum 1 weight 0.11000E+01 volume 0.19313E-03 ppm1 1.710 ppm2 2.142 CV 1
ASSI { 617} ((( segid " " and resid 465 and name HG2 )) ((( segid " " and resid 465 and name HB2 )) 6.000 4.500 0.000 peak 617 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.686 ppm2 1.992 CV 1
ASSI { 621} ((( segid " " and resid 478 and name HG2 )) ((( segid " " and resid 469 and name HB2 )) 4.400 2.400 1.600 peak 621 spectrum 1 weight 0.11000E+01 volume 0.88338E-04 ppm1 1.514 ppm2 2.025 CV 1
ASSI { 624} ((( segid " " and resid 496 and name HG2 )) ((( segid " " and resid 496 and name HD3 )) 4.600 2.700 1.400 peak 624 spectrum 1 weight 0.11000E+01 volume 0.11028E-03 ppm1 1.633 ppm2 1.858 CV 1
ASSI { 625} ((( segid " " and resid 477 and name HB2 )) ((( segid " " and resid 474 and name HB2 )) 6.000 4.500 0.000 peak 625 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.924 ppm2 2.116 CV 1
ASSI { 627} ((( segid " " and resid 478 and name HG3 )) ((( segid " " and resid 478 and name HD2 )) 4.000 2.000 2.000 peak 627 spectrum 1 weight 0.11000E+01 volume 0.23586E-03 ppm1 1.514 ppm2 1.710 CV 1
ASSI { 633} ((( segid " " and resid 497 and name HB3 )) ((( segid " " and resid 494 and name HA )) 5.700 4.100 0.300 peak 633 spectrum 1 weight 0.11000E+01 volume 0.33293E-04 ppm1 3.391 ppm2 2.056 CV 1
ASSI { 634} ((( segid " " and resid 468 and name HA )) ((( segid " " and resid 468 and name HG13)) 6.000 4.400 0.000 peak 634 spectrum 1 weight 0.11000E+01 volume 0.45249E-04 ppm1 3.481 ppm2 2.166 CV 1
ASSI { 655} ((( segid " " and resid 500 and name HB3 )) (( segid " " and resid 497 and name HD% )) 5.200 3.400 0.800 peak 655 spectrum 1 weight 0.11000E+01 volume 0.98348E-04 ppm1 2.240 ppm2 4.381 CV 1
ASSI { 657} ((( segid " " and resid 496 and name HB2 )) ((( segid " " and resid 493 and name HA )) 5.400 5.400 0.600 peak 657 spectrum 1 weight 0.11000E+01 volume 0.47926E-04 ppm1 2.107 ppm2 4.661 CV 1
ASSI { 658} ((( segid " " and resid 479 and name HB2 )) ((( segid " " and resid 480 and name HA )) 5.300 3.500 0.700 peak 658 spectrum 1 weight 0.11000E+01 volume 0.82699E-04 ppm1 2.054 ppm2 4.452 CV 1
ASSI { 659} ((( segid " " and resid 474 and name HB2 )) ((( segid " " and resid 477 and name HA )) 6.000 4.500 0.000 peak 659 spectrum 1 weight 0.11000E+01 volume 0.75161E-04 ppm1 2.107 ppm2 4.368 CV 1
ASSI { 667} ((( segid " " and resid 480 and name HB2 )) ((( segid " " and resid 480 and name HA )) 4.900 3.000 1.100 peak 667 spectrum 1 weight 0.11000E+01 volume 0.65885E-04 ppm1 3.456 ppm2 4.443 CV 1
ASSI { 669} ((( segid " " and resid 480 and name HB2 )) ((( segid " " and resid 477 and name HA )) 6.000 5.400 0.000 peak 669 spectrum 1 weight 0.11000E+01 volume 0.32773E-04 ppm1 3.441 ppm2 4.373 CV 1
ASSI { 670} ((( segid " " and resid 497 and name HB3 )) (( segid " " and resid 497 and name HE% )) 6.000 4.500 0.000 peak 670 spectrum 1 weight 0.11000E+01 volume 0.88394E-04 ppm1 3.394 ppm2 4.385 CV 1
ASSI { 692} ((( segid " " and resid 464 and name HG12)) ((( segid " " and resid 464 and name HB )) 6.000 4.500 0.000 peak 692 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.165 ppm2 1.979 CV 1
ASSI { 716} ((( segid " " and resid 465 and name HB2 )) ((( segid " " and resid 465 and name HA )) 6.000 4.500 0.000 peak 716 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.988 ppm2 3.811 CV 1
ASSI { 720} ((( segid " " and resid 489 and name HB2 )) ((( segid " " and resid 489 and name HA )) 6.000 4.500 0.000 peak 720 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.960 ppm2 4.580 CV 1
ASSI { 722} ((( segid " " and resid 472 and name HG2 )) ((( segid " " and resid 472 and name HA )) 6.000 4.500 0.000 peak 722 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.773 ppm2 4.645 CV 1
ASSI { 734} ((( segid " " and resid 476 and name HB3 )) ((( segid " " and resid 476 and name HA )) 4.500 2.500 1.500 peak 734 spectrum 1 weight 0.11000E+01 volume 0.15742E-03 ppm1 2.759 ppm2 4.437 CV 1
ASSI { 735} ((( segid " " and resid 492 and name HB2 )) ((( segid " " and resid 492 and name HA )) 4.700 2.800 1.300 peak 735 spectrum 1 weight 0.11000E+01 volume 0.11846E-03 ppm1 2.707 ppm2 4.392 CV 1
ASSI { 736} ((( segid " " and resid 471 and name HB3 )) ((( segid " " and resid 471 and name HA )) 4.700 2.800 1.300 peak 736 spectrum 1 weight 0.11000E+01 volume 0.11373E-03 ppm1 4.205 ppm2 4.537 CV 1
ASSI { 741} ((( segid " " and resid 503 and name HB2 )) ((( segid " " and resid 503 and name HA )) 5.200 3.400 0.800 peak 741 spectrum 1 weight 0.11000E+01 volume 0.59104E-04 ppm1 2.030 ppm2 4.145 CV 1
ASSI { 745} ((( segid " " and resid 474 and name HB3 )) ((( segid " " and resid 474 and name HA )) 6.000 4.400 0.000 peak 745 spectrum 1 weight 0.11000E+01 volume 0.25029E-04 ppm1 2.107 ppm2 3.771 CV 1
ASSI { 3} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 498 and name HA )) 3.100 1.200 1.200 peak 3 spectrum 2 weight 0.11000E+01 volume 0.15212E-02 ppm1 8.988 ppm2 4.185 CV 1
ASSI { 4} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 499 and name HN )) 3.300 1.300 1.300 peak 4 spectrum 2 weight 0.11000E+01 volume 0.97708E-03 ppm1 8.987 ppm2 8.043 CV 1
ASSI { 6} ((( segid " " and resid 499 and name HN )) ((( segid " " and resid 496 and name HA )) 3.200 1.300 1.300 peak 6 spectrum 2 weight 0.11000E+01 volume 0.10363E-02 ppm1 8.044 ppm2 4.221 CV 1
ASSI { 8} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 497 and name HN )) 3.100 1.200 1.200 peak 8 spectrum 2 weight 0.11000E+01 volume 0.10889E-02 ppm1 8.988 ppm2 8.432 CV 1
ASSI { 82} ((( segid " " and resid 494 and name HN )) ((( segid " " and resid 493 and name HA )) 3.000 1.100 1.100 peak 82 spectrum 2 weight 0.11000E+01 volume 0.22343E-02 ppm1 8.329 ppm2 4.670 CV 1
ASSI { 105} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 477 and name HE )) 1.800 0.400 0.400 peak 105 spectrum 2 weight 0.11000E+01 volume 0.24010E-01 ppm1 7.398 ppm2 7.226 CV 1
ASSI { 106} ((( segid " " and resid 477 and name HE )) ((( segid " " and resid 477 and name HD3 )) 1.900 0.400 0.400 peak 106 spectrum 2 weight 0.11000E+01 volume 0.21621E-01 ppm1 7.222 ppm2 3.392 CV 1
ASSI { 109} (( segid " " and resid 480 and name HD% ) ((( segid " " and resid 480 and name HB2 )) 2.400 0.700 0.700 peak 109 spectrum 2 weight 0.11000E+01 volume 0.69009E-02 ppm1 7.197 ppm2 3.443 CV 1
ASSI { 112} (( segid " " and resid 480 and name HD% ) ((( segid " " and resid 480 and name HA )) 2.400 0.700 0.700 peak 112 spectrum 2 weight 0.11000E+01 volume 0.59529E-02 ppm1 7.195 ppm2 4.447 CV 1
ASSI { 113} (( segid " " and resid 480 and name HD% ) (( segid " " and resid 480 and name HE% )) 1.900 0.400 0.400 peak 113 spectrum 2 weight 0.11000E+01 volume 0.26475E-01 ppm1 7.193 ppm2 6.905 CV 1
ASSI { 123} (( segid " " and resid 497 and name HD% ) ((( segid " " and resid 497 and name HB3 )) 2.600 0.800 0.800 peak 123 spectrum 2 weight 0.11000E+01 volume 0.37702E-02 ppm1 7.266 ppm2 3.395 CV 1
ASSI { 137} ((( segid " " and resid 484 and name HN )) ((( segid " " and resid 483 and name HA )) 2.600 0.800 0.800 peak 137 spectrum 2 weight 0.11000E+01 volume 0.48934E-02 ppm1 7.751 ppm2 4.406 CV 1
ASSI { 141} ((( segid " " and resid 470 and name HN )) ((( segid " " and resid 470 and name HB2 )) 2.800 1.000 1.000 peak 141 spectrum 2 weight 0.11000E+01 volume 0.28824E-02 ppm1 8.177 ppm2 4.101 CV 1
ASSI { 147} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 468 and name HG13)) 2.400 0.700 0.700 peak 147 spectrum 2 weight 0.11000E+01 volume 0.58403E-02 ppm1 8.643 ppm2 1.055 CV 1
ASSI { 192} ((( segid " " and resid 486 and name HN )) ((( segid " " and resid 485 and name HG )) 6.000 5.100 0.000 peak 192 spectrum 2 weight 0.11000E+01 volume 0.29321E-04 ppm1 7.610 ppm2 1.278 CV 1
ASSI { 200} ((( segid " " and resid 479 and name HN )) ((( segid " " and resid 476 and name HA )) 5.700 4.100 0.300 peak 200 spectrum 2 weight 0.11000E+01 volume 0.40478E-04 ppm1 8.152 ppm2 4.459 CV 1
ASSI { 201} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 474 and name HA )) 6.000 4.400 0.000 peak 201 spectrum 2 weight 0.11000E+01 volume 0.40229E-04 ppm1 8.362 ppm2 3.943 CV 1
ASSI { 203} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 477 and name HG2 )) 6.000 5.200 0.000 peak 203 spectrum 2 weight 0.11000E+01 volume 0.72088E-04 ppm1 7.396 ppm2 1.494 CV 1
ASSI { 205} ((( segid " " and resid 475 and name HN )) ((( segid " " and resid 475 and name HG2 )) 5.200 3.300 0.800 peak 205 spectrum 2 weight 0.11000E+01 volume 0.79465E-04 ppm1 9.141 ppm2 2.518 CV 1
ASSI { 206} ((( segid " " and resid 475 and name HN )) ((( segid " " and resid 475 and name HB2 )) 4.500 2.500 1.500 peak 206 spectrum 2 weight 0.11000E+01 volume 0.16085E-03 ppm1 9.140 ppm2 2.216 CV 1
ASSI { 217} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 498 and name HB2 )) 4.800 2.900 1.200 peak 217 spectrum 2 weight 0.11000E+01 volume 0.11291E-03 ppm1 8.987 ppm2 3.626 CV 1
ASSI { 219} ((( segid " " and resid 500 and name HN )) ((( segid " " and resid 500 and name HB2 )) 4.200 4.200 1.800 peak 219 spectrum 2 weight 0.11000E+01 volume 0.14171E-03 ppm1 7.880 ppm2 2.308 CV 1
ASSI { 221} ((( segid " " and resid 496 and name HN )) ((( segid " " and resid 493 and name HA )) 5.400 3.700 0.600 peak 221 spectrum 2 weight 0.11000E+01 volume 0.56306E-04 ppm1 7.972 ppm2 4.668 CV 1
ASSI { 232} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 465 and name HG3 )) 6.000 6.000 0.000 peak 232 spectrum 2 weight 0.11000E+01 volume 0.17593E-04 ppm1 8.692 ppm2 1.677 CV 1
ASSI { 239} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 505 and name HG13)) 4.700 2.800 1.300 peak 239 spectrum 2 weight 0.11000E+01 volume 0.96389E-04 ppm1 8.456 ppm2 1.752 CV 1
ASSI { 245} ((( segid " " and resid 505 and name HN )) ((( segid " " and resid 504 and name HA )) 5.700 4.100 0.300 peak 245 spectrum 2 weight 0.11000E+01 volume 0.40553E-04 ppm1 8.454 ppm2 3.913 CV 1
ASSI { 246} ((( segid " " and resid 504 and name HN )) ((( segid " " and resid 503 and name HA )) 6.000 4.500 0.000 peak 246 spectrum 2 weight 0.11000E+01 volume 0.31632E-04 ppm1 8.032 ppm2 4.156 CV 1
ASSI { 250} ((( segid " " and resid 503 and name HN )) ((( segid " " and resid 503 and name HB3 )) 4.400 2.400 1.600 peak 250 spectrum 2 weight 0.11000E+01 volume 0.15848E-03 ppm1 7.365 ppm2 2.051 CV 1
ASSI { 255} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 499 and name HA )) 6.000 4.500 0.000 peak 255 spectrum 2 weight 0.11000E+01 volume 0.35458E-04 ppm1 8.295 ppm2 3.927 CV 1
ASSI { 262} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 497 and name HB3 )) 5.000 3.100 1.000 peak 262 spectrum 2 weight 0.11000E+01 volume 0.86175E-04 ppm1 8.988 ppm2 3.403 CV 1
ASSI { 263} ((( segid " " and resid 490 and name HN )) ((( segid " " and resid 489 and name HA )) 5.100 3.200 0.900 peak 263 spectrum 2 weight 0.11000E+01 volume 0.74471E-04 ppm1 8.386 ppm2 4.586 CV 1
ASSI { 264} ((( segid " " and resid 497 and name HN )) ((( segid " " and resid 496 and name HA )) 5.700 4.100 0.300 peak 264 spectrum 2 weight 0.11000E+01 volume 0.47187E-04 ppm1 8.433 ppm2 4.223 CV 1
ASSI { 279} ((( segid " " and resid 501 and name HN )) ((( segid " " and resid 500 and name HB2 )) 6.000 6.000 0.000 peak 279 spectrum 2 weight 0.11000E+01 volume 0.52852E-04 ppm1 8.601 ppm2 2.306 CV 1
ASSI { 280} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 481 and name HA )) 4.700 2.700 1.300 peak 280 spectrum 2 weight 0.11000E+01 volume 0.97305E-04 ppm1 8.576 ppm2 4.059 CV 1
ASSI { 307} ((( segid " " and resid 481 and name HB2 )) ((( segid " " and resid 483 and name HN )) 6.000 6.000 0.000 peak 307 spectrum 2 weight 0.11000E+01 volume 0.17319E-04 ppm1 7.997 ppm2 2.219 CV 1
ASSI { 308} ((( segid " " and resid 504 and name HN )) ((( segid " " and resid 503 and name HG3 )) 6.000 6.000 0.000 peak 308 spectrum 2 weight 0.11000E+01 volume 0.14437E-04 ppm1 8.037 ppm2 1.694 CV 1
ASSI { 309} (( segid " " and resid 497 and name HD% ) (( segid " " and resid 497 and name HE% )) 5.200 3.300 0.800 peak 309 spectrum 2 weight 0.11000E+01 volume 0.54766E-04 ppm1 7.267 ppm2 4.386 CV 1
ASSI { 313} (( segid " " and resid 480 and name HD% ) ((( segid " " and resid 481 and name HB2 )) 5.800 4.200 0.200 peak 313 spectrum 2 weight 0.11000E+01 volume 0.62095E-04 ppm1 7.196 ppm2 2.185 CV 1
ASSI { 314} (( segid " " and resid 497 and name HD% ) ((( segid " " and resid 497 and name HA )) 5.600 4.000 0.400 peak 314 spectrum 2 weight 0.11000E+01 volume 0.32676E-04 ppm1 7.268 ppm2 4.179 CV 1
ASSI { 322} (( segid " " and resid 480 and name HE% ) ((( segid " " and resid 480 and name HB2 )) 5.600 4.000 0.400 peak 322 spectrum 2 weight 0.11000E+01 volume 0.19307E-04 ppm1 6.904 ppm2 3.424 CV 1
ASSI { 325} (( segid " " and resid 497 and name HD% ) ((( segid " " and resid 496 and name HD2 )) 5.600 3.900 0.400 peak 325 spectrum 2 weight 0.11000E+01 volume 0.54517E-04 ppm1 7.265 ppm2 1.825 CV 1
ASSI { 327} ((( segid " " and resid 477 and name HE )) ((( segid " " and resid 477 and name HB2 )) 5.200 3.300 0.800 peak 327 spectrum 2 weight 0.11000E+01 volume 0.33396E-04 ppm1 7.226 ppm2 1.918 CV 1
ASSI { 329} ((( segid " " and resid 477 and name HN )) ((( segid " " and resid 475 and name HB2 )) 6.000 5.600 0.000 peak 329 spectrum 2 weight 0.11000E+01 volume 0.26488E-04 ppm1 7.399 ppm2 2.205 CV 1
ASSI { 338} ((( segid " " and resid 471 and name HA )) ((( segid " " and resid 468 and name HA )) 6.000 6.000 0.000 peak 338 spectrum 2 weight 0.11000E+01 volume 0.16698E-04 ppm1 4.541 ppm2 3.495 CV 1
ASSI { 348} ((( segid " " and resid 481 and name HA )) ((( segid " " and resid 485 and name HB2 )) 5.500 3.700 0.500 peak 348 spectrum 2 weight 0.11000E+01 volume 0.64782E-04 ppm1 4.066 ppm2 2.059 CV 1
ASSI { 356} ((( segid " " and resid 499 and name HA )) ((( segid " " and resid 499 and name HB2 )) 5.500 3.800 0.500 peak 356 spectrum 2 weight 0.11000E+01 volume 0.42963E-04 ppm1 3.922 ppm2 2.322 CV 1
ASSI { 359} ((( segid " " and resid 495 and name HA )) ((( segid " " and resid 499 and name HB2 )) 6.000 6.000 0.000 peak 359 spectrum 2 weight 0.11000E+01 volume 0.21419E-04 ppm1 4.384 ppm2 2.316 CV 1
ASSI { 361} ((( segid " " and resid 469 and name HA )) ((( segid " " and resid 479 and name HG2 )) 6.000 4.700 0.000 peak 361 spectrum 2 weight 0.11000E+01 volume 0.23134E-04 ppm1 4.022 ppm2 1.716 CV 1
ASSI { 362} ((( segid " " and resid 501 and name HA )) ((( segid " " and resid 501 and name HB2 )) 5.000 3.100 1.000 peak 362 spectrum 2 weight 0.11000E+01 volume 0.63711E-04 ppm1 3.892 ppm2 1.344 CV 1
ASSI { 371} ((( segid " " and resid 485 and name HA )) ((( segid " " and resid 485 and name HG )) 5.100 3.200 0.900 peak 371 spectrum 2 weight 0.11000E+01 volume 0.63463E-04 ppm1 3.389 ppm2 1.277 CV 1
ASSI { 375} ((( segid " " and resid 482 and name HG2 )) ((( segid " " and resid 468 and name HG13)) 4.900 3.000 1.100 peak 375 spectrum 2 weight 0.11000E+01 volume 0.46815E-04 ppm1 2.905 ppm2 1.056 CV 1
ASSI { 393} ((( segid " " and resid 478 and name HB3 )) ((( segid " " and resid 468 and name HG13)) 4.300 2.300 1.700 peak 393 spectrum 2 weight 0.11000E+01 volume 0.28367E-03 ppm1 2.133 ppm2 1.058 CV 1
ASSI { 399} ((( segid " " and resid 501 and name HG )) ((( segid " " and resid 501 and name HB3 )) 4.300 2.400 1.700 peak 399 spectrum 2 weight 0.11000E+01 volume 0.17515E-03 ppm1 1.985 ppm2 1.344 CV 1
ASSI { 406} ((( segid " " and resid 481 and name HB2 )) ((( segid " " and resid 477 and name HG3 )) 3.800 1.800 1.800 peak 406 spectrum 2 weight 0.11000E+01 volume 0.28267E-03 ppm1 2.199 ppm2 1.494 CV 1
ASSI { 418} ((( segid " " and resid 468 and name HB )) ((( segid " " and resid 482 and name HB2 )) 4.100 4.100 1.900 peak 418 spectrum 2 weight 0.11000E+01 volume 0.33175E-03 ppm1 2.232 ppm2 2.431 CV 1
ASSI { 422} ((( segid " " and resid 505 and name HB )) ((( segid " " and resid 505 and name HA )) 5.700 4.100 0.300 peak 422 spectrum 2 weight 0.11000E+01 volume 0.37074E-04 ppm1 2.044 ppm2 3.826 CV 1
ASSI { 432} ((( segid " " and resid 500 and name HA )) ((( segid " " and resid 500 and name HG2 )) 6.000 5.300 0.000 peak 432 spectrum 2 weight 0.11000E+01 volume 0.20351E-04 ppm1 4.108 ppm2 2.766 CV 1
ASSI { 436} ((( segid " " and resid 502 and name HA )) ((( segid " " and resid 502 and name HB )) 5.200 3.300 0.800 peak 436 spectrum 2 weight 0.11000E+01 volume 0.68109E-04 ppm1 3.614 ppm2 2.105 CV 1
ASSI { 439} ((( segid " " and resid 468 and name HA )) ((( segid " " and resid 468 and name HB )) 5.500 3.800 0.500 peak 439 spectrum 2 weight 0.11000E+01 volume 0.35558E-04 ppm1 3.499 ppm2 2.234 CV 1
ASSI { 440} ((( segid " " and resid 468 and name HA )) ((( segid " " and resid 469 and name HG2 )) 6.000 5.800 0.000 peak 440 spectrum 2 weight 0.11000E+01 volume 0.23755E-04 ppm1 3.487 ppm2 1.592 CV 1
ASSI { 441} ((( segid " " and resid 497 and name HB3 )) ((( segid " " and resid 488 and name HG12)) 5.400 3.700 0.600 peak 441 spectrum 2 weight 0.11000E+01 volume 0.24202E-04 ppm1 3.387 ppm2 1.554 CV 1
ASSI { 457} ((( segid " " and resid 477 and name HE )) ((( segid " " and resid 477 and name HG2 )) 6.000 4.800 0.000 peak 457 spectrum 2 weight 0.11000E+01 volume 0.30887E-04 ppm1 7.224 ppm2 1.493 CV 1
ASSI { 459} (( segid " " and resid 497 and name HD% ) ((( segid " " and resid 488 and name HG12)) 5.500 3.800 0.500 peak 459 spectrum 2 weight 0.11000E+01 volume 0.22488E-04 ppm1 7.267 ppm2 1.554 CV 1
ASSI { 460} ((( segid " " and resid 479 and name HG2 )) ((( segid " " and resid 478 and name HG2 )) 3.800 1.800 1.800 peak 460 spectrum 2 weight 0.11000E+01 volume 0.42369E-03 ppm1 1.695 ppm2 1.512 CV 1
ASSI { 472} ((( segid " " and resid 484 and name HG )) ((( segid " " and resid 484 and name HB2 )) 6.000 4.500 0.000 peak 472 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.502 ppm2 1.910 CV 1
ASSI { 475} ((( segid " " and resid 474 and name HB2 )) ((( segid " " and resid 474 and name HG2 )) 6.000 4.500 0.000 peak 475 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.098 ppm2 2.625 CV 1
ASSI { 481} ((( segid " " and resid 500 and name HN )) ((( segid " " and resid 500 and name HG2 )) 5.500 3.800 0.500 peak 481 spectrum 2 weight 0.11000E+01 volume 0.12767E-03 ppm1 7.882 ppm2 2.763 CV 1
ASSI { 483} ((( segid " " and resid 498 and name HN )) (( segid " " and resid 497 and name HD% )) 6.000 4.500 0.000 peak 483 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 8.990 ppm2 7.268 CV 1
ASSI { 485} ((( segid " " and resid 498 and name HN )) ((( segid " " and resid 499 and name HB2 )) 6.000 5.600 0.000 peak 485 spectrum 2 weight 0.11000E+01 volume 0.38713E-04 ppm1 8.987 ppm2 2.314 CV 1
ASSI { 487} ((( segid " " and resid 497 and name HN )) (( segid " " and resid 497 and name HD% )) 4.900 3.100 1.100 peak 487 spectrum 2 weight 0.11000E+01 volume 0.84089E-04 ppm1 8.434 ppm2 7.265 CV 1
ASSI { 496} ((( segid " " and resid 475 and name HN )) ((( segid " " and resid 474 and name HB3 )) 5.700 4.000 0.300 peak 496 spectrum 2 weight 0.11000E+01 volume 0.60185E-04 ppm1 9.134 ppm2 2.082 CV 1
ASSI { 497} ((( segid " " and resid 471 and name HN )) ((( segid " " and resid 471 and name HB2 )) 5.300 3.500 0.700 peak 497 spectrum 2 weight 0.11000E+01 volume 0.55732E-04 ppm1 7.543 ppm2 3.501 CV 1
ASSI { 508} ((( segid " " and resid 469 and name HA )) ((( segid " " and resid 468 and name HG13)) 4.500 2.500 1.500 peak 508 spectrum 2 weight 0.11000E+01 volume 0.23104E-03 ppm1 4.022 ppm2 1.050 CV 1
ASSI { 509} ((( segid " " and resid 482 and name HA )) ((( segid " " and resid 468 and name HG13)) 4.200 2.200 1.800 peak 509 spectrum 2 weight 0.11000E+01 volume 0.33133E-03 ppm1 4.112 ppm2 1.063 CV 1
ASSI { 511} ((( segid " " and resid 498 and name HA )) ((( segid " " and resid 464 and name HG13)) 4.700 2.800 1.300 peak 511 spectrum 2 weight 0.11000E+01 volume 0.14186E-03 ppm1 4.179 ppm2 1.141 CV 1
ASSI { 516} ((( segid " " and resid 478 and name HA )) ((( segid " " and resid 468 and name HG13)) 3.600 1.600 1.600 peak 516 spectrum 2 weight 0.11000E+01 volume 0.90452E-03 ppm1 3.770 ppm2 1.055 CV 1
ASSI { 523} ((( segid " " and resid 484 and name HA )) ((( segid " " and resid 487 and name HB2 )) 6.000 4.500 0.000 peak 523 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.045 ppm2 2.666 CV 1
ASSI { 525} ((( segid " " and resid 495 and name HA )) ((( segid " " and resid 463 and name HB )) 3.500 3.500 2.500 peak 525 spectrum 2 weight 0.11000E+01 volume 0.36579E-03 ppm1 4.399 ppm2 2.260 CV 1
ASSI { 526} ((( segid " " and resid 464 and name HA )) ((( segid " " and resid 467 and name HB )) 6.000 4.500 0.000 peak 526 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.583 ppm2 2.188 CV 1
ASSI { 533} ((( segid " " and resid 469 and name HA )) ((( segid " " and resid 469 and name HG3 )) 4.600 2.600 1.400 peak 533 spectrum 2 weight 0.11000E+01 volume 0.14733E-03 ppm1 4.018 ppm2 1.583 CV 1
ASSI { 534} ((( segid " " and resid 488 and name HA )) ((( segid " " and resid 488 and name HG12)) 4.400 2.400 1.600 peak 534 spectrum 2 weight 0.11000E+01 volume 0.13269E-03 ppm1 4.118 ppm2 1.556 CV 1
ASSI { 536} ((( segid " " and resid 479 and name HA )) ((( segid " " and resid 479 and name HG2 )) 4.200 2.200 1.800 peak 536 spectrum 2 weight 0.11000E+01 volume 0.22061E-03 ppm1 4.066 ppm2 1.724 CV 1
ASSI { 539} ((( segid " " and resid 505 and name HA )) ((( segid " " and resid 505 and name HG13)) 4.300 2.300 1.700 peak 539 spectrum 2 weight 0.11000E+01 volume 0.24744E-03 ppm1 3.832 ppm2 1.754 CV 1
ASSI { 548} ((( segid " " and resid 498 and name HA )) ((( segid " " and resid 501 and name HB3 )) 4.700 2.800 1.300 peak 548 spectrum 2 weight 0.11000E+01 volume 0.14064E-03 ppm1 4.182 ppm2 1.344 CV 1
ASSI { 549} ((( segid " " and resid 478 and name HA )) ((( segid " " and resid 477 and name HG3 )) 4.300 2.300 1.700 peak 549 spectrum 2 weight 0.11000E+01 volume 0.19618E-03 ppm1 3.762 ppm2 1.490 CV 1
ASSI { 550} ((( segid " " and resid 503 and name HA )) ((( segid " " and resid 503 and name HB2 )) 3.800 1.800 1.800 peak 550 spectrum 2 weight 0.11000E+01 volume 0.46827E-03 ppm1 4.149 ppm2 2.009 CV 1
ASSI { 555} ((( segid " " and resid 463 and name HA )) ((( segid " " and resid 463 and name HB )) 4.500 2.500 1.500 peak 555 spectrum 2 weight 0.11000E+01 volume 0.16440E-03 ppm1 3.817 ppm2 2.264 CV 1
ASSI { 559} ((( segid " " and resid 477 and name HA )) ((( segid " " and resid 477 and name HB2 )) 6.000 4.500 0.000 peak 559 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.360 ppm2 1.924 CV 1
ASSI { 563} ((( segid " " and resid 495 and name HA )) ((( segid " " and resid 498 and name HB2 )) 4.700 4.700 1.300 peak 563 spectrum 2 weight 0.11000E+01 volume 0.20239E-03 ppm1 4.400 ppm2 3.625 CV 1
ASSI { 564} ((( segid " " and resid 466 and name HB3 )) ((( segid " " and resid 463 and name HA )) 4.100 2.100 1.900 peak 564 spectrum 2 weight 0.11000E+01 volume 0.26903E-03 ppm1 4.179 ppm2 3.821 CV 1
ASSI { 568} ((( segid " " and resid 462 and name HB2 )) ((( segid " " and resid 462 and name HA )) 6.000 4.500 0.000 peak 568 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.995 ppm2 4.203 CV 1
ASSI { 570} ((( segid " " and resid 476 and name HB2 )) ((( segid " " and resid 475 and name HB2 )) 4.600 2.600 1.400 peak 570 spectrum 2 weight 0.11000E+01 volume 0.36883E-03 ppm1 2.776 ppm2 2.213 CV 1
ASSI { 573} ((( segid " " and resid 500 and name HG2 )) ((( segid " " and resid 499 and name HB2 )) 6.000 4.500 0.000 peak 573 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.760 ppm2 2.422 CV 1
ASSI { 583} ((( segid " " and resid 475 and name HG2 )) ((( segid " " and resid 475 and name HB2 )) 3.400 1.400 1.400 peak 583 spectrum 2 weight 0.11000E+01 volume 0.87643E-03 ppm1 2.519 ppm2 2.213 CV 1
ASSI { 593} ((( segid " " and resid 488 and name HB )) ((( segid " " and resid 488 and name HG12)) 3.400 1.400 1.400 peak 593 spectrum 2 weight 0.11000E+01 volume 0.77744E-03 ppm1 1.963 ppm2 1.562 CV 1
ASSI { 594} ((( segid " " and resid 496 and name HB2 )) ((( segid " " and resid 496 and name HG3 )) 3.200 1.300 1.300 peak 594 spectrum 2 weight 0.11000E+01 volume 0.92267E-03 ppm1 1.657 ppm2 1.831 CV 1
ASSI { 597} ((( segid " " and resid 479 and name HB2 )) ((( segid " " and resid 479 and name HG2 )) 6.000 4.500 0.000 peak 597 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.053 ppm2 1.736 CV 1
ASSI { 599} ((( segid " " and resid 485 and name HB3 )) ((( segid " " and resid 485 and name HG )) 4.400 2.400 1.600 peak 599 spectrum 2 weight 0.11000E+01 volume 0.16209E-03 ppm1 2.051 ppm2 1.285 CV 1
ASSI { 600} ((( segid " " and resid 504 and name HB )) ((( segid " " and resid 504 and name HG13)) 4.400 2.400 1.600 peak 600 spectrum 2 weight 0.11000E+01 volume 0.13992E-03 ppm1 2.171 ppm2 1.301 CV 1
ASSI { 613} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 468 and name HG13)) 5.300 3.500 0.700 peak 613 spectrum 2 weight 0.11000E+01 volume 0.14250E-03 ppm1 8.363 ppm2 1.058 CV 1
ASSI { 614} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 468 and name HG12)) 6.000 4.500 0.000 peak 614 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 8.362 ppm2 1.107 CV 1
ASSI { 616} (( segid " " and resid 497 and name HD% ) ((( segid " " and resid 488 and name HB )) 4.700 2.800 1.300 peak 616 spectrum 2 weight 0.11000E+01 volume 0.54766E-04 ppm1 7.268 ppm2 1.968 CV 1
ASSI { 621} ((( segid " " and resid 487 and name HN )) ((( segid " " and resid 485 and name HA )) 5.200 3.400 0.800 peak 621 spectrum 2 weight 0.11000E+01 volume 0.90496E-04 ppm1 7.397 ppm2 3.395 CV 1
ASSI { 625} ((( segid " " and resid 503 and name HN )) ((( segid " " and resid 499 and name HA )) 5.000 3.200 1.000 peak 625 spectrum 2 weight 0.11000E+01 volume 0.88587E-04 ppm1 7.363 ppm2 3.917 CV 1
ASSI { 626} ((( segid " " and resid 465 and name HN )) ((( segid " " and resid 464 and name HA )) 4.700 2.800 1.300 peak 626 spectrum 2 weight 0.11000E+01 volume 0.11544E-03 ppm1 8.695 ppm2 3.581 CV 1
ASSI { 627} ((( segid " " and resid 495 and name HN )) ((( segid " " and resid 494 and name HA )) 5.000 5.000 1.000 peak 627 spectrum 2 weight 0.11000E+01 volume 0.97504E-04 ppm1 8.076 ppm2 4.179 CV 1
ASSI { 628} ((( segid " " and resid 469 and name HN )) ((( segid " " and resid 465 and name HA )) 5.300 3.500 0.700 peak 628 spectrum 2 weight 0.11000E+01 volume 0.61129E-04 ppm1 8.641 ppm2 3.829 CV 1
ASSI { 631} ((( segid " " and resid 482 and name HN )) ((( segid " " and resid 468 and name HG13)) 4.300 2.300 1.700 peak 631 spectrum 2 weight 0.11000E+01 volume 0.29835E-03 ppm1 8.584 ppm2 1.057 CV 1
ASSI { 641} ((( segid " " and resid 482 and name HB2 )) ((( segid " " and resid 468 and name HG13)) 5.000 5.000 1.000 peak 641 spectrum 2 weight 0.11000E+01 volume 0.63811E-04 ppm1 2.432 ppm2 1.060 CV 1
ASSI { 649} ((( segid " " and resid 478 and name HN )) ((( segid " " and resid 473 and name HG )) 4.500 2.500 1.500 peak 649 spectrum 2 weight 0.11000E+01 volume 0.78395E-04 ppm1 8.363 ppm2 1.386 CV 1
ASSI { 652} ((( segid " " and resid 499 and name HA )) ((( segid " " and resid 502 and name HB )) 3.600 1.700 1.700 peak 652 spectrum 2 weight 0.11000E+01 volume 0.41541E-03 ppm1 3.936 ppm2 2.107 CV 1
ASSI { 660} ((( segid " " and resid 484 and name HN )) ((( segid " " and resid 483 and name HB )) 4.600 2.600 1.400 peak 660 spectrum 2 weight 0.11000E+01 volume 0.12419E-03 ppm1 7.746 ppm2 4.105 CV 1
ASSI { 668} ((( segid " " and resid 502 and name HA )) (( segid " " and resid 502 and name HG2%)) 3.400 1.500 1.500 peak 668 spectrum 2 weight 0.11000E+01 volume 0.81965E-03 ppm1 3.603 ppm2 0.959 CV 1
ASSI { 690} ((( segid " " and resid 502 and name HB )) (( segid " " and resid 502 and name HG1%)) 3.100 1.200 1.200 peak 690 spectrum 2 weight 0.11000E+01 volume 0.11330E-02 ppm1 2.104 ppm2 0.959 CV 1
ASSI { 691} ((( segid " " and resid 496 and name HD2 )) ((( segid " " and resid 503 and name HD2 )) 6.000 4.500 0.000 peak 691 spectrum 2 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.833 ppm2 1.000 CV 1
ASSI { 698} ((( segid " " and resid 501 and name HN )) (( segid " " and resid 502 and name HG2%)) 4.300 2.300 1.700 peak 698 spectrum 2 weight 0.11000E+01 volume 0.52077E-03 ppm1 8.597 ppm2 0.948 CV 1
ASSI { 700} ((( segid " " and resid 467 and name HB )) ((( segid " " and resid 467 and name HG12)) 4.200 2.300 1.800 peak 700 spectrum 2 weight 0.11000E+01 volume 0.14921E-03 ppm1 2.201 ppm2 1.988 CV 1
ASSI { 704} ((( segid " " and resid 503 and name HB2 )) ((( segid " " and resid 503 and name HG2 )) 4.600 2.600 1.400 peak 704 spectrum 2 weight 0.10000E+01 volume 0.25946E-03 ppm1 2.001 ppm2 1.683 CV 1
ASSI { 709} ((( segid " " and resid 469 and name HD2 )) ((( segid " " and resid 469 and name HG3 )) 3.400 1.400 1.400 peak 709 spectrum 2 weight 0.11000E+01 volume 0.75410E-03 ppm1 1.745 ppm2 1.577 CV 1
ASSI { 712} ((( segid " " and resid 481 and name HN )) ((( segid " " and resid 477 and name HG2 )) 3.500 1.500 1.500 peak 712 spectrum 2 weight 0.11000E+01 volume 0.32795E-03 ppm1 8.578 ppm2 1.493 CV 1
ASSI { 713} ((( segid " " and resid 502 and name HN )) ((( segid " " and resid 505 and name HG13)) 5.100 3.300 0.900 peak 713 spectrum 2 weight 0.11000E+01 volume 0.10287E-03 ppm1 8.292 ppm2 1.756 CV 1
ASSI { 731} ((( segid " " and resid 488 and name HA )) ((( segid " " and resid 488 and name HB )) 4.200 2.200 1.800 peak 731 spectrum 2 weight 0.11000E+01 volume 0.25301E-03 ppm1 4.120 ppm2 1.957 CV 1
ASSI { 732} ((( segid " " and resid 483 and name HA )) ((( segid " " and resid 483 and name HB )) 3.900 1.900 1.900 peak 732 spectrum 2 weight 0.11000E+01 volume 0.38629E-03 ppm1 4.397 ppm2 4.106 CV 1
ASSI { 733} ((( segid " " and resid 488 and name HA )) ((( segid " " and resid 485 and name HB3 )) 4.600 2.700 1.400 peak 733 spectrum 2 weight 0.11000E+01 volume 0.43641E-03 ppm1 4.115 ppm2 2.049 CV 1
ASSI { 735} ((( segid " " and resid 481 and name HA )) ((( segid " " and resid 485 and name HA )) 5.300 3.600 0.700 peak 735 spectrum 2 weight 0.11000E+01 volume 0.84040E-04 ppm1 4.064 ppm2 3.379 CV 1
ASSI { 736} ((( segid " " and resid 482 and name HA )) ((( segid " " and resid 482 and name HG2 )) 4.700 2.700 1.300 peak 736 spectrum 2 weight 0.11000E+01 volume 0.15319E-03 ppm1 4.110 ppm2 2.902 CV 1
ASSI { 737} ((( segid " " and resid 487 and name HN )) ((( segid " " and resid 488 and name HG12)) 6.000 5.300 0.000 peak 737 spectrum 2 weight 0.11000E+01 volume 0.41273E-04 ppm1 7.411 ppm2 1.558 CV 1
ASSI { 748} ((( segid " " and resid 485 and name HN )) ((( segid " " and resid 468 and name HG12)) 4.700 2.700 1.300 peak 748 spectrum 2 weight 0.11000E+01 volume 0.59087E-04 ppm1 7.929 ppm2 1.063 CV 1
ASSI { 749} ((( segid " " and resid 501 and name HA )) ((( segid " " and resid 504 and name HB )) 3.600 1.700 1.700 peak 749 spectrum 2 weight 0.10000E+01 volume 0.33088E-03 ppm1 3.891 ppm2 2.164 CV 1
ASSI { 750} (( segid " " and resid 480 and name HE% ) ((( segid " " and resid 481 and name HB2 )) 5.900 4.300 0.100 peak 750 spectrum 2 weight 0.11000E+01 volume 0.70521E-04 ppm1 6.904 ppm2 2.168 CV 1
ASSI { 752} ((( segid " " and resid 467 and name HB )) (( segid " " and resid 502 and name HG2%)) 3.200 3.200 2.800 peak 752 spectrum 2 weight 0.11000E+01 volume 0.16335E-02 ppm1 2.188 ppm2 0.941 CV 1
ASSI { 754} ((( segid " " and resid 483 and name HN )) ((( segid " " and resid 481 and name HA )) 5.100 5.100 0.900 peak 754 spectrum 2 weight 0.11000E+01 volume 0.10262E-03 ppm1 8.000 ppm2 4.054 CV 1
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