NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
17845 |
2d82   |
6960 | cing | 1-original | 5 | XPLOR/CNS | distance | NOE | simple |
!
!The last digit in peak ID is the spectrum number
ASSI { 03}
(( segid "PROT" and resid 77 and name HE1 ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 03 weight 0.1000E+01 volume 360.32990 ppm1 6.604 ppm2 6.710
ASSI { 23}
(( segid "PROT" and resid 35 and name HZ ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 23 weight 0.1000E+01 volume 29.26870 ppm1 7.016 ppm2 7.399
ASSI { 33}
(( segid "PROT" and resid 26 and name HE1 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 33 weight 0.1000E+01 volume 858.95251 ppm1 6.592 ppm2 6.937
ASSI { 43}
(( segid "PROT" and resid 49 and name HE1 ))
(( segid "PROT" and resid 49 and name HD1 ))
6 6 0 peak 43 weight 0.1000E+01 volume 24.16150 ppm1 6.126 ppm2 5.400
ASSI { 53}
(( segid "PROT" and resid 91 and name HE1 ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 53 weight 0.1000E+01 volume 279.32040 ppm1 6.695 ppm2 6.925
ASSI { 63}
(( segid "PROT" and resid 109 and name HE1 ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 63 weight 0.1000E+01 volume 177.67349 ppm1 7.176 ppm2 7.034
ASSI { 73}
(( segid "PROT" and resid 101 and name HZ ))
(( segid "PROT" and resid 101 and name HE1 ))
6 6 0 peak 73 weight 0.1000E+01 volume 694.11133 ppm1 7.122 ppm2 7.305
ASSI { 83}
(( segid "PROT" and resid 101 and name HD1 ))
(( segid "PROT" and resid 101 and name HE1 ))
6 6 0 peak 83 weight 0.1000E+01 volume 407.26410 ppm1 7.078 ppm2 7.302
ASSI { 93}
(( segid "PROT" and resid 109 and name HZ ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 93 weight 0.1000E+01 volume 111.21780 ppm1 6.835 ppm2 7.180
ASSI { 103}
(( segid "PROT" and resid 35 and name HZ ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 103 weight 0.1000E+01 volume 393.20251 ppm1 7.018 ppm2 7.341
ASSI { 113}
(( segid "PROT" and resid 101 and name HE1 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 113 weight 0.1000E+01 volume 525.34351 ppm1 7.299 ppm2 7.091
ASSI { 123}
(( segid "PROT" and resid 101 and name HA ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 123 weight 0.1000E+01 volume 104.53210 ppm1 4.486 ppm2 7.083
ASSI { 133}
(( segid "PROT" and resid 85 and name HA ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 133 weight 0.1000E+01 volume 157.45720 ppm1 4.173 ppm2 6.048
ASSI { 143}
(( segid "PROT" and resid 101 and name HE1 ))
(( segid "PROT" and resid 101 and name HZ ))
6 6 0 peak 143 weight 0.1000E+01 volume 471.72031 ppm1 7.299 ppm2 7.130
ASSI { 153}
(( segid "PROT" and resid 109 and name HE1 ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 153 weight 0.1000E+01 volume 112.35230 ppm1 7.176 ppm2 6.846
ASSI { 163}
(( segid "PROT" and resid 35 and name HE1 ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 163 weight 0.1000E+01 volume 344.82990 ppm1 7.337 ppm2 7.019
ASSI { 173}
(( segid "PROT" and resid 102 and name HA ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 173 weight 0.1000E+01 volume 46.63500 ppm1 3.226 ppm2 7.024
ASSI { 183}
(( segid "PROT" and resid 82 and name HB2 ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 183 weight 0.1000E+01 volume 52.46980 ppm1 3.083 ppm2 7.467
ASSI { 193}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 193 weight 0.1000E+01 volume 101.85690 ppm1 0.889 ppm2 6.073
ASSI { 203}
(( segid "PROT" and resid 82 and name HZ2 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 203 weight 0.1000E+01 volume 402.64359 ppm1 7.708 ppm2 7.467
ASSI { 213}
(( segid "PROT" and resid 75 and name HZ2 ))
(( segid "PROT" and resid 75 and name HH2 ))
6 6 0 peak 213 weight 0.1000E+01 volume 553.00739 ppm1 7.473 ppm2 7.250
ASSI { 223}
(( segid "PROT" and resid 82 and name HH2 ))
(( segid "PROT" and resid 89 and name HH2 ))
6 6 0 peak 223 weight 0.1000E+01 volume 45.19910 ppm1 7.491 ppm2 6.969
ASSI { 233}
(( segid "PROT" and resid 89 and name HZ3 ))
(( segid "PROT" and resid 89 and name HH2 ))
6 6 0 peak 233 weight 0.1000E+01 volume 47.52040 ppm1 7.235 ppm2 6.968
ASSI { 243}
(( segid "PROT" and resid 75 and name HE3 ))
(( segid "PROT" and resid 75 and name HZ3 ))
6 6 0 peak 243 weight 0.1000E+01 volume 341.10309 ppm1 7.537 ppm2 7.180
ASSI { 253}
(( segid "PROT" and resid 82 and name HE3 ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 253 weight 0.1000E+01 volume 145.51089 ppm1 7.884 ppm2 7.498
ASSI { 263}
(( segid "PROT" and resid 89 and name HZ3 ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 263 weight 0.1000E+01 volume 35.12580 ppm1 7.240 ppm2 7.502
ASSI { 273}
(( segid "PROT" and resid 89 and name HH2 ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 273 weight 0.1000E+01 volume 119.33470 ppm1 6.956 ppm2 7.500
ASSI { 283}
(( segid "PROT" and resid 75 and name HZ3 ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 283 weight 0.1000E+01 volume 290.83221 ppm1 7.170 ppm2 7.540
ASSI { 293}
(( segid "PROT" and resid 82 and name HZ3 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 293 weight 0.1000E+01 volume 262.06531 ppm1 7.490 ppm2 7.888
ASSI { 313}
(( segid "PROT" and resid 91 and name HD1 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 313 weight 0.1000E+01 volume 255.35291 ppm1 6.921 ppm2 6.693
ASSI { 323}
(( segid "PROT" and resid 109 and name HE1 ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 323 weight 0.1000E+01 volume 53.00630 ppm1 7.176 ppm2 6.605
ASSI { 333}
(( segid "PROT" and resid 109 and name HZ ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 333 weight 0.1000E+01 volume 92.99380 ppm1 6.847 ppm2 6.606
ASSI { 343}
(( segid "PROT" and resid 26 and name HD1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 343 weight 0.1000E+01 volume 1003.55219 ppm1 6.928 ppm2 6.602
ASSI { 353}
(( segid "PROT" and resid 35 and name HE1 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 353 weight 0.1000E+01 volume 109.10160 ppm1 7.389 ppm2 6.142
ASSI { 363}
(( segid "PROT" and resid 91 and name HD1 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 363 weight 0.1000E+01 volume 45.54350 ppm1 6.925 ppm2 6.144
ASSI { 373}
(( segid "PROT" and resid 49 and name HD1 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 373 weight 0.1000E+01 volume 149.37740 ppm1 5.407 ppm2 6.138
ASSI { 383}
(( segid "PROT" and resid 82 and name HH2 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 383 weight 0.1000E+01 volume 517.71143 ppm1 7.459 ppm2 7.711
ASSI { 393}
(( segid "PROT" and resid 75 and name HH2 ))
(( segid "PROT" and resid 75 and name HZ2 ))
6 6 0 peak 393 weight 0.1000E+01 volume 387.80649 ppm1 7.245 ppm2 7.478
ASSI { 403}
(( segid "PROT" and resid 77 and name HB2 ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 403 weight 0.1000E+01 volume 166.28860 ppm1 1.762 ppm2 6.705
ASSI { 413}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 413 weight 0.1000E+01 volume 155.58611 ppm1 1.151 ppm2 6.712
ASSI { 423}
(( segid "PROT" and resid 18 and name HD2# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 423 weight 0.1000E+01 volume 24.91960 ppm1 0.495 ppm2 6.708
ASSI { 433}
(( segid "PROT" and resid 18 and name HD1# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 433 weight 0.1000E+01 volume 60.00310 ppm1 0.224 ppm2 6.706
ASSI { 443}
(( segid "PROT" and resid 22 and name HG ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 443 weight 0.1000E+01 volume 201.22240 ppm1 1.847 ppm2 6.932
ASSI { 453}
(( segid "PROT" and resid 22 and name HD1# ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 453 weight 0.1000E+01 volume 204.04240 ppm1 1.089 ppm2 6.939
ASSI { 463}
(( segid "PROT" and resid 105 and name HD1# ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 463 weight 0.1000E+01 volume 76.45090 ppm1 0.372 ppm2 7.399
ASSI { 473}
(( segid "PROT" and resid 52 and name HG2# ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 473 weight 0.1000E+01 volume 203.09460 ppm1 0.987 ppm2 6.923
ASSI { 483}
(( segid "PROT" and resid 98 and name HG1# ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 483 weight 0.1000E+01 volume 58.39920 ppm1 0.826 ppm2 6.923
ASSI { 493}
(( segid "PROT" and resid 59 and name HD2# ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 493 weight 0.1000E+01 volume 52.18500 ppm1 0.569 ppm2 6.929
ASSI { 503}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 503 weight 0.1000E+01 volume 49.62030 ppm1 0.884 ppm2 7.034
ASSI { 513}
(( segid "PROT" and resid 113 and name HD1# ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 513 weight 0.1000E+01 volume 47.77270 ppm1 0.875 ppm2 7.179
ASSI { 523}
(( segid "PROT" and resid 88 and name HB# ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 523 weight 0.1000E+01 volume 371.62430 ppm1 1.740 ppm2 7.348
ASSI { 533}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 533 weight 0.1000E+01 volume 394.55231 ppm1 1.251 ppm2 7.467
ASSI { 543}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 543 weight 0.1000E+01 volume 30.05340 ppm1 0.909 ppm2 7.463
ASSI { 553}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 89 and name HH2 ))
6 6 0 peak 553 weight 0.1000E+01 volume 63.13680 ppm1 0.911 ppm2 6.966
ASSI { 563}
(( segid "PROT" and resid 52 and name HG2# ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 563 weight 0.1000E+01 volume 80.19500 ppm1 0.983 ppm2 6.699
ASSI { 573}
(( segid "PROT" and resid 52 and name HD1# ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 573 weight 0.1000E+01 volume 102.77530 ppm1 0.905 ppm2 6.696
ASSI { 583}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 583 weight 0.1000E+01 volume 98.71250 ppm1 1.153 ppm2 6.601
ASSI { 593}
(( segid "PROT" and resid 113 and name HD1# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 593 weight 0.1000E+01 volume 107.24310 ppm1 0.873 ppm2 6.604
ASSI { 603}
(( segid "PROT" and resid 18 and name HD2# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 603 weight 0.1000E+01 volume 16.83300 ppm1 0.491 ppm2 6.603
ASSI { 613}
(( segid "PROT" and resid 63 and name HB1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 613 weight 0.1000E+01 volume 128.71291 ppm1 1.993 ppm2 6.600
ASSI { 623}
(( segid "PROT" and resid 36 and name HB2 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 623 weight 0.1000E+01 volume 251.29359 ppm1 1.874 ppm2 6.598
ASSI { 633}
(( segid "PROT" and resid 77 and name HB2 ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 633 weight 0.1000E+01 volume 11.81070 ppm1 1.760 ppm2 6.603
ASSI { 643}
(( segid "PROT" and resid 59 and name HB2 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 643 weight 0.1000E+01 volume 107.11890 ppm1 1.307 ppm2 6.600
ASSI { 653}
(( segid "PROT" and resid 22 and name HD1# ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 653 weight 0.1000E+01 volume 392.56369 ppm1 1.088 ppm2 6.599
ASSI { 663}
(( segid "PROT" and resid 113 and name HG2# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 663 weight 0.1000E+01 volume 30.38270 ppm1 0.720 ppm2 6.604
ASSI { 673}
(( segid "PROT" and resid 59 and name HD1# ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 673 weight 0.1000E+01 volume 100.70610 ppm1 0.221 ppm2 6.599
ASSI { 683}
(( segid "PROT" and resid 39 and name HG1# ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 683 weight 0.1000E+01 volume 82.65160 ppm1 0.723 ppm2 6.141
ASSI { 693}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 89 and name HZ2 ))
6 6 0 peak 693 weight 0.1000E+01 volume 179.43581 ppm1 0.910 ppm2 6.952
ASSI { 703}
(( segid "PROT" and resid 103 and name HA ))
(( segid "PROT" and resid 89 and name HZ2 ))
6 6 0 peak 703 weight 0.1000E+01 volume 59.76920 ppm1 4.436 ppm2 6.952
ASSI { 713}
(( segid "PROT" and resid 88 and name HB# ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 713 weight 0.1000E+01 volume 9.54920 ppm1 1.740 ppm2 7.024
ASSI { 723}
(( segid "PROT" and resid 98 and name HG1# ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 723 weight 0.1000E+01 volume 13.20740 ppm1 0.782 ppm2 7.024
ASSI { 733}
(( segid "PROT" and resid 82 and name HA ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 733 weight 0.1000E+01 volume 9.40450 ppm1 3.975 ppm2 7.467
ASSI { 743}
(( segid "PROT" and resid 82 and name HB1 ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 743 weight 0.1000E+01 volume 28.15650 ppm1 3.262 ppm2 7.472
ASSI { 753}
(( segid "PROT" and resid 91 and name HE1 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 753 weight 0.1000E+01 volume 9.46650 ppm1 6.692 ppm2 6.141
ASSI { 763}
(( segid "PROT" and resid 56 and name HA ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 763 weight 0.1000E+01 volume 3.03520 ppm1 4.117 ppm2 6.140
ASSI { 773}
(( segid "PROT" and resid 49 and name HA ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 773 weight 0.1000E+01 volume 8.38550 ppm1 3.577 ppm2 6.139
ASSI { 783}
(( segid "PROT" and resid 91 and name HB2 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 783 weight 0.1000E+01 volume 5.32280 ppm1 2.887 ppm2 6.127
ASSI { 793}
(( segid "PROT" and resid 91 and name HB1 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 793 weight 0.1000E+01 volume 2.00880 ppm1 2.979 ppm2 6.129
ASSI { 803}
(( segid "PROT" and resid 49 and name HB1 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 803 weight 0.1000E+01 volume 4.38020 ppm1 2.732 ppm2 6.140
ASSI { 813}
(( segid "PROT" and resid 56 and name HB1 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 813 weight 0.1000E+01 volume 6.78070 ppm1 2.432 ppm2 6.141
ASSI { 823}
(( segid "PROT" and resid 56 and name HB2 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 823 weight 0.1000E+01 volume 13.17170 ppm1 2.126 ppm2 6.141
ASSI { 833}
(( segid "PROT" and resid 49 and name HB2 ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 833 weight 0.1000E+01 volume 14.76310 ppm1 1.967 ppm2 6.142
ASSI { 843}
(( segid "PROT" and resid 49 and name HE1 ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 843 weight 0.1000E+01 volume 11.76440 ppm1 6.136 ppm2 6.928
ASSI { 853}
(( segid "PROT" and resid 49 and name HD1 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 853 weight 0.1000E+01 volume 3.42210 ppm1 5.417 ppm2 7.419
ASSI { 863}
(( segid "PROT" and resid 49 and name HE1 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 863 weight 0.1000E+01 volume 13.24090 ppm1 6.137 ppm2 7.414
ASSI { 873}
(( segid "PROT" and resid 50 and name HA ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 873 weight 0.1000E+01 volume 81.16650 ppm1 4.965 ppm2 7.425
ASSI { 883}
(( segid "PROT" and resid 50 and name HB1 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 883 weight 0.1000E+01 volume 37.69850 ppm1 3.459 ppm2 7.426
ASSI { 893}
(( segid "PROT" and resid 50 and name HB2 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 893 weight 0.1000E+01 volume 18.51510 ppm1 2.923 ppm2 7.420
ASSI { 903}
(( segid "PROT" and resid 35 and name HE1 ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 903 weight 0.1000E+01 volume 297.80399 ppm1 7.333 ppm2 7.397
ASSI { 913}
(( segid "PROT" and resid 32 and name HA ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 913 weight 0.1000E+01 volume 55.12980 ppm1 4.348 ppm2 7.402
ASSI { 923}
(( segid "PROT" and resid 35 and name HA ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 923 weight 0.1000E+01 volume 62.60780 ppm1 4.735 ppm2 7.396
ASSI { 933}
(( segid "PROT" and resid 100 and name HA ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 933 weight 0.1000E+01 volume 6.27260 ppm1 4.300 ppm2 7.115
ASSI { 943}
(( segid "PROT" and resid 89 and name HD1 ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 943 weight 0.1000E+01 volume 11.27490 ppm1 5.003 ppm2 7.115
ASSI { 953}
(( segid "PROT" and resid 99 and name HA ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 953 weight 0.1000E+01 volume 10.89360 ppm1 3.768 ppm2 7.122
ASSI { 963}
(( segid "PROT" and resid 49 and name HD1 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 963 weight 0.1000E+01 volume 5.37280 ppm1 5.408 ppm2 6.700
ASSI { 973}
(( segid "PROT" and resid 49 and name HE1 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 973 weight 0.1000E+01 volume 11.05110 ppm1 6.138 ppm2 6.700
ASSI { 983}
(( segid "PROT" and resid 49 and name HA ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 983 weight 0.1000E+01 volume 22.01280 ppm1 3.567 ppm2 6.696
ASSI { 993}
(( segid "PROT" and resid 91 and name HA ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 993 weight 0.1000E+01 volume 15.59940 ppm1 3.994 ppm2 6.701
ASSI { 1003}
(( segid "PROT" and resid 91 and name HB2 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 1003 weight 0.1000E+01 volume 11.38730 ppm1 2.889 ppm2 6.699
ASSI { 1013}
(( segid "PROT" and resid 91 and name HB1 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 1013 weight 0.1000E+01 volume 3.01630 ppm1 2.962 ppm2 6.698
ASSI { 1023}
(( segid "PROT" and resid 91 and name HA ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 1023 weight 0.1000E+01 volume 78.02820 ppm1 4.003 ppm2 6.928
ASSI { 1033}
(( segid "PROT" and resid 77 and name HA ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 1033 weight 0.1000E+01 volume 39.07370 ppm1 3.375 ppm2 6.710
ASSI { 1043}
(( segid "PROT" and resid 18 and name HA ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 1043 weight 0.1000E+01 volume 4.49950 ppm1 4.180 ppm2 6.716
ASSI { 1053}
(( segid "PROT" and resid 26 and name HA ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 1053 weight 0.1000E+01 volume 36.75700 ppm1 3.698 ppm2 6.933
ASSI { 1063}
(( segid "PROT" and resid 9 and name HA ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 1063 weight 0.1000E+01 volume 38.15110 ppm1 4.629 ppm2 7.317
ASSI { 1073}
(( segid "PROT" and resid 8 and name HA ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 1073 weight 0.1000E+01 volume 6.92420 ppm1 4.268 ppm2 7.314
ASSI { 1083}
(( segid "PROT" and resid 101 and name HA ))
(( segid "PROT" and resid 101 and name HE1 ))
6 6 0 peak 1083 weight 0.1000E+01 volume 12.75670 ppm1 4.487 ppm2 7.298
ASSI { 1093}
(( segid "PROT" and resid 79 and name HA ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 1093 weight 0.1000E+01 volume 13.08390 ppm1 4.542 ppm2 7.463
ASSI { 1103}
(( segid "PROT" and resid 103 and name HA ))
(( segid "PROT" and resid 89 and name HH2 ))
6 6 0 peak 1103 weight 0.1000E+01 volume 25.44920 ppm1 4.438 ppm2 6.968
ASSI { 1113}
(( segid "PROT" and resid 81 and name HG1# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 1113 weight 0.1000E+01 volume 3.37780 ppm1 -0.273 ppm2 6.714
ASSI { 1123}
(( segid "PROT" and resid 109 and name HE1 ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 1123 weight 0.1000E+01 volume 11.66760 ppm1 7.173 ppm2 6.708
ASSI { 1133}
(( segid "PROT" and resid 71 and name HD1 ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 1133 weight 0.1000E+01 volume 18.45030 ppm1 6.841 ppm2 6.712
ASSI { 1143}
(( segid "PROT" and resid 81 and name HG1# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 1143 weight 0.1000E+01 volume 9.75910 ppm1 -0.268 ppm2 6.607
ASSI { 1153}
(( segid "PROT" and resid 109 and name HD1 ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 1153 weight 0.1000E+01 volume 4.55600 ppm1 7.016 ppm2 6.712
ASSI { 1163}
(( segid "PROT" and resid 77 and name HE1 ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 1163 weight 0.1000E+01 volume 11.45100 ppm1 6.599 ppm2 7.180
ASSI { 1173}
(( segid "PROT" and resid 85 and name HE1 ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 1173 weight 0.1000E+01 volume 4.43070 ppm1 6.050 ppm2 7.173
ASSI { 1183}
(( segid "PROT" and resid 110 and name HA ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 1183 weight 0.1000E+01 volume 7.37140 ppm1 4.027 ppm2 7.179
ASSI { 1203}
(( segid "PROT" and resid 78 and name HA ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 1203 weight 0.1000E+01 volume 14.32500 ppm1 3.050 ppm2 7.180
ASSI { 1213}
(( segid "PROT" and resid 85 and name HE1 ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 1213 weight 0.1000E+01 volume 19.26020 ppm1 6.049 ppm2 7.032
ASSI { 1223}
(( segid "PROT" and resid 109 and name HA ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 1223 weight 0.1000E+01 volume 36.61200 ppm1 4.020 ppm2 7.037
ASSI { 1233}
(( segid "PROT" and resid 109 and name HB1 ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 1233 weight 0.1000E+01 volume 18.70750 ppm1 3.328 ppm2 7.033
ASSI { 1243}
(( segid "PROT" and resid 109 and name HB2 ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 1243 weight 0.1000E+01 volume 27.19210 ppm1 3.053 ppm2 7.036
ASSI { 1253}
(( segid "PROT" and resid 81 and name HG1# ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 1253 weight 0.1000E+01 volume 8.89570 ppm1 -0.261 ppm2 7.177
ASSI { 1263}
(( segid "PROT" and resid 81 and name HG1# ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1263 weight 0.1000E+01 volume 13.32840 ppm1 -0.273 ppm2 6.841
ASSI { 1273}
(( segid "PROT" and resid 109 and name HD1 ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1273 weight 0.1000E+01 volume 16.86410 ppm1 7.034 ppm2 6.841
ASSI { 1283}
(( segid "PROT" and resid 77 and name HD1 ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1283 weight 0.1000E+01 volume 9.63020 ppm1 6.707 ppm2 6.844
ASSI { 1293}
(( segid "PROT" and resid 77 and name HE1 ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1293 weight 0.1000E+01 volume 13.34750 ppm1 6.607 ppm2 6.848
ASSI { 1303}
(( segid "PROT" and resid 109 and name HZ ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 1303 weight 0.1000E+01 volume 12.78380 ppm1 6.834 ppm2 7.032
ASSI { 1313}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 1313 weight 0.1000E+01 volume 9.70360 ppm1 -1.498 ppm2 7.037
ASSI { 1323}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 1323 weight 0.1000E+01 volume 13.13480 ppm1 -1.510 ppm2 7.175
ASSI { 1333}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1333 weight 0.1000E+01 volume 5.29630 ppm1 -1.515 ppm2 6.843
ASSI { 1343}
(( segid "PROT" and resid 113 and name HG2# ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1343 weight 0.1000E+01 volume 15.60040 ppm1 0.707 ppm2 6.845
ASSI { 1353}
(( segid "PROT" and resid 113 and name HD1# ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1353 weight 0.1000E+01 volume 18.85260 ppm1 0.871 ppm2 6.848
ASSI { 1363}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1363 weight 0.1000E+01 volume 28.61850 ppm1 1.098 ppm2 6.846
ASSI { 1373}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1373 weight 0.1000E+01 volume 14.04240 ppm1 1.250 ppm2 6.848
ASSI { 1383}
(( segid "PROT" and resid 78 and name HA ))
(( segid "PROT" and resid 109 and name HZ ))
6 6 0 peak 1383 weight 0.1000E+01 volume 21.64650 ppm1 3.052 ppm2 6.851
ASSI { 1393}
(( segid "PROT" and resid 82 and name HA ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 1393 weight 0.1000E+01 volume 18.15070 ppm1 3.975 ppm2 6.050
ASSI { 1403}
(( segid "PROT" and resid 89 and name HH2 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 1403 weight 0.1000E+01 volume 9.73810 ppm1 7.011 ppm2 6.047
ASSI { 1413}
(( segid "PROT" and resid 82 and name HZ3 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 1413 weight 0.1000E+01 volume 8.71240 ppm1 7.465 ppm2 6.047
ASSI { 1423}
(( segid "PROT" and resid 82 and name HE3 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 1423 weight 0.1000E+01 volume 11.77730 ppm1 7.877 ppm2 6.048
ASSI { 1433}
(( segid "PROT" and resid 85 and name HB1 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 1433 weight 0.1000E+01 volume 18.92570 ppm1 2.475 ppm2 6.047
ASSI { 1443}
(( segid "PROT" and resid 85 and name HD1 ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 1443 weight 0.1000E+01 volume 4.28080 ppm1 6.056 ppm2 7.342
ASSI { 1453}
(( segid "PROT" and resid 85 and name HD1 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 1453 weight 0.1000E+01 volume 6.75480 ppm1 6.044 ppm2 7.459
ASSI { 1463}
(( segid "PROT" and resid 85 and name HD1 ))
(( segid "PROT" and resid 89 and name HH2 ))
6 6 0 peak 1463 weight 0.1000E+01 volume 7.28080 ppm1 6.031 ppm2 6.969
ASSI { 1473}
(( segid "PROT" and resid 85 and name HD1 ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 1473 weight 0.1000E+01 volume 12.59970 ppm1 6.042 ppm2 7.495
ASSI { 1483}
(( segid "PROT" and resid 85 and name HD1 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 1483 weight 0.1000E+01 volume 54.03160 ppm1 6.045 ppm2 7.890
ASSI { 1493}
(( segid "PROT" and resid 89 and name HH2 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 1493 weight 0.1000E+01 volume 17.03460 ppm1 6.963 ppm2 7.885
ASSI { 1503}
(( segid "PROT" and resid 89 and name HZ3 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 1503 weight 0.1000E+01 volume 19.06910 ppm1 7.240 ppm2 7.886
ASSI { 1513}
(( segid "PROT" and resid 82 and name HA ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 1513 weight 0.1000E+01 volume 49.94480 ppm1 3.973 ppm2 7.888
ASSI { 1523}
(( segid "PROT" and resid 82 and name HB1 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 1523 weight 0.1000E+01 volume 11.12090 ppm1 3.283 ppm2 7.890
ASSI { 1533}
(( segid "PROT" and resid 82 and name HB2 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 1533 weight 0.1000E+01 volume 20.94090 ppm1 3.099 ppm2 7.885
ASSI { 1543}
(( segid "PROT" and resid 82 and name HA ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 1543 weight 0.1000E+01 volume 3.07270 ppm1 3.980 ppm2 7.516
ASSI { 1553}
(( segid "PROT" and resid 82 and name HE3 ))
(( segid "PROT" and resid 89 and name HH2 ))
6 6 0 peak 1553 weight 0.1000E+01 volume 6.78410 ppm1 7.882 ppm2 6.961
ASSI { 1563}
(( segid "PROT" and resid 89 and name HE3 ))
(( segid "PROT" and resid 89 and name HH2 ))
6 6 0 peak 1563 weight 0.1000E+01 volume 4.47010 ppm1 7.612 ppm2 6.968
ASSI { 1573}
(( segid "PROT" and resid 82 and name HZ2 ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 1573 weight 0.1000E+01 volume 15.86500 ppm1 7.710 ppm2 7.499
ASSI { 1583}
(( segid "PROT" and resid 82 and name HE3 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 1583 weight 0.1000E+01 volume 14.92500 ppm1 7.885 ppm2 7.467
ASSI { 1593}
(( segid "PROT" and resid 89 and name HH2 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 1593 weight 0.1000E+01 volume 16.30240 ppm1 6.961 ppm2 7.463
ASSI { 1603}
(( segid "PROT" and resid 89 and name HH2 ))
(( segid "PROT" and resid 89 and name HZ3 ))
6 6 0 peak 1603 weight 0.1000E+01 volume 18.93920 ppm1 6.956 ppm2 7.246
ASSI { 1613}
(( segid "PROT" and resid 82 and name HZ3 ))
(( segid "PROT" and resid 89 and name HZ3 ))
6 6 0 peak 1613 weight 0.1000E+01 volume 11.24990 ppm1 7.492 ppm2 7.243
ASSI { 1623}
(( segid "PROT" and resid 89 and name HA ))
(( segid "PROT" and resid 89 and name HE3 ))
6 6 0 peak 1623 weight 0.1000E+01 volume 5.44770 ppm1 4.787 ppm2 7.625
ASSI { 1633}
(( segid "PROT" and resid 89 and name HB2 ))
(( segid "PROT" and resid 89 and name HE3 ))
6 6 0 peak 1633 weight 0.1000E+01 volume 2.37250 ppm1 3.137 ppm2 7.629
ASSI { 1643}
(( segid "PROT" and resid 89 and name HB1 ))
(( segid "PROT" and resid 89 and name HE3 ))
6 6 0 peak 1643 weight 0.1000E+01 volume 5.18210 ppm1 3.319 ppm2 7.630
ASSI { 1653}
(( segid "PROT" and resid 89 and name HE3 ))
(( segid "PROT" and resid 89 and name HZ3 ))
6 6 0 peak 1653 weight 0.1000E+01 volume 11.39100 ppm1 7.609 ppm2 7.248
ASSI { 1663}
(( segid "PROT" and resid 89 and name HA ))
(( segid "PROT" and resid 89 and name HZ3 ))
6 6 0 peak 1663 weight 0.1000E+01 volume 3.26970 ppm1 4.782 ppm2 7.246
ASSI { 1673}
(( segid "PROT" and resid 89 and name HZ3 ))
(( segid "PROT" and resid 89 and name HZ2 ))
6 6 0 peak 1673 weight 0.1000E+01 volume 16.81570 ppm1 7.243 ppm2 6.954
ASSI { 1683}
(( segid "PROT" and resid 82 and name HZ3 ))
(( segid "PROT" and resid 89 and name HZ2 ))
6 6 0 peak 1683 weight 0.1000E+01 volume 10.30540 ppm1 7.484 ppm2 6.958
ASSI { 1703}
(( segid "PROT" and resid 103 and name HB1 ))
(( segid "PROT" and resid 89 and name HZ2 ))
6 6 0 peak 1703 weight 0.1000E+01 volume 16.66780 ppm1 4.241 ppm2 6.953
ASSI { 1713}
(( segid "PROT" and resid 103 and name HB2 ))
(( segid "PROT" and resid 89 and name HZ2 ))
6 6 0 peak 1713 weight 0.1000E+01 volume 17.74550 ppm1 4.095 ppm2 6.951
ASSI { 1723}
(( segid "PROT" and resid 75 and name HA ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 1723 weight 0.1000E+01 volume 20.52260 ppm1 4.191 ppm2 7.540
ASSI { 1733}
(( segid "PROT" and resid 76 and name HA ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 1733 weight 0.1000E+01 volume 9.22490 ppm1 3.877 ppm2 7.535
ASSI { 1743}
(( segid "PROT" and resid 75 and name HB1 ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 1743 weight 0.1000E+01 volume 12.47060 ppm1 3.591 ppm2 7.535
ASSI { 1753}
(( segid "PROT" and resid 75 and name HB2 ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 1753 weight 0.1000E+01 volume 10.43200 ppm1 3.233 ppm2 7.540
ASSI { 1763}
(( segid "PROT" and resid 78 and name HB ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 1763 weight 0.1000E+01 volume 15.38810 ppm1 2.263 ppm2 7.540
ASSI { 1773}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 1773 weight 0.1000E+01 volume 14.37040 ppm1 1.093 ppm2 7.541
ASSI { 1783}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 1783 weight 0.1000E+01 volume 12.07910 ppm1 1.251 ppm2 7.541
ASSI { 1793}
(( segid "PROT" and resid 89 and name HZ3 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 1793 weight 0.1000E+01 volume 20.75540 ppm1 7.241 ppm2 7.461
ASSI { 1803}
(( segid "PROT" and resid 110 and name HB1 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 1803 weight 0.1000E+01 volume 3.71660 ppm1 2.362 ppm2 7.469
ASSI { 1813}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 1813 weight 0.1000E+01 volume 11.92500 ppm1 0.907 ppm2 7.711
ASSI { 1823}
(( segid "PROT" and resid 110 and name HG2 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 1823 weight 0.1000E+01 volume 24.84300 ppm1 2.503 ppm2 7.715
ASSI { 1833}
(( segid "PROT" and resid 110 and name HG1 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 1833 weight 0.1000E+01 volume 32.33500 ppm1 2.809 ppm2 7.705
ASSI { 1843}
(( segid "PROT" and resid 82 and name HA ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 1843 weight 0.1000E+01 volume 14.31700 ppm1 3.983 ppm2 7.705
ASSI { 1853}
(( segid "PROT" and resid 109 and name HD1 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 1853 weight 0.1000E+01 volume 10.02480 ppm1 7.032 ppm2 7.706
ASSI { 1863}
(( segid "PROT" and resid 89 and name HZ3 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 1863 weight 0.1000E+01 volume 6.38680 ppm1 7.249 ppm2 7.701
ASSI { 1873}
(( segid "PROT" and resid 109 and name HE1 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 1873 weight 0.1000E+01 volume 8.82370 ppm1 7.175 ppm2 7.706
ASSI { 1883}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 1883 weight 0.1000E+01 volume 16.40660 ppm1 0.908 ppm2 7.502
ASSI { 1893}
(( segid "PROT" and resid 110 and name HG2 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 1893 weight 0.1000E+01 volume 14.00460 ppm1 2.500 ppm2 7.465
ASSI { 1903}
(( segid "PROT" and resid 110 and name HG1 ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 1903 weight 0.1000E+01 volume 9.82980 ppm1 2.807 ppm2 7.459
ASSI { 1913}
(( segid "PROT" and resid 9 and name HB1 ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 1913 weight 0.1000E+01 volume 104.71670 ppm1 2.853 ppm2 7.316
ASSI { 1923}
(( segid "PROT" and resid 14 and name HD2# ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 1923 weight 0.1000E+01 volume 19.54930 ppm1 0.257 ppm2 7.313
ASSI { 1933}
(( segid "PROT" and resid 14 and name HD1# ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 1933 weight 0.1000E+01 volume 10.06310 ppm1 0.342 ppm2 7.320
ASSI { 1943}
(( segid "PROT" and resid 8 and name HA ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 1943 weight 0.1000E+01 volume 5.36840 ppm1 4.247 ppm2 7.405
ASSI { 1953}
(( segid "PROT" and resid 9 and name HA ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 1953 weight 0.1000E+01 volume 13.68100 ppm1 4.622 ppm2 7.395
ASSI { 1963}
(( segid "PROT" and resid 59 and name HD1# ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 1963 weight 0.1000E+01 volume 7.92560 ppm1 0.226 ppm2 7.396
ASSI { 1973}
(( segid "PROT" and resid 59 and name HD1# ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 1973 weight 0.1000E+01 volume 23.38520 ppm1 0.223 ppm2 6.941
ASSI { 1983}
(( segid "PROT" and resid 88 and name HA ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 1983 weight 0.1000E+01 volume 2.94710 ppm1 4.344 ppm2 6.932
ASSI { 1993}
(( segid "PROT" and resid 35 and name HB1 ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 1993 weight 0.1000E+01 volume 89.74170 ppm1 3.830 ppm2 7.400
ASSI { 2003}
(( segid "PROT" and resid 84 and name HA ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 2003 weight 0.1000E+01 volume 14.97270 ppm1 3.642 ppm2 7.400
ASSI { 2013}
(( segid "PROT" and resid 56 and name HG1 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 2013 weight 0.1000E+01 volume 21.56760 ppm1 2.128 ppm2 7.405
ASSI { 2023}
(( segid "PROT" and resid 56 and name HG2 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 2023 weight 0.1000E+01 volume 12.46070 ppm1 1.964 ppm2 7.401
ASSI { 2033}
(( segid "PROT" and resid 25 and name HD2# ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 2033 weight 0.1000E+01 volume 23.85390 ppm1 0.900 ppm2 6.045
ASSI { 2043}
(( segid "PROT" and resid 84 and name HE# ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 2043 weight 0.1000E+01 volume 16.57710 ppm1 1.211 ppm2 6.050
ASSI { 2053}
(( segid "PROT" and resid 85 and name HB2 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 2053 weight 0.1000E+01 volume 12.84680 ppm1 1.490 ppm2 6.047
ASSI { 2063}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 2063 weight 0.1000E+01 volume 13.78530 ppm1 -1.502 ppm2 6.044
ASSI { 2073}
(( segid "PROT" and resid 109 and name HD1 ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 2073 weight 0.1000E+01 volume 13.96680 ppm1 7.028 ppm2 6.069
ASSI { 2083}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 2083 weight 0.1000E+01 volume 14.52150 ppm1 -1.512 ppm2 6.061
ASSI { 2093}
(( segid "PROT" and resid 25 and name HD1# ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 2093 weight 0.1000E+01 volume 10.01960 ppm1 0.657 ppm2 6.073
ASSI { 2103}
(( segid "PROT" and resid 106 and name HA ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 2103 weight 0.1000E+01 volume 9.98660 ppm1 3.414 ppm2 6.078
ASSI { 2113}
(( segid "PROT" and resid 109 and name HB1 ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 2113 weight 0.1000E+01 volume 11.72290 ppm1 3.340 ppm2 6.083
ASSI { 2123}
(( segid "PROT" and resid 109 and name HB2 ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 2123 weight 0.1000E+01 volume 5.74800 ppm1 3.053 ppm2 6.079
ASSI { 2133}
(( segid "PROT" and resid 75 and name HA ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 2133 weight 0.1000E+01 volume 16.11810 ppm1 4.189 ppm2 7.469
ASSI { 2143}
(( segid "PROT" and resid 75 and name HB1 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 2143 weight 0.1000E+01 volume 48.57950 ppm1 3.593 ppm2 7.465
ASSI { 2153}
(( segid "PROT" and resid 71 and name HE1 ))
(( segid "PROT" and resid 71 and name HD1 ))
6 6 0 peak 2153 weight 0.1000E+01 volume 10.82350 ppm1 6.543 ppm2 6.847
ASSI { 2163}
(( segid "PROT" and resid 39 and name HG2# ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 2163 weight 0.1000E+01 volume 12.85230 ppm1 -0.381 ppm2 6.141
ASSI { 2173}
(( segid "PROT" and resid 88 and name HA ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 2173 weight 0.1000E+01 volume 10.19130 ppm1 4.348 ppm2 7.337
ASSI { 2183}
(( segid "PROT" and resid 105 and name HD1# ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 2183 weight 0.1000E+01 volume 13.46520 ppm1 0.376 ppm2 7.344
ASSI { 2193}
(( segid "PROT" and resid 46 and name HG2# ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 2193 weight 0.1000E+01 volume 15.36300 ppm1 0.723 ppm2 6.700
ASSI { 2203}
(( segid "PROT" and resid 98 and name HG1# ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 2203 weight 0.1000E+01 volume 22.47000 ppm1 0.829 ppm2 6.697
ASSI { 2213}
(( segid "PROT" and resid 101 and name HB2 ))
(( segid "PROT" and resid 101 and name HE1 ))
6 6 0 peak 2213 weight 0.1000E+01 volume 11.55130 ppm1 3.656 ppm2 7.344
ASSI { 2223}
(( segid "PROT" and resid 102 and name HA ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 2223 weight 0.1000E+01 volume 3.79500 ppm1 3.232 ppm2 7.339
ASSI { 2233}
(( segid "PROT" and resid 35 and name HD1 ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 2233 weight 0.1000E+01 volume 13.17920 ppm1 7.401 ppm2 7.019
ASSI { 2243}
(( segid "PROT" and resid 98 and name HG2# ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 2243 weight 0.1000E+01 volume 18.17800 ppm1 0.780 ppm2 7.349
ASSI { 2253}
(( segid "PROT" and resid 88 and name HB# ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 2253 weight 0.1000E+01 volume 18.22450 ppm1 1.744 ppm2 7.402
ASSI { 2263}
(( segid "PROT" and resid 59 and name HG ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 2263 weight 0.1000E+01 volume 8.17700 ppm1 1.588 ppm2 7.400
ASSI { 2273}
(( segid "PROT" and resid 34 and name HB1 ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 2273 weight 0.1000E+01 volume 1.69510 ppm1 2.091 ppm2 7.400
ASSI { 2293}
(( segid "PROT" and resid 34 and name HB2 ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 2293 weight 0.1000E+01 volume 15.27700 ppm1 0.560 ppm2 7.400
ASSI { 2303}
(( segid "PROT" and resid 9 and name HE1 ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 2303 weight 0.1000E+01 volume 204.23750 ppm1 7.388 ppm2 7.319
ASSI { 2313}
(( segid "PROT" and resid 26 and name HB1 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 2313 weight 0.1000E+01 volume 190.56090 ppm1 2.881 ppm2 6.937
ASSI { 2333}
(( segid "PROT" and resid 60 and name HB2 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2333 weight 0.1000E+01 volume 8.44270 ppm1 3.991 ppm2 6.599
ASSI { 2343}
(( segid "PROT" and resid 36 and name HA ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2343 weight 0.1000E+01 volume 18.56720 ppm1 3.925 ppm2 6.600
ASSI { 2353}
(( segid "PROT" and resid 26 and name HA ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2353 weight 0.1000E+01 volume 14.03130 ppm1 3.691 ppm2 6.600
ASSI { 2363}
(( segid "PROT" and resid 36 and name HD2 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2363 weight 0.1000E+01 volume 7.79850 ppm1 3.043 ppm2 6.599
ASSI { 2373}
(( segid "PROT" and resid 26 and name HB1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2373 weight 0.1000E+01 volume 27.77020 ppm1 2.883 ppm2 6.599
ASSI { 2383}
(( segid "PROT" and resid 101 and name HB1 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2383 weight 0.1000E+01 volume 16.26880 ppm1 3.901 ppm2 7.082
ASSI { 2393}
(( segid "PROT" and resid 34 and name HD1 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2393 weight 0.1000E+01 volume 7.19890 ppm1 3.795 ppm2 7.082
ASSI { 2403}
(( segid "PROT" and resid 101 and name HB2 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2403 weight 0.1000E+01 volume 10.44480 ppm1 3.638 ppm2 7.083
ASSI { 2413}
(( segid "PROT" and resid 102 and name HA ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2413 weight 0.1000E+01 volume 5.09600 ppm1 3.259 ppm2 7.087
ASSI { 2423}
(( segid "PROT" and resid 31 and name HG1 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2423 weight 0.1000E+01 volume 1.23270 ppm1 2.290 ppm2 7.076
ASSI { 2433}
(( segid "PROT" and resid 100 and name HB1 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2433 weight 0.1000E+01 volume 12.69890 ppm1 2.048 ppm2 7.086
ASSI { 2443}
(( segid "PROT" and resid 30 and name HG1 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2443 weight 0.1000E+01 volume 13.87600 ppm1 1.921 ppm2 7.087
ASSI { 2453}
(( segid "PROT" and resid 100 and name HD1 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2453 weight 0.1000E+01 volume 5.97060 ppm1 1.747 ppm2 7.076
ASSI { 2463}
(( segid "PROT" and resid 100 and name HD2 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2463 weight 0.1000E+01 volume 4.45400 ppm1 1.664 ppm2 7.080
ASSI { 2473}
(( segid "PROT" and resid 100 and name HG2 ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 2473 weight 0.1000E+01 volume 13.68880 ppm1 1.580 ppm2 7.087
ASSI { 2483}
(( segid "PROT" and resid 30 and name HG2 ))
(( segid "PROT" and resid 101 and name HZ ))
6 6 0 peak 2483 weight 0.1000E+01 volume 5.65000 ppm1 1.084 ppm2 7.130
ASSI { 2493}
(( segid "PROT" and resid 91 and name HB1 ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 2493 weight 0.1000E+01 volume 15.94270 ppm1 2.979 ppm2 6.925
ASSI { 2503}
(( segid "PROT" and resid 52 and name HB ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 2503 weight 0.1000E+01 volume 12.33240 ppm1 1.818 ppm2 6.696
ASSI { 2513}
(( segid "PROT" and resid 52 and name HG11 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 2513 weight 0.1000E+01 volume 12.17100 ppm1 1.556 ppm2 6.699
ASSI { 2523}
(( segid "PROT" and resid 52 and name HG12 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 2523 weight 0.1000E+01 volume 5.13400 ppm1 1.382 ppm2 6.699
ASSI { 2533}
(( segid "PROT" and resid 97 and name HD1 ))
(( segid "PROT" and resid 101 and name HE1 ))
6 6 0 peak 2533 weight 0.1000E+01 volume 6.05900 ppm1 2.996 ppm2 7.302
ASSI { 2543}
(( segid "PROT" and resid 35 and name HB1 ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 2543 weight 0.1000E+01 volume 16.73420 ppm1 3.877 ppm2 7.346
ASSI { 2553}
(( segid "PROT" and resid 99 and name HB1 ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 2553 weight 0.1000E+01 volume 25.71430 ppm1 3.394 ppm2 7.116
ASSI { 2563}
(( segid "PROT" and resid 94 and name HA ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 2563 weight 0.1000E+01 volume 6.54030 ppm1 2.157 ppm2 7.118
ASSI { 2573}
(( segid "PROT" and resid 99 and name HB2 ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 2573 weight 0.1000E+01 volume 22.30530 ppm1 2.582 ppm2 7.114
ASSI { 2583}
(( segid "PROT" and resid 89 and name HA ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 2583 weight 0.1000E+01 volume 18.90820 ppm1 4.782 ppm2 7.116
ASSI { 2593}
(( segid "PROT" and resid 53 and name HG1# ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 2593 weight 0.1000E+01 volume 14.41870 ppm1 0.432 ppm2 6.929
ASSI { 2613}
(( segid "PROT" and resid 84 and name HE# ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 2613 weight 0.1000E+01 volume 6.34080 ppm1 1.201 ppm2 6.077
ASSI { 2623}
(( segid "PROT" and resid 105 and name HD1# ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 2623 weight 0.1000E+01 volume 2.51530 ppm1 0.380 ppm2 6.077
ASSI { 2633}
(( segid "PROT" and resid 106 and name HB# ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 2633 weight 0.1000E+01 volume 7.69270 ppm1 0.909 ppm2 7.886
ASSI { 2643}
(( segid "PROT" and resid 81 and name HB ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 2643 weight 0.1000E+01 volume 3.90740 ppm1 0.881 ppm2 7.464
ASSI { 2653}
(( segid "PROT" and resid 120 and name HG ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 2653 weight 0.1000E+01 volume 20.78940 ppm1 1.758 ppm2 7.400
ASSI { 2663}
(( segid "PROT" and resid 7 and name HD1 ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 2663 weight 0.1000E+01 volume 17.76820 ppm1 1.498 ppm2 7.400
ASSI { 2683}
(( segid "PROT" and resid 35 and name HB2 ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 2683 weight 0.1000E+01 volume 17.99800 ppm1 2.596 ppm2 7.400
ASSI { 2693}
(( segid "PROT" and resid 3 and name HA ))
(( segid "PROT" and resid 3 and name HD2 ))
6 6 0 peak 2693 weight 0.1000E+01 volume 11.59370 ppm1 4.598 ppm2 7.015
ASSI { 2703}
(( segid "PROT" and resid 3 and name HB2 ))
(( segid "PROT" and resid 3 and name HD2 ))
6 6 0 peak 2703 weight 0.1000E+01 volume 40.35570 ppm1 3.012 ppm2 7.015
ASSI { 2713}
(( segid "PROT" and resid 3 and name HB1 ))
(( segid "PROT" and resid 3 and name HD2 ))
6 6 0 peak 2713 weight 0.1000E+01 volume 22.31300 ppm1 3.100 ppm2 7.013
ASSI { 2723}
(( segid "PROT" and resid 14 and name HA ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 2723 weight 0.1000E+01 volume 21.44140 ppm1 3.766 ppm2 7.368
ASSI { 2733}
(( segid "PROT" and resid 120 and name HG ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 2733 weight 0.1000E+01 volume 43.64850 ppm1 1.747 ppm2 7.373
ASSI { 2743}
(( segid "PROT" and resid 7 and name HD1 ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 2743 weight 0.1000E+01 volume 26.48100 ppm1 1.481 ppm2 7.377
ASSI { 2753}
(( segid "PROT" and resid 120 and name HB2 ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 2753 weight 0.1000E+01 volume 38.47120 ppm1 1.606 ppm2 7.375
ASSI { 2763}
(( segid "PROT" and resid 113 and name HG2# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 2763 weight 0.1000E+01 volume 12.94970 ppm1 0.725 ppm2 6.714
ASSI { 2773}
(( segid "PROT" and resid 113 and name HD1# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 2773 weight 0.1000E+01 volume 10.90560 ppm1 0.873 ppm2 6.712
ASSI { 2783}
(( segid "PROT" and resid 105 and name HD1# ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 2783 weight 0.1000E+01 volume 4.79630 ppm1 0.379 ppm2 6.042
ASSI { 2793}
(( segid "PROT" and resid 63 and name HD1 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 2793 weight 0.1000E+01 volume 3.81760 ppm1 1.444 ppm2 6.929
ASSI { 2803}
(( segid "PROT" and resid 59 and name HB2 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 2803 weight 0.1000E+01 volume 9.51900 ppm1 1.328 ppm2 6.928
ASSI { 2813}
(( segid "PROT" and resid 62 and name HD1# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 2813 weight 0.1000E+01 volume 12.24050 ppm1 0.339 ppm2 6.712
ASSI { 2823}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 2823 weight 0.1000E+01 volume 8.16790 ppm1 1.256 ppm2 6.712
ASSI { 2833}
(( segid "PROT" and resid 62 and name HD1# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 2833 weight 0.1000E+01 volume 8.61660 ppm1 0.336 ppm2 6.604
ASSI { 2843}
(( segid "PROT" and resid 53 and name HG2# ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 2843 weight 0.1000E+01 volume 21.77880 ppm1 0.598 ppm2 6.142
ASSI { 2853}
(( segid "PROT" and resid 52 and name HG2# ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 2853 weight 0.1000E+01 volume 15.73190 ppm1 1.006 ppm2 6.141
ASSI { 2863}
(( segid "PROT" and resid 39 and name HB ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 2863 weight 0.1000E+01 volume 8.54270 ppm1 1.456 ppm2 6.141
ASSI { 2873}
(( segid "PROT" and resid 99 and name HE1 ))
(( segid "PROT" and resid 89 and name HD1 ))
6 6 0 peak 2873 weight 0.1000E+01 volume 7.56930 ppm1 7.034 ppm2 5.006
ASSI { 2883}
(( segid "PROT" and resid 99 and name HD1 ))
(( segid "PROT" and resid 89 and name HD1 ))
6 6 0 peak 2883 weight 0.1000E+01 volume 6.79780 ppm1 7.110 ppm2 5.005
ASSI { 2903}
(( segid "PROT" and resid 89 and name HA ))
(( segid "PROT" and resid 89 and name HD1 ))
6 6 0 peak 2903 weight 0.1000E+01 volume 28.94040 ppm1 4.795 ppm2 5.009
ASSI { 2913}
(( segid "PROT" and resid 99 and name HA ))
(( segid "PROT" and resid 89 and name HD1 ))
6 6 0 peak 2913 weight 0.1000E+01 volume 1.28860 ppm1 3.770 ppm2 5.008
ASSI { 2923}
(( segid "PROT" and resid 36 and name HB1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2923 weight 0.1000E+01 volume 34.39700 ppm1 2.147 ppm2 6.599
ASSI { 2933}
(( segid "PROT" and resid 63 and name HD1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2933 weight 0.1000E+01 volume 31.58030 ppm1 1.448 ppm2 6.600
ASSI { 2943}
(( segid "PROT" and resid 59 and name HD2# ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2943 weight 0.1000E+01 volume 23.34440 ppm1 0.567 ppm2 6.603
ASSI { 2953}
(( segid "PROT" and resid 36 and name HD1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2953 weight 0.1000E+01 volume 8.60110 ppm1 3.184 ppm2 6.599
ASSI { 2963}
(( segid "PROT" and resid 60 and name HB1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2963 weight 0.1000E+01 volume 4.97370 ppm1 4.322 ppm2 6.596
ASSI { 2973}
(( segid "PROT" and resid 60 and name HA ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 2973 weight 0.1000E+01 volume 4.69180 ppm1 4.220 ppm2 6.600
ASSI { 2993}
(( segid "PROT" and resid 36 and name HB1 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 2993 weight 0.1000E+01 volume 18.91360 ppm1 2.129 ppm2 6.927
ASSI { 3003}
(( segid "PROT" and resid 84 and name HE# ))
(( segid "PROT" and resid 35 and name HD1 ))
6 6 0 peak 3003 weight 0.1000E+01 volume 5.35800 ppm1 1.213 ppm2 7.399
ASSI { 3023}
(( segid "PROT" and resid 13 and name HB1 ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 3023 weight 0.1000E+01 volume 4.72520 ppm1 2.420 ppm2 7.315
ASSI { 3033}
(( segid "PROT" and resid 13 and name HB2 ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 3033 weight 0.1000E+01 volume 11.89200 ppm1 2.181 ppm2 7.317
ASSI { 3043}
(( segid "PROT" and resid 82 and name HA ))
(( segid "PROT" and resid 82 and name HH2 ))
6 6 0 peak 3043 weight 0.1000E+01 volume 4.46840 ppm1 3.984 ppm2 7.459
ASSI { 3053}
(( segid "PROT" and resid 41 and name HD1 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 3053 weight 0.1000E+01 volume 5.63210 ppm1 3.779 ppm2 7.393
ASSI { 3073}
(( segid "PROT" and resid 41 and name HG2 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 3073 weight 0.1000E+01 volume 8.17260 ppm1 1.090 ppm2 7.393
ASSI { 3093}
(( segid "PROT" and resid 14 and name HG ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 3093 weight 0.1000E+01 volume 4.88290 ppm1 1.401 ppm2 7.319
ASSI { 3113}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 3113 weight 0.1000E+01 volume 26.53760 ppm1 1.097 ppm2 7.468
ASSI { 3123}
(( segid "PROT" and resid 73 and name HB1 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 3123 weight 0.1000E+01 volume 14.56770 ppm1 2.174 ppm2 7.469
ASSI { 3133}
(( segid "PROT" and resid 74 and name HD1 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 3133 weight 0.1000E+01 volume 8.19530 ppm1 3.744 ppm2 7.468
ASSI { 3143}
(( segid "PROT" and resid 31 and name HA ))
(( segid "PROT" and resid 101 and name HD1 ))
6 6 0 peak 3143 weight 0.1000E+01 volume 10.29240 ppm1 2.566 ppm2 7.089
ASSI { 3153}
(( segid "PROT" and resid 92 and name HB1 ))
(( segid "PROT" and resid 99 and name HD1 ))
6 6 0 peak 3153 weight 0.1000E+01 volume 7.46490 ppm1 3.098 ppm2 7.116
ASSI { 3163}
(( segid "PROT" and resid 110 and name HB1 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 3163 weight 0.1000E+01 volume 8.17780 ppm1 2.367 ppm2 7.714
ASSI { 3173}
(( segid "PROT" and resid 110 and name HB2 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 3173 weight 0.1000E+01 volume 4.81820 ppm1 2.156 ppm2 7.711
ASSI { 3183}
(( segid "PROT" and resid 113 and name HG2# ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 3183 weight 0.1000E+01 volume 6.27040 ppm1 0.702 ppm2 7.705
ASSI { 3193}
(( segid "PROT" and resid 85 and name HD1 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 3193 weight 0.1000E+01 volume 2.26880 ppm1 6.055 ppm2 7.704
ASSI { 3203}
(( segid "PROT" and resid 89 and name HH2 ))
(( segid "PROT" and resid 82 and name HZ2 ))
6 6 0 peak 3203 weight 0.1000E+01 volume 7.47750 ppm1 6.961 ppm2 7.713
ASSI { 3213}
(( segid "PROT" and resid 75 and name HZ3 ))
(( segid "PROT" and resid 75 and name HZ2 ))
6 6 0 peak 3213 weight 0.1000E+01 volume 13.28850 ppm1 7.179 ppm2 7.477
ASSI { 3263}
(( segid "PROT" and resid 53 and name HG1# ))
(( segid "PROT" and resid 49 and name HE1 ))
6 6 0 peak 3263 weight 0.1000E+01 volume 27.13490 ppm1 0.434 ppm2 6.139
ASSI { 3273}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 3273 weight 0.1000E+01 volume 6.39790 ppm1 -1.515 ppm2 6.607
ASSI { 3293}
(( segid "PROT" and resid 71 and name HB1 ))
(( segid "PROT" and resid 71 and name HE1 ))
6 6 0 peak 3293 weight 0.1000E+01 volume 6.64500 ppm1 2.780 ppm2 6.597
ASSI { 3303}
(( segid "PROT" and resid 59 and name HB1 ))
(( segid "PROT" and resid 26 and name HE1 ))
6 6 0 peak 3303 weight 0.1000E+01 volume 22.70720 ppm1 1.706 ppm2 6.599
ASSI { 3313}
(( segid "PROT" and resid 66 and name HD2# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 3313 weight 0.1000E+01 volume 15.42180 ppm1 0.827 ppm2 6.605
ASSI { 3323}
(( segid "PROT" and resid 21 and name HG2# ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 3323 weight 0.1000E+01 volume 20.62350 ppm1 1.271 ppm2 6.598
ASSI { 3333}
(( segid "PROT" and resid 18 and name HA ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 3333 weight 0.1000E+01 volume 4.29110 ppm1 4.187 ppm2 6.603
ASSI { 3343}
(( segid "PROT" and resid 22 and name HA ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 3343 weight 0.1000E+01 volume 2.68400 ppm1 4.301 ppm2 6.603
ASSI { 3353}
(( segid "PROT" and resid 109 and name HD1 ))
(( segid "PROT" and resid 77 and name HE1 ))
6 6 0 peak 3353 weight 0.1000E+01 volume 7.21090 ppm1 7.024 ppm2 6.610
ASSI { 3363}
(( segid "PROT" and resid 49 and name HB1 ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 3363 weight 0.1000E+01 volume 3.43060 ppm1 2.737 ppm2 6.697
ASSI { 3373}
(( segid "PROT" and resid 53 and name HG1# ))
(( segid "PROT" and resid 91 and name HE1 ))
6 6 0 peak 3373 weight 0.1000E+01 volume 9.95890 ppm1 0.434 ppm2 6.703
ASSI { 3403}
(( segid "PROT" and resid 85 and name HA ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 3403 weight 0.1000E+01 volume 3.96140 ppm1 4.183 ppm2 7.888
ASSI { 3413}
(( segid "PROT" and resid 85 and name HB1 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 3413 weight 0.1000E+01 volume 10.47910 ppm1 2.478 ppm2 7.882
ASSI { 3423}
(( segid "PROT" and resid 85 and name HB2 ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 3423 weight 0.1000E+01 volume 5.80210 ppm1 1.458 ppm2 7.889
ASSI { 3433}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 82 and name HE3 ))
6 6 0 peak 3433 weight 0.1000E+01 volume 1.28500 ppm1 -1.511 ppm2 7.890
ASSI { 3443}
(( segid "PROT" and resid 75 and name HH2 ))
(( segid "PROT" and resid 75 and name HE3 ))
6 6 0 peak 3443 weight 0.1000E+01 volume 7.32280 ppm1 7.233 ppm2 7.534
ASSI { 3453}
(( segid "PROT" and resid 89 and name HE3 ))
(( segid "PROT" and resid 82 and name HZ3 ))
6 6 0 peak 3453 weight 0.1000E+01 volume 19.88570 ppm1 7.608 ppm2 7.497
ASSI { 3463}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 75 and name HZ3 ))
6 6 0 peak 3463 weight 0.1000E+01 volume 11.91010 ppm1 1.102 ppm2 7.181
ASSI { 3473}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 75 and name HZ3 ))
6 6 0 peak 3473 weight 0.1000E+01 volume 12.65630 ppm1 1.251 ppm2 7.174
ASSI { 3493}
(( segid "PROT" and resid 78 and name HB ))
(( segid "PROT" and resid 75 and name HZ3 ))
6 6 0 peak 3493 weight 0.1000E+01 volume 2.24850 ppm1 2.252 ppm2 7.177
ASSI { 3503}
(( segid "PROT" and resid 75 and name HH2 ))
(( segid "PROT" and resid 75 and name HZ3 ))
6 6 0 peak 3503 weight 0.1000E+01 volume 63.40260 ppm1 7.242 ppm2 7.176
ASSI { 3513}
(( segid "PROT" and resid 75 and name HZ2 ))
(( segid "PROT" and resid 75 and name HZ3 ))
6 6 0 peak 3513 weight 0.1000E+01 volume 19.41750 ppm1 7.478 ppm2 7.175
ASSI { 3523}
(( segid "PROT" and resid 89 and name HB2 ))
(( segid "PROT" and resid 89 and name HD1 ))
6 6 0 peak 3523 weight 0.1000E+01 volume 1.75700 ppm1 3.060 ppm2 5.008
ASSI { 3533}
(( segid "PROT" and resid 75 and name HZ3 ))
(( segid "PROT" and resid 75 and name HH2 ))
6 6 0 peak 3533 weight 0.1000E+01 volume 35.35650 ppm1 7.176 ppm2 7.250
ASSI { 3543}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 75 and name HH2 ))
6 6 0 peak 3543 weight 0.1000E+01 volume 8.72360 ppm1 1.104 ppm2 7.242
ASSI { 3553}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 75 and name HH2 ))
6 6 0 peak 3553 weight 0.1000E+01 volume 4.83370 ppm1 1.248 ppm2 7.259
ASSI { 3573}
(( segid "PROT" and resid 85 and name HB2 ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 3573 weight 0.1000E+01 volume 7.35570 ppm1 1.495 ppm2 6.081
ASSI { 3583}
(( segid "PROT" and resid 105 and name HD2# ))
(( segid "PROT" and resid 85 and name HE1 ))
6 6 0 peak 3583 weight 0.1000E+01 volume 5.27600 ppm1 0.554 ppm2 6.077
ASSI { 3593}
(( segid "PROT" and resid 109 and name HE1 ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 3593 weight 0.1000E+01 volume 20.85820 ppm1 7.176 ppm2 7.469
ASSI { 3603}
(( segid "PROT" and resid 75 and name HB2 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 3603 weight 0.1000E+01 volume 32.58340 ppm1 3.258 ppm2 7.468
ASSI { 3613}
(( segid "PROT" and resid 73 and name HG2 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 3613 weight 0.1000E+01 volume 23.91480 ppm1 2.248 ppm2 7.469
ASSI { 3623}
(( segid "PROT" and resid 74 and name HG1 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 3623 weight 0.1000E+01 volume 7.29820 ppm1 1.763 ppm2 7.464
ASSI { 3633}
(( segid "PROT" and resid 74 and name HG2 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 3633 weight 0.1000E+01 volume 13.47280 ppm1 1.399 ppm2 7.471
ASSI { 3643}
(( segid "PROT" and resid 73 and name HG1 ))
(( segid "PROT" and resid 75 and name HD1 ))
6 6 0 peak 3643 weight 0.1000E+01 volume 2.86290 ppm1 2.431 ppm2 7.472
ASSI { 3653}
(( segid "PROT" and resid 85 and name HD1 ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 3653 weight 0.1000E+01 volume 3.22880 ppm1 6.049 ppm2 7.464
ASSI { 3663}
(( segid "PROT" and resid 81 and name HG2# ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 3663 weight 0.1000E+01 volume 7.63380 ppm1 -1.518 ppm2 7.474
ASSI { 3673}
(( segid "PROT" and resid 82 and name HE3 ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 3673 weight 0.1000E+01 volume 4.67820 ppm1 7.882 ppm2 7.470
ASSI { 3683}
(( segid "PROT" and resid 109 and name HD1 ))
(( segid "PROT" and resid 82 and name HD1 ))
6 6 0 peak 3683 weight 0.1000E+01 volume 5.72200 ppm1 7.026 ppm2 7.470
ASSI { 3693}
(( segid "PROT" and resid 99 and name HA ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 3693 weight 0.1000E+01 volume 3.96190 ppm1 3.769 ppm2 7.016
ASSI { 3703}
(( segid "PROT" and resid 102 and name HB1 ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 3703 weight 0.1000E+01 volume 18.14690 ppm1 3.024 ppm2 7.026
ASSI { 3713}
(( segid "PROT" and resid 102 and name HB2 ))
(( segid "PROT" and resid 35 and name HZ ))
6 6 0 peak 3713 weight 0.1000E+01 volume 18.32250 ppm1 2.693 ppm2 7.022
ASSI { 3723}
(( segid "PROT" and resid 30 and name HG1 ))
(( segid "PROT" and resid 101 and name HZ ))
6 6 0 peak 3723 weight 0.1000E+01 volume 9.17430 ppm1 1.906 ppm2 7.130
ASSI { 3733}
(( segid "PROT" and resid 30 and name HB1 ))
(( segid "PROT" and resid 101 and name HZ ))
6 6 0 peak 3733 weight 0.1000E+01 volume 20.57020 ppm1 2.084 ppm2 7.129
ASSI { 3743}
(( segid "PROT" and resid 97 and name HD1 ))
(( segid "PROT" and resid 101 and name HZ ))
6 6 0 peak 3743 weight 0.1000E+01 volume 9.75590 ppm1 2.990 ppm2 7.129
ASSI { 3763}
(( segid "PROT" and resid 106 and name HA ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 3763 weight 0.1000E+01 volume 7.58240 ppm1 3.416 ppm2 6.039
ASSI { 3773}
(( segid "PROT" and resid 82 and name HB1 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 3773 weight 0.1000E+01 volume 3.81880 ppm1 3.347 ppm2 6.052
ASSI { 3783}
(( segid "PROT" and resid 82 and name HB2 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 3783 weight 0.1000E+01 volume 6.21290 ppm1 3.056 ppm2 6.056
ASSI { 3793}
(( segid "PROT" and resid 105 and name HB1 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 3793 weight 0.1000E+01 volume 7.97390 ppm1 1.414 ppm2 6.054
ASSI { 3803}
(( segid "PROT" and resid 105 and name HB2 ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 3803 weight 0.1000E+01 volume 12.69360 ppm1 1.089 ppm2 6.046
ASSI { 3813}
(( segid "PROT" and resid 105 and name HD2# ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 3813 weight 0.1000E+01 volume 4.28110 ppm1 0.562 ppm2 6.040
ASSI { 3823}
(( segid "PROT" and resid 25 and name HD1# ))
(( segid "PROT" and resid 85 and name HD1 ))
6 6 0 peak 3823 weight 0.1000E+01 volume 4.86520 ppm1 0.665 ppm2 6.049
ASSI { 3833}
(( segid "PROT" and resid 7 and name HE1 ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 3833 weight 0.1000E+01 volume 12.86960 ppm1 2.672 ppm2 7.373
ASSI { 3843}
(( segid "PROT" and resid 120 and name HD2# ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 3843 weight 0.1000E+01 volume 8.83760 ppm1 0.648 ppm2 7.374
ASSI { 3853}
(( segid "PROT" and resid 120 and name HD1# ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 3853 weight 0.1000E+01 volume 12.76120 ppm1 0.591 ppm2 7.366
ASSI { 3873}
(( segid "PROT" and resid 35 and name HB2 ))
(( segid "PROT" and resid 35 and name HE1 ))
6 6 0 peak 3873 weight 0.1000E+01 volume 14.26990 ppm1 2.592 ppm2 7.346
ASSI { 3883}
(( segid "PROT" and resid 100 and name HB1 ))
(( segid "PROT" and resid 101 and name HE1 ))
6 6 0 peak 3883 weight 0.1000E+01 volume 16.79320 ppm1 2.092 ppm2 7.304
ASSI { 3913}
(( segid "PROT" and resid 100 and name HG2 ))
(( segid "PROT" and resid 101 and name HE1 ))
6 6 0 peak 3913 weight 0.1000E+01 volume 19.77330 ppm1 1.590 ppm2 7.310
ASSI { 3923}
(( segid "PROT" and resid 77 and name HD1 ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 3923 weight 0.1000E+01 volume 6.92720 ppm1 6.712 ppm2 7.188
ASSI { 3933}
(( segid "PROT" and resid 109 and name HD1 ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 3933 weight 0.1000E+01 volume 82.72220 ppm1 7.033 ppm2 7.183
ASSI { 3943}
(( segid "PROT" and resid 113 and name HG2# ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 3943 weight 0.1000E+01 volume 7.28030 ppm1 0.707 ppm2 7.179
ASSI { 3953}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 3953 weight 0.1000E+01 volume 18.70630 ppm1 1.094 ppm2 7.183
ASSI { 3963}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 3963 weight 0.1000E+01 volume 40.99420 ppm1 1.249 ppm2 7.178
ASSI { 3973}
(( segid "PROT" and resid 82 and name HD1 ))
(( segid "PROT" and resid 109 and name HE1 ))
6 6 0 peak 3973 weight 0.1000E+01 volume 7.90220 ppm1 7.461 ppm2 7.188
ASSI { 3983}
(( segid "PROT" and resid 82 and name HD1 ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 3983 weight 0.1000E+01 volume 3.60670 ppm1 7.463 ppm2 7.019
ASSI { 3993}
(( segid "PROT" and resid 106 and name HA ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 3993 weight 0.1000E+01 volume 4.80350 ppm1 3.408 ppm2 7.031
ASSI { 4003}
(( segid "PROT" and resid 78 and name HG2# ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 4003 weight 0.1000E+01 volume 9.74840 ppm1 1.096 ppm2 7.045
ASSI { 4013}
(( segid "PROT" and resid 78 and name HG1# ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 4013 weight 0.1000E+01 volume 12.90760 ppm1 1.256 ppm2 7.038
ASSI { 4023}
(( segid "PROT" and resid 113 and name HG2# ))
(( segid "PROT" and resid 109 and name HD1 ))
6 6 0 peak 4023 weight 0.1000E+01 volume 34.67000 ppm1 0.670 ppm2 7.037
ASSI { 4033}
(( segid "PROT" and resid 7 and name HE1 ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4033 weight 0.1000E+01 volume 4.96470 ppm1 2.664 ppm2 7.393
ASSI { 4053}
(( segid "PROT" and resid 9 and name HB1 ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4053 weight 0.1000E+01 volume 30.08520 ppm1 2.872 ppm2 7.398
ASSI { 4063}
(( segid "PROT" and resid 56 and name HB1 ))
(( segid "PROT" and resid 50 and name HE1 ))
6 6 0 peak 4063 weight 0.1000E+01 volume 8.56210 ppm1 2.421 ppm2 7.400
ASSI { 4073}
(( segid "PROT" and resid 13 and name HB2 ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4073 weight 0.1000E+01 volume 4.93220 ppm1 2.176 ppm2 7.393
ASSI { 4083}
(( segid "PROT" and resid 56 and name HG1 ))
(( segid "PROT" and resid 50 and name HE1 ))
6 6 0 peak 4083 weight 0.1000E+01 volume 11.31690 ppm1 2.137 ppm2 7.396
ASSI { 4093}
(( segid "PROT" and resid 120 and name HB2 ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4093 weight 0.1000E+01 volume 26.18260 ppm1 1.597 ppm2 7.397
ASSI { 4103}
(( segid "PROT" and resid 120 and name HD1# ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4103 weight 0.1000E+01 volume 7.40870 ppm1 0.595 ppm2 7.396
ASSI { 4113}
(( segid "PROT" and resid 14 and name HD2# ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4113 weight 0.1000E+01 volume 1.73480 ppm1 0.256 ppm2 7.379
ASSI { 4123}
(( segid "PROT" and resid 14 and name HD1# ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4123 weight 0.1000E+01 volume 2.76800 ppm1 0.340 ppm2 7.396
ASSI { 4133}
(( segid "PROT" and resid 120 and name HD2# ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 4133 weight 0.1000E+01 volume 7.13370 ppm1 0.648 ppm2 7.327
ASSI { 4143}
(( segid "PROT" and resid 120 and name HD2# ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4143 weight 0.1000E+01 volume 16.00390 ppm1 0.647 ppm2 7.397
ASSI { 4153}
(( segid "PROT" and resid 9 and name HD1 ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4153 weight 0.1000E+01 volume 76.37480 ppm1 7.317 ppm2 7.391
ASSI { 4163}
(( segid "PROT" and resid 14 and name HA ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 4163 weight 0.1000E+01 volume 11.22890 ppm1 3.760 ppm2 7.319
ASSI { 4183}
(( segid "PROT" and resid 7 and name HE1 ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 4183 weight 0.1000E+01 volume 6.98570 ppm1 2.665 ppm2 7.324
ASSI { 4193}
(( segid "PROT" and resid 120 and name HG ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 4193 weight 0.1000E+01 volume 12.01320 ppm1 1.759 ppm2 7.326
ASSI { 4203}
(( segid "PROT" and resid 120 and name HB2 ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 4203 weight 0.1000E+01 volume 9.27780 ppm1 1.603 ppm2 7.322
ASSI { 4213}
(( segid "PROT" and resid 7 and name HD1 ))
(( segid "PROT" and resid 9 and name HD1 ))
6 6 0 peak 4213 weight 0.1000E+01 volume 15.70050 ppm1 1.522 ppm2 7.324
ASSI { 4223}
(( segid "PROT" and resid 14 and name HG ))
(( segid "PROT" and resid 9 and name HE1 ))
6 6 0 peak 4223 weight 0.1000E+01 volume 7.50420 ppm1 1.407 ppm2 7.386
ASSI { 4233}
(( segid "PROT" and resid 52 and name HD1# ))
(( segid "PROT" and resid 91 and name HD1 ))
6 6 0 peak 4233 weight 0.1000E+01 volume 11.75510 ppm1 0.911 ppm2 6.921
ASSI { 4253}
(( segid "PROT" and resid 59 and name HB1 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 4253 weight 0.1000E+01 volume 10.28260 ppm1 1.715 ppm2 6.927
ASSI { 4273}
(( segid "PROT" and resid 36 and name HD1 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 4273 weight 0.1000E+01 volume 4.84080 ppm1 3.171 ppm2 6.934
ASSI { 4283}
(( segid "PROT" and resid 36 and name HD2 ))
(( segid "PROT" and resid 26 and name HD1 ))
6 6 0 peak 4283 weight 0.1000E+01 volume 5.35520 ppm1 3.084 ppm2 6.930
ASSI { 4313}
(( segid "PROT" and resid 66 and name HD2# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 4313 weight 0.1000E+01 volume 11.22280 ppm1 0.830 ppm2 6.709
ASSI { 4323}
(( segid "PROT" and resid 22 and name HD2# ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 4323 weight 0.1000E+01 volume 94.05120 ppm1 1.097 ppm2 6.710
ASSI { 4333}
(( segid "PROT" and resid 77 and name HB1 ))
(( segid "PROT" and resid 77 and name HD1 ))
6 6 0 peak 4333 weight 0.1000E+01 volume 31.24490 ppm1 2.637 ppm2 6.709
ASSI { 4353}
(( segid "PROT" and resid 71 and name HD1 ))
(( segid "PROT" and resid 71 and name HE1 ))
6 6 0 peak 4353 weight 0.1000E+01 volume 33.96520 ppm1 6.842 ppm2 6.563
ASSI { 4363}
(( segid "PROT" and resid 14 and name HD1# ))
(( segid "PROT" and resid 9 and name HZ ))
6 6 0 peak 4363 weight 0.1000E+01 volume 5.74060 ppm1 0.351 ppm2 7.355
ASSI { 4383}
(( segid "PROT" and resid 50 and name HA ))
(( segid "PROT" and resid 50 and name HZ ))
6 6 0 peak 4383 weight 0.1000E+01 volume 3.27970 ppm1 4.971 ppm2 7.376
ASSI { 4403}
(( segid "PROT" and resid 49 and name HE1 ))
(( segid "PROT" and resid 50 and name HZ ))
6 6 0 peak 4403 weight 0.1000E+01 volume 6.45480 ppm1 6.133 ppm2 7.384
ASSI { 4413}
(( segid "PROT" and resid 41 and name HD2 ))
(( segid "PROT" and resid 50 and name HZ ))
6 6 0 peak 4413 weight 0.1000E+01 volume 15.40450 ppm1 3.717 ppm2 7.375
ASSI { 4423}
(( segid "PROT" and resid 41 and name HD2 ))
(( segid "PROT" and resid 50 and name HD1 ))
6 6 0 peak 4423 weight 0.1000E+01 volume 6.00150 ppm1 3.737 ppm2 7.393
ASSI { 4433}
(( segid "PROT" and resid 56 and name HG2 ))
(( segid "PROT" and resid 50 and name HZ ))
6 6 0 peak 4433 weight 0.1000E+01 volume 4.48320 ppm1 1.966 ppm2 7.367
ASSI { 4443}
(( segid "PROT" and resid 56 and name HG1 ))
(( segid "PROT" and resid 50 and name HZ ))
6 6 0 peak 4443 weight 0.1000E+01 volume 5.41470 ppm1 2.129 ppm2 7.373
ASSI { 4453}
(( segid "PROT" and resid 56 and name HB1 ))
(( segid "PROT" and resid 50 and name HZ ))
6 6 0 peak 4453 weight 0.1000E+01 volume 4.24270 ppm1 2.438 ppm2 7.379
ASSI { 4463}
(( segid "PROT" and resid 41 and name HG2 ))
(( segid "PROT" and resid 50 and name HZ ))
6 6 0 peak 4463 weight 0.1000E+01 volume 4.37520 ppm1 1.077 ppm2 7.365
ASSI { 4473}
(( segid "PROT" and resid 41 and name HG2 ))
(( segid "PROT" and resid 50 and name HE1 ))
6 6 0 peak 4473 weight 0.1000E+01 volume 6.17830 ppm1 1.080 ppm2 7.386
ASSI { 4483}
(( segid "PROT" and resid 56 and name HG2 ))
(( segid "PROT" and resid 50 and name HE1 ))
6 6 0 peak 4483 weight 0.1000E+01 volume 5.11890 ppm1 1.955 ppm2 7.394
ASSI { 4503}
(( segid "PROT" and resid 89 and name HH2 ))
(( segid "PROT" and resid 85 and name HZ ))
6 6 0 peak 4503 weight 0.1000E+01 volume 14.29300 ppm1 7.026 ppm2 6.050
ASSI { 4513}
(( segid "PROT" and resid 105 and name HD1# ))
(( segid "PROT" and resid 85 and name HZ ))
6 6 0 peak 4513 weight 0.1000E+01 volume 12.32480 ppm1 0.373 ppm2 6.037
ASSI { 4523}
(( segid "PROT" and resid 105 and name HD2# ))
(( segid "PROT" and resid 85 and name HZ ))
6 6 0 peak 4523 weight 0.1000E+01 volume 8.00580 ppm1 0.560 ppm2 6.042
ASSI { 4533}
(( segid "PROT" and resid 25 and name HD1# ))
(( segid "PROT" and resid 85 and name HZ ))
6 6 0 peak 4533 weight 0.1000E+01 volume 11.04100 ppm1 0.665 ppm2 6.032
ASSI { 4543}
(( segid "PROT" and resid 25 and name HD2# ))
(( segid "PROT" and resid 85 and name HZ ))
6 6 0 peak 4543 weight 0.1000E+01 volume 21.68950 ppm1 0.896 ppm2 6.043
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