NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
17843 | 2d82 | 6960 | cing | 1-original | 3 | XPLOR/CNS | distance | NOE | simple |
ASSI { 02} (( segid "PROT" and resid 17 and name HA )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 02 weight 0.1000E+01 volume 326.72290 ppm1 4.179 ppm2 1.332 ASSI { 12} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 17 and name HA )) 6 6 0 peak 12 weight 0.1000E+01 volume 140.78520 ppm1 1.338 ppm2 4.177 ASSI { 22} (( segid "PROT" and resid 120 and name HA )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 22 weight 0.1000E+01 volume 6.89940 ppm1 4.429 ppm2 1.335 ASSI { 32} (( segid "PROT" and resid 17 and name HN )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 32 weight 0.1000E+01 volume 5.32060 ppm1 7.417 ppm2 1.337 ASSI { 42} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 42 weight 0.1000E+01 volume 44.01400 ppm1 3.789 ppm2 1.334 ASSI { 62} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 62 weight 0.1000E+01 volume 20.65850 ppm1 1.037 ppm2 1.335 ASSI { 72} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 72 weight 0.1000E+01 volume 104.56790 ppm1 0.658 ppm2 1.334 ASSI { 82} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 82 weight 0.1000E+01 volume 91.74620 ppm1 0.613 ppm2 1.336 ASSI { 92} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 92 weight 0.1000E+01 volume 50.13060 ppm1 0.506 ppm2 1.334 ASSI { 102} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 102 weight 0.1000E+01 volume 22.66430 ppm1 0.354 ppm2 1.335 ASSI { 112} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 112 weight 0.1000E+01 volume 24.07720 ppm1 0.249 ppm2 1.336 ASSI { 122} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 17 and name HA )) 6 6 0 peak 122 weight 0.1000E+01 volume 7.73870 ppm1 0.775 ppm2 4.175 ASSI { 132} (( segid "PROT" and resid 88 and name HA )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 132 weight 0.1000E+01 volume 136.71339 ppm1 4.397 ppm2 1.749 ASSI { 142} (( segid "PROT" and resid 88 and name HB# )) (( segid "PROT" and resid 88 and name HA )) 6 6 0 peak 142 weight 0.1000E+01 volume 73.69680 ppm1 1.752 ppm2 4.400 ASSI { 152} (( segid "PROT" and resid 85 and name HA )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 152 weight 0.1000E+01 volume 23.80760 ppm1 4.182 ppm2 1.744 ASSI { 162} (( segid "PROT" and resid 102 and name HA )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 162 weight 0.1000E+01 volume 10.28500 ppm1 3.240 ppm2 1.744 ASSI { 172} (( segid "PROT" and resid 102 and name HB1 )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 172 weight 0.1000E+01 volume 12.68080 ppm1 3.049 ppm2 1.746 ASSI { 182} (( segid "PROT" and resid 35 and name HZ )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 182 weight 0.1000E+01 volume 21.31700 ppm1 7.031 ppm2 1.747 ASSI { 192} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 192 weight 0.1000E+01 volume 93.03940 ppm1 7.352 ppm2 1.743 ASSI { 202} (( segid "PROT" and resid 24 and name HA )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 202 weight 0.1000E+01 volume 309.89890 ppm1 3.950 ppm2 1.410 ASSI { 212} (( segid "PROT" and resid 21 and name HA )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 212 weight 0.1000E+01 volume 131.03461 ppm1 4.145 ppm2 1.410 ASSI { 222} (( segid "PROT" and resid 112 and name HG1 )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 222 weight 0.1000E+01 volume 56.11570 ppm1 2.498 ppm2 1.410 ASSI { 242} (( segid "PROT" and resid 112 and name HG2 )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 242 weight 0.1000E+01 volume 144.83090 ppm1 2.018 ppm2 1.413 ASSI { 252} (( segid "PROT" and resid 24 and name HB# )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 252 weight 0.1000E+01 volume 186.23630 ppm1 1.414 ppm2 3.949 ASSI { 262} (( segid "PROT" and resid 27 and name HD1 )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 262 weight 0.1000E+01 volume 8.24520 ppm1 3.192 ppm2 3.951 ASSI { 272} (( segid "PROT" and resid 106 and name HA )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 272 weight 0.1000E+01 volume 38.24440 ppm1 3.423 ppm2 0.919 ASSI { 282} (( segid "PROT" and resid 106 and name HB# )) (( segid "PROT" and resid 106 and name HA )) 6 6 0 peak 282 weight 0.1000E+01 volume 63.27150 ppm1 0.912 ppm2 3.423 ASSI { 292} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 292 weight 0.1000E+01 volume 27.60630 ppm1 4.120 ppm2 0.919 ASSI { 302} (( segid "PROT" and resid 103 and name HA )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 302 weight 0.1000E+01 volume 60.60420 ppm1 4.453 ppm2 0.921 ASSI { 312} (( segid "PROT" and resid 85 and name HD1 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 312 weight 0.1000E+01 volume 59.87620 ppm1 6.048 ppm2 0.919 ASSI { 322} (( segid "PROT" and resid 89 and name HH2 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 322 weight 0.1000E+01 volume 112.91640 ppm1 6.958 ppm2 0.921 ASSI { 332} (( segid "PROT" and resid 89 and name HZ3 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 332 weight 0.1000E+01 volume 20.83740 ppm1 7.250 ppm2 0.916 ASSI { 342} (( segid "PROT" and resid 82 and name HZ3 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 342 weight 0.1000E+01 volume 62.75260 ppm1 7.485 ppm2 0.921 ASSI { 352} (( segid "PROT" and resid 82 and name HZ2 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 352 weight 0.1000E+01 volume 10.68250 ppm1 7.719 ppm2 0.916 ASSI { 362} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 106 and name HA )) 6 6 0 peak 362 weight 0.1000E+01 volume 50.90580 ppm1 6.057 ppm2 3.425 ASSI { 372} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 106 and name HA )) 6 6 0 peak 372 weight 0.1000E+01 volume 5.77540 ppm1 7.035 ppm2 3.425 ASSI { 382} (( segid "PROT" and resid 8 and name HB )) (( segid "PROT" and resid 8 and name HA )) 6 6 0 peak 382 weight 0.1000E+01 volume 83.37790 ppm1 1.742 ppm2 4.283 ASSI { 392} (( segid "PROT" and resid 8 and name HG11 )) (( segid "PROT" and resid 8 and name HA )) 6 6 0 peak 392 weight 0.1000E+01 volume 22.81200 ppm1 1.433 ppm2 4.271 ASSI { 402} (( segid "PROT" and resid 8 and name HG12 )) (( segid "PROT" and resid 8 and name HA )) 6 6 0 peak 402 weight 0.1000E+01 volume 43.53360 ppm1 1.137 ppm2 4.279 ASSI { 412} (( segid "PROT" and resid 8 and name HG2# )) (( segid "PROT" and resid 8 and name HA )) 6 6 0 peak 412 weight 0.1000E+01 volume 12.41660 ppm1 0.879 ppm2 4.276 ASSI { 422} (( segid "PROT" and resid 8 and name HD1# )) (( segid "PROT" and resid 8 and name HA )) 6 6 0 peak 422 weight 0.1000E+01 volume 23.82380 ppm1 0.829 ppm2 4.276 ASSI { 432} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 8 and name HA )) 6 6 0 peak 432 weight 0.1000E+01 volume 13.58600 ppm1 7.333 ppm2 4.281 ASSI { 442} (( segid "PROT" and resid 8 and name HA )) (( segid "PROT" and resid 8 and name HB )) 6 6 0 peak 442 weight 0.1000E+01 volume 55.99740 ppm1 4.278 ppm2 1.739 ASSI { 452} (( segid "PROT" and resid 8 and name HG11 )) (( segid "PROT" and resid 8 and name HB )) 6 6 0 peak 452 weight 0.1000E+01 volume 55.48710 ppm1 1.433 ppm2 1.739 ASSI { 462} (( segid "PROT" and resid 8 and name HG12 )) (( segid "PROT" and resid 8 and name HB )) 6 6 0 peak 462 weight 0.1000E+01 volume 60.14330 ppm1 1.138 ppm2 1.732 ASSI { 472} (( segid "PROT" and resid 8 and name HG2# )) (( segid "PROT" and resid 8 and name HB )) 6 6 0 peak 472 weight 0.1000E+01 volume 72.58460 ppm1 0.874 ppm2 1.736 ASSI { 482} (( segid "PROT" and resid 8 and name HA )) (( segid "PROT" and resid 8 and name HG11 )) 6 6 0 peak 482 weight 0.1000E+01 volume 28.55280 ppm1 4.277 ppm2 1.434 ASSI { 492} (( segid "PROT" and resid 8 and name HA )) (( segid "PROT" and resid 8 and name HG12 )) 6 6 0 peak 492 weight 0.1000E+01 volume 50.97310 ppm1 4.276 ppm2 1.134 ASSI { 502} (( segid "PROT" and resid 8 and name HB )) (( segid "PROT" and resid 8 and name HG12 )) 6 6 0 peak 502 weight 0.1000E+01 volume 205.07420 ppm1 1.744 ppm2 1.138 ASSI { 512} (( segid "PROT" and resid 8 and name HB )) (( segid "PROT" and resid 8 and name HG11 )) 6 6 0 peak 512 weight 0.1000E+01 volume 299.02319 ppm1 1.741 ppm2 1.434 ASSI { 522} (( segid "PROT" and resid 8 and name HG11 )) (( segid "PROT" and resid 8 and name HG12 )) 6 6 0 peak 522 weight 0.1000E+01 volume 576.40472 ppm1 1.437 ppm2 1.143 ASSI { 532} (( segid "PROT" and resid 8 and name HG12 )) (( segid "PROT" and resid 8 and name HG11 )) 6 6 0 peak 532 weight 0.1000E+01 volume 398.45599 ppm1 1.136 ppm2 1.428 ASSI { 542} (( segid "PROT" and resid 8 and name HD1# )) (( segid "PROT" and resid 8 and name HG12 )) 6 6 0 peak 542 weight 0.1000E+01 volume 255.07111 ppm1 0.828 ppm2 1.130 ASSI { 552} (( segid "PROT" and resid 8 and name HB )) (( segid "PROT" and resid 8 and name HG2# )) 6 6 0 peak 552 weight 0.1000E+01 volume 303.00229 ppm1 1.741 ppm2 0.857 ASSI { 562} (( segid "PROT" and resid 8 and name HA )) (( segid "PROT" and resid 8 and name HG2# )) 6 6 0 peak 562 weight 0.1000E+01 volume 191.39830 ppm1 4.276 ppm2 0.856 ASSI { 572} (( segid "PROT" and resid 8 and name HG11 )) (( segid "PROT" and resid 8 and name HG2# )) 6 6 0 peak 572 weight 0.1000E+01 volume 73.42690 ppm1 1.434 ppm2 0.857 ASSI { 582} (( segid "PROT" and resid 8 and name HG12 )) (( segid "PROT" and resid 8 and name HG2# )) 6 6 0 peak 582 weight 0.1000E+01 volume 80.59850 ppm1 1.140 ppm2 0.856 ASSI { 592} (( segid "PROT" and resid 8 and name HA )) (( segid "PROT" and resid 8 and name HD1# )) 6 6 0 peak 592 weight 0.1000E+01 volume 79.87710 ppm1 4.274 ppm2 0.823 ASSI { 602} (( segid "PROT" and resid 8 and name HB )) (( segid "PROT" and resid 8 and name HD1# )) 6 6 0 peak 602 weight 0.1000E+01 volume 80.47540 ppm1 1.740 ppm2 0.827 ASSI { 612} (( segid "PROT" and resid 8 and name HG11 )) (( segid "PROT" and resid 8 and name HD1# )) 6 6 0 peak 612 weight 0.1000E+01 volume 210.87660 ppm1 1.433 ppm2 0.829 ASSI { 622} (( segid "PROT" and resid 8 and name HG12 )) (( segid "PROT" and resid 8 and name HD1# )) 6 6 0 peak 622 weight 0.1000E+01 volume 168.70399 ppm1 1.140 ppm2 0.829 ASSI { 632} (( segid "PROT" and resid 8 and name HD1# )) (( segid "PROT" and resid 8 and name HB )) 6 6 0 peak 632 weight 0.1000E+01 volume 75.33220 ppm1 0.837 ppm2 1.735 ASSI { 642} (( segid "PROT" and resid 52 and name HA )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 642 weight 0.1000E+01 volume 30.88720 ppm1 3.995 ppm2 1.829 ASSI { 652} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 652 weight 0.1000E+01 volume 62.62850 ppm1 0.999 ppm2 1.827 ASSI { 662} (( segid "PROT" and resid 52 and name HG12 )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 662 weight 0.1000E+01 volume 19.02160 ppm1 1.401 ppm2 1.822 ASSI { 672} (( segid "PROT" and resid 52 and name HG11 )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 672 weight 0.1000E+01 volume 15.41710 ppm1 1.561 ppm2 1.830 ASSI { 682} (( segid "PROT" and resid 49 and name HA )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 682 weight 0.1000E+01 volume 11.66770 ppm1 3.583 ppm2 1.823 ASSI { 692} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 692 weight 0.1000E+01 volume 10.95210 ppm1 6.707 ppm2 1.828 ASSI { 702} (( segid "PROT" and resid 53 and name HB )) (( segid "PROT" and resid 53 and name HA )) 6 6 0 peak 702 weight 0.1000E+01 volume 64.96590 ppm1 1.000 ppm2 3.529 ASSI { 712} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 53 and name HA )) 6 6 0 peak 712 weight 0.1000E+01 volume 71.79620 ppm1 0.607 ppm2 3.531 ASSI { 722} (( segid "PROT" and resid 53 and name HA )) (( segid "PROT" and resid 53 and name HB )) 6 6 0 peak 722 weight 0.1000E+01 volume 25.51570 ppm1 3.536 ppm2 1.025 ASSI { 732} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 53 and name HB )) 6 6 0 peak 732 weight 0.1000E+01 volume 82.71650 ppm1 0.611 ppm2 1.024 ASSI { 742} (( segid "PROT" and resid 53 and name HA )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 742 weight 0.1000E+01 volume 109.40060 ppm1 3.535 ppm2 0.445 ASSI { 752} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 752 weight 0.1000E+01 volume 17.75830 ppm1 6.939 ppm2 0.439 ASSI { 762} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 762 weight 0.1000E+01 volume 64.42990 ppm1 6.712 ppm2 0.502 ASSI { 772} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 772 weight 0.1000E+01 volume 40.75220 ppm1 6.612 ppm2 0.504 ASSI { 782} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 782 weight 0.1000E+01 volume 50.97420 ppm1 6.150 ppm2 0.442 ASSI { 792} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 792 weight 0.1000E+01 volume 150.75549 ppm1 4.191 ppm2 0.501 ASSI { 802} (( segid "PROT" and resid 87 and name HB1 )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 802 weight 0.1000E+01 volume 24.62930 ppm1 3.076 ppm2 0.440 ASSI { 812} (( segid "PROT" and resid 53 and name HB )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 812 weight 0.1000E+01 volume 154.12959 ppm1 1.009 ppm2 0.445 ASSI { 822} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 822 weight 0.1000E+01 volume 185.32460 ppm1 0.233 ppm2 0.504 ASSI { 832} (( segid "PROT" and resid 53 and name HA )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 832 weight 0.1000E+01 volume 86.23680 ppm1 3.536 ppm2 0.608 ASSI { 842} (( segid "PROT" and resid 50 and name HD1 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 842 weight 0.1000E+01 volume 18.79810 ppm1 7.409 ppm2 0.608 ASSI { 852} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 852 weight 0.1000E+01 volume 48.38800 ppm1 6.149 ppm2 0.608 ASSI { 862} (( segid "PROT" and resid 87 and name HA )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 862 weight 0.1000E+01 volume 12.66080 ppm1 4.455 ppm2 0.608 ASSI { 872} (( segid "PROT" and resid 87 and name HB1 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 872 weight 0.1000E+01 volume 22.47610 ppm1 3.081 ppm2 0.607 ASSI { 882} (( segid "PROT" and resid 87 and name HB2 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 882 weight 0.1000E+01 volume 38.73520 ppm1 2.749 ppm2 0.609 ASSI { 892} (( segid "PROT" and resid 53 and name HB )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 892 weight 0.1000E+01 volume 131.06000 ppm1 1.022 ppm2 0.608 ASSI { 902} (( segid "PROT" and resid 39 and name HA )) (( segid "PROT" and resid 39 and name HG1# )) 6 6 0 peak 902 weight 0.1000E+01 volume 108.76930 ppm1 3.204 ppm2 0.741 ASSI { 912} (( segid "PROT" and resid 39 and name HB )) (( segid "PROT" and resid 39 and name HG1# )) 6 6 0 peak 912 weight 0.1000E+01 volume 199.89951 ppm1 1.471 ppm2 0.734 ASSI { 922} (( segid "PROT" and resid 39 and name HB )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 922 weight 0.1000E+01 volume 139.80350 ppm1 1.470 ppm2 -0.369 ASSI { 932} (( segid "PROT" and resid 39 and name HG1# )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 932 weight 0.1000E+01 volume 315.98459 ppm1 0.740 ppm2 -0.370 ASSI { 942} (( segid "PROT" and resid 41 and name HG2 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 942 weight 0.1000E+01 volume 7.21210 ppm1 1.097 ppm2 -0.371 ASSI { 952} (( segid "PROT" and resid 41 and name HG1 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 952 weight 0.1000E+01 volume 23.64400 ppm1 1.574 ppm2 -0.367 ASSI { 962} (( segid "PROT" and resid 39 and name HA )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 962 weight 0.1000E+01 volume 47.47680 ppm1 3.205 ppm2 -0.374 ASSI { 972} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 972 weight 0.1000E+01 volume 8.58790 ppm1 5.084 ppm2 -0.368 ASSI { 982} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 982 weight 0.1000E+01 volume 21.31620 ppm1 6.152 ppm2 -0.368 ASSI { 1002} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 116 and name HA )) 6 6 0 peak 1002 weight 0.1000E+01 volume 93.94220 ppm1 1.041 ppm2 3.676 ASSI { 1012} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 116 and name HA )) 6 6 0 peak 1012 weight 0.1000E+01 volume 78.69610 ppm1 0.779 ppm2 3.675 ASSI { 1022} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 116 and name HA )) 6 6 0 peak 1022 weight 0.1000E+01 volume 29.33780 ppm1 2.068 ppm2 3.678 ASSI { 1032} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 28 and name HG2 )) 6 6 0 peak 1032 weight 0.1000E+01 volume 14.36370 ppm1 0.570 ppm2 2.034 ASSI { 1042} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 116 and name HB )) 6 6 0 peak 1042 weight 0.1000E+01 volume 94.92040 ppm1 0.776 ppm2 2.067 ASSI { 1052} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 116 and name HB )) 6 6 0 peak 1052 weight 0.1000E+01 volume 108.15450 ppm1 1.040 ppm2 2.069 ASSI { 1062} (( segid "PROT" and resid 100 and name HG2 )) (( segid "PROT" and resid 100 and name HB1 )) 6 6 0 peak 1062 weight 0.1000E+01 volume 248.84160 ppm1 1.616 ppm2 2.034 ASSI { 1072} (( segid "PROT" and resid 100 and name HG1 )) (( segid "PROT" and resid 100 and name HB1 )) 6 6 0 peak 1072 weight 0.1000E+01 volume 224.21500 ppm1 1.710 ppm2 2.030 ASSI { 1082} (( segid "PROT" and resid 118 and name HG2 )) (( segid "PROT" and resid 116 and name HB )) 6 6 0 peak 1082 weight 0.1000E+01 volume 256.02802 ppm1 2.441 ppm2 2.039 ASSI { 1092} (( segid "PROT" and resid 28 and name HG1 )) (( segid "PROT" and resid 28 and name HG2 )) 6 6 0 peak 1092 weight 0.1000E+01 volume 62.95610 ppm1 2.799 ppm2 2.034 ASSI { 1102} (( segid "PROT" and resid 116 and name HA )) (( segid "PROT" and resid 116 and name HB )) 6 6 0 peak 1102 weight 0.1000E+01 volume 84.90530 ppm1 3.658 ppm2 2.051 ASSI { 1112} (( segid "PROT" and resid 113 and name HA )) (( segid "PROT" and resid 116 and name HB )) 6 6 0 peak 1112 weight 0.1000E+01 volume 89.66320 ppm1 4.074 ppm2 2.040 ASSI { 1122} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 11 and name HB2 )) 6 6 0 peak 1122 weight 0.1000E+01 volume 131.81660 ppm1 4.233 ppm2 2.035 ASSI { 1132} (( segid "PROT" and resid 116 and name HA )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1132 weight 0.1000E+01 volume 119.36390 ppm1 3.680 ppm2 0.770 ASSI { 1142} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1142 weight 0.1000E+01 volume 3.68070 ppm1 6.610 ppm2 0.771 ASSI { 1152} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1152 weight 0.1000E+01 volume 8.09900 ppm1 4.309 ppm2 0.772 ASSI { 1162} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1162 weight 0.1000E+01 volume 87.43320 ppm1 4.186 ppm2 0.776 ASSI { 1172} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1172 weight 0.1000E+01 volume 53.55810 ppm1 2.069 ppm2 0.771 ASSI { 1182} (( segid "PROT" and resid 120 and name HG )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1182 weight 0.1000E+01 volume 50.60910 ppm1 1.784 ppm2 0.769 ASSI { 1192} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1192 weight 0.1000E+01 volume 30.96600 ppm1 1.565 ppm2 0.766 ASSI { 1202} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1202 weight 0.1000E+01 volume 144.27240 ppm1 1.310 ppm2 0.776 ASSI { 1212} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1212 weight 0.1000E+01 volume 201.40849 ppm1 1.036 ppm2 0.780 ASSI { 1222} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1222 weight 0.1000E+01 volume 112.37040 ppm1 0.505 ppm2 0.774 ASSI { 1232} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 1232 weight 0.1000E+01 volume 10.24130 ppm1 0.237 ppm2 0.767 ASSI { 1242} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 116 and name HG1# )) 6 6 0 peak 1242 weight 0.1000E+01 volume 200.55409 ppm1 0.774 ppm2 1.037 ASSI { 1252} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 116 and name HG1# )) 6 6 0 peak 1252 weight 0.1000E+01 volume 32.86770 ppm1 0.507 ppm2 1.031 ASSI { 1262} (( segid "PROT" and resid 83 and name HG )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 1262 weight 0.1000E+01 volume 226.13240 ppm1 1.406 ppm2 1.097 ASSI { 1272} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 116 and name HG1# )) 6 6 0 peak 1272 weight 0.1000E+01 volume 213.73801 ppm1 2.064 ppm2 1.032 ASSI { 1282} (( segid "PROT" and resid 116 and name HA )) (( segid "PROT" and resid 116 and name HG1# )) 6 6 0 peak 1282 weight 0.1000E+01 volume 189.18620 ppm1 3.680 ppm2 1.029 ASSI { 1292} (( segid "PROT" and resid 83 and name HA )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 1292 weight 0.1000E+01 volume 105.60280 ppm1 4.232 ppm2 1.102 ASSI { 1302} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 108 and name HA )) 6 6 0 peak 1302 weight 0.1000E+01 volume 44.18870 ppm1 0.959 ppm2 3.634 ASSI { 1312} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 108 and name HA )) 6 6 0 peak 1312 weight 0.1000E+01 volume 92.79360 ppm1 0.869 ppm2 3.636 ASSI { 1322} (( segid "PROT" and resid 108 and name HB )) (( segid "PROT" and resid 108 and name HA )) 6 6 0 peak 1322 weight 0.1000E+01 volume 54.47060 ppm1 2.173 ppm2 3.642 ASSI { 1332} (( segid "PROT" and resid 111 and name HB1 )) (( segid "PROT" and resid 108 and name HA )) 6 6 0 peak 1332 weight 0.1000E+01 volume 15.95010 ppm1 2.280 ppm2 3.646 ASSI { 1342} (( segid "PROT" and resid 111 and name HG2 )) (( segid "PROT" and resid 108 and name HA )) 6 6 0 peak 1342 weight 0.1000E+01 volume 7.70040 ppm1 2.440 ppm2 3.639 ASSI { 1352} (( segid "PROT" and resid 111 and name HG1 )) (( segid "PROT" and resid 108 and name HA )) 6 6 0 peak 1352 weight 0.1000E+01 volume 7.46140 ppm1 2.518 ppm2 3.638 ASSI { 1362} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 108 and name HB )) 6 6 0 peak 1362 weight 0.1000E+01 volume 84.95850 ppm1 3.637 ppm2 2.157 ASSI { 1372} (( segid "PROT" and resid 75 and name HD1 )) (( segid "PROT" and resid 73 and name HB1 )) 6 6 0 peak 1372 weight 0.1000E+01 volume 7.53360 ppm1 7.472 ppm2 2.182 ASSI { 1382} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 108 and name HB )) 6 6 0 peak 1382 weight 0.1000E+01 volume 125.84800 ppm1 0.957 ppm2 2.166 ASSI { 1392} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 108 and name HB )) 6 6 0 peak 1392 weight 0.1000E+01 volume 160.23050 ppm1 0.874 ppm2 2.157 ASSI { 1402} (( segid "PROT" and resid 108 and name HB )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 1402 weight 0.1000E+01 volume 234.80780 ppm1 2.159 ppm2 0.957 ASSI { 1412} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 1412 weight 0.1000E+01 volume 344.11609 ppm1 3.640 ppm2 0.961 ASSI { 1422} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 1422 weight 0.1000E+01 volume 130.96660 ppm1 3.636 ppm2 0.869 ASSI { 1432} (( segid "PROT" and resid 112 and name HG1 )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 1432 weight 0.1000E+01 volume 4.62730 ppm1 2.502 ppm2 0.869 ASSI { 1442} (( segid "PROT" and resid 107 and name HB1 )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 1442 weight 0.1000E+01 volume 5.86030 ppm1 2.282 ppm2 0.867 ASSI { 1452} (( segid "PROT" and resid 108 and name HB )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 1452 weight 0.1000E+01 volume 115.80970 ppm1 2.158 ppm2 0.866 ASSI { 1462} (( segid "PROT" and resid 95 and name HA )) (( segid "PROT" and resid 95 and name HB )) 6 6 0 peak 1462 weight 0.1000E+01 volume 91.62050 ppm1 4.100 ppm2 4.441 ASSI { 1472} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 113 and name HA )) 6 6 0 peak 1472 weight 0.1000E+01 volume 89.40790 ppm1 0.721 ppm2 4.092 ASSI { 1482} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 113 and name HA )) 6 6 0 peak 1482 weight 0.1000E+01 volume 106.11620 ppm1 0.887 ppm2 4.100 ASSI { 1492} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 113 and name HA )) 6 6 0 peak 1492 weight 0.1000E+01 volume 16.86400 ppm1 1.038 ppm2 4.091 ASSI { 1502} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 113 and name HA )) 6 6 0 peak 1502 weight 0.1000E+01 volume 40.45630 ppm1 1.302 ppm2 4.088 ASSI { 1512} (( segid "PROT" and resid 113 and name HA )) (( segid "PROT" and resid 113 and name HB )) 6 6 0 peak 1512 weight 0.1000E+01 volume 28.79750 ppm1 4.093 ppm2 0.714 ASSI { 1522} (( segid "PROT" and resid 113 and name HA )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 1522 weight 0.1000E+01 volume 127.10770 ppm1 4.092 ppm2 0.887 ASSI { 1532} (( segid "PROT" and resid 113 and name HG11 )) (( segid "PROT" and resid 113 and name HA )) 6 6 0 peak 1532 weight 0.1000E+01 volume 27.61300 ppm1 1.211 ppm2 4.090 ASSI { 1542} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 14 and name HA )) 6 6 0 peak 1542 weight 0.1000E+01 volume 24.43540 ppm1 0.355 ppm2 3.792 ASSI { 1552} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 14 and name HA )) 6 6 0 peak 1552 weight 0.1000E+01 volume 44.36870 ppm1 0.269 ppm2 3.789 ASSI { 1562} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 14 and name HA )) 6 6 0 peak 1562 weight 0.1000E+01 volume 7.17490 ppm1 0.657 ppm2 3.793 ASSI { 1572} (( segid "PROT" and resid 14 and name HB2 )) (( segid "PROT" and resid 14 and name HA )) 6 6 0 peak 1572 weight 0.1000E+01 volume 49.42990 ppm1 1.321 ppm2 3.786 ASSI { 1582} (( segid "PROT" and resid 14 and name HG )) (( segid "PROT" and resid 14 and name HA )) 6 6 0 peak 1582 weight 0.1000E+01 volume 29.86880 ppm1 1.388 ppm2 3.783 ASSI { 1592} (( segid "PROT" and resid 14 and name HB1 )) (( segid "PROT" and resid 14 and name HA )) 6 6 0 peak 1592 weight 0.1000E+01 volume 60.01140 ppm1 1.658 ppm2 3.793 ASSI { 1602} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 14 and name HB1 )) 6 6 0 peak 1602 weight 0.1000E+01 volume 41.00990 ppm1 0.354 ppm2 1.644 ASSI { 1612} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 14 and name HB2 )) 6 6 0 peak 1612 weight 0.1000E+01 volume 15.96660 ppm1 0.353 ppm2 1.310 ASSI { 1622} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 14 and name HB1 )) 6 6 0 peak 1622 weight 0.1000E+01 volume 20.91850 ppm1 0.268 ppm2 1.651 ASSI { 1632} (( segid "PROT" and resid 14 and name HB2 )) (( segid "PROT" and resid 14 and name HB1 )) 6 6 0 peak 1632 weight 0.1000E+01 volume 85.75330 ppm1 1.304 ppm2 1.657 ASSI { 1642} (( segid "PROT" and resid 14 and name HG )) (( segid "PROT" and resid 14 and name HB2 )) 6 6 0 peak 1642 weight 0.1000E+01 volume 25.45920 ppm1 1.401 ppm2 1.295 ASSI { 1652} (( segid "PROT" and resid 14 and name HG )) (( segid "PROT" and resid 14 and name HB1 )) 6 6 0 peak 1652 weight 0.1000E+01 volume 36.95480 ppm1 1.400 ppm2 1.653 ASSI { 1662} (( segid "PROT" and resid 14 and name HB1 )) (( segid "PROT" and resid 14 and name HB2 )) 6 6 0 peak 1662 weight 0.1000E+01 volume 112.79770 ppm1 1.655 ppm2 1.304 ASSI { 1672} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 14 and name HB2 )) 6 6 0 peak 1672 weight 0.1000E+01 volume 63.79600 ppm1 3.787 ppm2 1.319 ASSI { 1682} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 14 and name HB1 )) 6 6 0 peak 1682 weight 0.1000E+01 volume 40.22970 ppm1 3.789 ppm2 1.653 ASSI { 1692} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 14 and name HB1 )) 6 6 0 peak 1692 weight 0.1000E+01 volume 10.63440 ppm1 4.232 ppm2 1.661 ASSI { 1702} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 14 and name HG )) 6 6 0 peak 1702 weight 0.1000E+01 volume 89.43150 ppm1 0.353 ppm2 1.399 ASSI { 1712} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 14 and name HG )) 6 6 0 peak 1712 weight 0.1000E+01 volume 48.24370 ppm1 0.262 ppm2 1.401 ASSI { 1722} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 14 and name HG )) 6 6 0 peak 1722 weight 0.1000E+01 volume 21.08080 ppm1 3.790 ppm2 1.402 ASSI { 1732} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 1732 weight 0.1000E+01 volume 49.40220 ppm1 7.365 ppm2 0.390 ASSI { 1742} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 1742 weight 0.1000E+01 volume 46.10010 ppm1 6.059 ppm2 0.394 ASSI { 1752} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1752 weight 0.1000E+01 volume 206.81509 ppm1 3.784 ppm2 0.268 ASSI { 1762} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1762 weight 0.1000E+01 volume 157.07230 ppm1 0.610 ppm2 0.265 ASSI { 1772} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1772 weight 0.1000E+01 volume 36.74140 ppm1 0.658 ppm2 0.268 ASSI { 1782} (( segid "PROT" and resid 14 and name HG )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1782 weight 0.1000E+01 volume 156.77271 ppm1 1.402 ppm2 0.265 ASSI { 1792} (( segid "PROT" and resid 14 and name HB2 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1792 weight 0.1000E+01 volume 136.64410 ppm1 1.311 ppm2 0.270 ASSI { 1802} (( segid "PROT" and resid 14 and name HB1 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1802 weight 0.1000E+01 volume 65.06140 ppm1 1.653 ppm2 0.266 ASSI { 1812} (( segid "PROT" and resid 77 and name HB2 )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 1812 weight 0.1000E+01 volume 122.72260 ppm1 1.776 ppm2 0.231 ASSI { 1822} (( segid "PROT" and resid 74 and name HD2 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1822 weight 0.1000E+01 volume 48.86510 ppm1 2.764 ppm2 0.265 ASSI { 1832} (( segid "PROT" and resid 9 and name HB1 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1832 weight 0.1000E+01 volume 57.34080 ppm1 2.865 ppm2 0.266 ASSI { 1842} (( segid "PROT" and resid 72 and name HA )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1842 weight 0.1000E+01 volume 16.11780 ppm1 4.292 ppm2 0.266 ASSI { 1852} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1852 weight 0.1000E+01 volume 40.65220 ppm1 4.629 ppm2 0.266 ASSI { 1862} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1862 weight 0.1000E+01 volume 10.76020 ppm1 7.329 ppm2 0.266 ASSI { 1872} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 1872 weight 0.1000E+01 volume 17.67770 ppm1 7.389 ppm2 0.265 ASSI { 1882} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 21 and name HA )) 6 6 0 peak 1882 weight 0.1000E+01 volume 25.70330 ppm1 1.303 ppm2 4.142 ASSI { 1892} (( segid "PROT" and resid 24 and name HB# )) (( segid "PROT" and resid 21 and name HA )) 6 6 0 peak 1892 weight 0.1000E+01 volume 30.09650 ppm1 1.411 ppm2 4.145 ASSI { 1902} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 1902 weight 0.1000E+01 volume 61.99870 ppm1 1.301 ppm2 4.197 ASSI { 1912} (( segid "PROT" and resid 21 and name HB )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 1912 weight 0.1000E+01 volume 169.42410 ppm1 4.187 ppm2 1.304 ASSI { 1922} (( segid "PROT" and resid 21 and name HA )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 1922 weight 0.1000E+01 volume 104.10790 ppm1 4.131 ppm2 1.303 ASSI { 1932} (( segid "PROT" and resid 112 and name HG1 )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 1932 weight 0.1000E+01 volume 17.54770 ppm1 2.499 ppm2 1.308 ASSI { 1942} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 1942 weight 0.1000E+01 volume 43.18980 ppm1 2.068 ppm2 1.299 ASSI { 1952} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 1952 weight 0.1000E+01 volume 45.74860 ppm1 1.760 ppm2 1.303 ASSI { 1962} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 1962 weight 0.1000E+01 volume 26.21720 ppm1 0.504 ppm2 1.303 ASSI { 1972} (( segid "PROT" and resid 95 and name HA )) (( segid "PROT" and resid 95 and name HG2# )) 6 6 0 peak 1972 weight 0.1000E+01 volume 152.49719 ppm1 4.102 ppm2 1.120 ASSI { 1982} (( segid "PROT" and resid 95 and name HB )) (( segid "PROT" and resid 95 and name HG2# )) 6 6 0 peak 1982 weight 0.1000E+01 volume 176.49609 ppm1 4.440 ppm2 1.117 ASSI { 1992} (( segid "PROT" and resid 95 and name HG2# )) (( segid "PROT" and resid 95 and name HB )) 6 6 0 peak 1992 weight 0.1000E+01 volume 91.16990 ppm1 1.118 ppm2 4.437 ASSI { 2002} (( segid "PROT" and resid 95 and name HB )) (( segid "PROT" and resid 95 and name HA )) 6 6 0 peak 2002 weight 0.1000E+01 volume 90.14380 ppm1 4.440 ppm2 4.102 ASSI { 2012} (( segid "PROT" and resid 95 and name HG2# )) (( segid "PROT" and resid 95 and name HA )) 6 6 0 peak 2012 weight 0.1000E+01 volume 158.24260 ppm1 1.111 ppm2 4.091 ASSI { 2022} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 68 and name HB )) 6 6 0 peak 2022 weight 0.1000E+01 volume 40.95950 ppm1 1.227 ppm2 4.510 ASSI { 2032} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 68 and name HA )) 6 6 0 peak 2032 weight 0.1000E+01 volume 44.34220 ppm1 1.225 ppm2 4.501 ASSI { 2042} (( segid "PROT" and resid 68 and name HB )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 2042 weight 0.1000E+01 volume 231.31461 ppm1 4.511 ppm2 1.225 ASSI { 2052} (( segid "PROT" and resid 64 and name HD1 )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 2052 weight 0.1000E+01 volume 13.17220 ppm1 3.220 ppm2 1.222 ASSI { 2062} (( segid "PROT" and resid 67 and name HB1 )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 2062 weight 0.1000E+01 volume 21.06010 ppm1 2.845 ppm2 1.226 ASSI { 2072} (( segid "PROT" and resid 61 and name HG2# )) (( segid "PROT" and resid 61 and name HB )) 6 6 0 peak 2072 weight 0.1000E+01 volume 151.98930 ppm1 1.136 ppm2 4.224 ASSI { 2082} (( segid "PROT" and resid 61 and name HA )) (( segid "PROT" and resid 61 and name HB )) 6 6 0 peak 2082 weight 0.1000E+01 volume 22.02180 ppm1 3.883 ppm2 4.230 ASSI { 2092} (( segid "PROT" and resid 61 and name HB )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 2092 weight 0.1000E+01 volume 187.27130 ppm1 4.231 ppm2 1.137 ASSI { 2102} (( segid "PROT" and resid 61 and name HA )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 2102 weight 0.1000E+01 volume 188.89720 ppm1 3.880 ppm2 1.132 ASSI { 2112} (( segid "PROT" and resid 57 and name HA )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 2112 weight 0.1000E+01 volume 4.26280 ppm1 5.068 ppm2 1.138 ASSI { 2122} (( segid "PROT" and resid 63 and name HB1 )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 2122 weight 0.1000E+01 volume 161.26601 ppm1 1.993 ppm2 1.139 ASSI { 2132} (( segid "PROT" and resid 119 and name HB2 )) (( segid "PROT" and resid 119 and name HA )) 6 6 0 peak 2132 weight 0.1000E+01 volume 31.62980 ppm1 3.980 ppm2 4.434 ASSI { 2142} (( segid "PROT" and resid 119 and name HB1 )) (( segid "PROT" and resid 119 and name HA )) 6 6 0 peak 2142 weight 0.1000E+01 volume 98.08780 ppm1 4.029 ppm2 4.431 ASSI { 2152} (( segid "PROT" and resid 119 and name HA )) (( segid "PROT" and resid 119 and name HB2 )) 6 6 0 peak 2152 weight 0.1000E+01 volume 130.04190 ppm1 4.435 ppm2 3.979 ASSI { 2162} (( segid "PROT" and resid 119 and name HA )) (( segid "PROT" and resid 119 and name HB1 )) 6 6 0 peak 2162 weight 0.1000E+01 volume 109.23970 ppm1 4.432 ppm2 4.056 ASSI { 2172} (( segid "PROT" and resid 39 and name HG1# )) (( segid "PROT" and resid 39 and name HA )) 6 6 0 peak 2172 weight 0.1000E+01 volume 152.79201 ppm1 0.739 ppm2 3.207 ASSI { 2182} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 39 and name HA )) 6 6 0 peak 2182 weight 0.1000E+01 volume 33.09180 ppm1 -0.356 ppm2 3.196 ASSI { 2192} (( segid "PROT" and resid 39 and name HB )) (( segid "PROT" and resid 39 and name HA )) 6 6 0 peak 2192 weight 0.1000E+01 volume 32.27610 ppm1 1.472 ppm2 3.205 ASSI { 2202} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2202 weight 0.1000E+01 volume 48.37840 ppm1 1.262 ppm2 3.067 ASSI { 2212} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2212 weight 0.1000E+01 volume 51.20600 ppm1 1.111 ppm2 3.062 ASSI { 2222} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2222 weight 0.1000E+01 volume 5.25770 ppm1 -1.499 ppm2 3.060 ASSI { 2232} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2232 weight 0.1000E+01 volume 18.75270 ppm1 -0.257 ppm2 3.064 ASSI { 2242} (( segid "PROT" and resid 81 and name HB )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2242 weight 0.1000E+01 volume 47.11970 ppm1 0.871 ppm2 3.062 ASSI { 2252} (( segid "PROT" and resid 78 and name HB )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2252 weight 0.1000E+01 volume 12.87480 ppm1 2.274 ppm2 3.065 ASSI { 2262} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2262 weight 0.1000E+01 volume 1.46950 ppm1 6.723 ppm2 3.060 ASSI { 2272} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2272 weight 0.1000E+01 volume 19.42420 ppm1 6.855 ppm2 3.064 ASSI { 2282} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2282 weight 0.1000E+01 volume 7.13650 ppm1 7.199 ppm2 3.062 ASSI { 2292} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 2292 weight 0.1000E+01 volume 1.66130 ppm1 7.474 ppm2 3.071 ASSI { 2302} (( segid "PROT" and resid 78 and name HA )) (( segid "PROT" and resid 78 and name HB )) 6 6 0 peak 2302 weight 0.1000E+01 volume 9.16470 ppm1 3.064 ppm2 2.277 ASSI { 2312} (( segid "PROT" and resid 75 and name HA )) (( segid "PROT" and resid 78 and name HB )) 6 6 0 peak 2312 weight 0.1000E+01 volume 38.49320 ppm1 4.206 ppm2 2.273 ASSI { 2322} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 78 and name HB )) 6 6 0 peak 2322 weight 0.1000E+01 volume 66.00090 ppm1 1.261 ppm2 2.277 ASSI { 2332} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 78 and name HB )) 6 6 0 peak 2332 weight 0.1000E+01 volume 57.55440 ppm1 1.112 ppm2 2.280 ASSI { 2342} (( segid "PROT" and resid 78 and name HA )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 2342 weight 0.1000E+01 volume 92.29730 ppm1 3.067 ppm2 1.114 ASSI { 2352} (( segid "PROT" and resid 78 and name HA )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 2352 weight 0.1000E+01 volume 69.66290 ppm1 3.068 ppm2 1.262 ASSI { 2362} (( segid "PROT" and resid 78 and name HB )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 2362 weight 0.1000E+01 volume 178.35780 ppm1 2.271 ppm2 1.114 ASSI { 2372} (( segid "PROT" and resid 78 and name HB )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 2372 weight 0.1000E+01 volume 134.77161 ppm1 2.272 ppm2 1.262 ASSI { 2382} (( segid "PROT" and resid 82 and name HB1 )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 2382 weight 0.1000E+01 volume 6.32500 ppm1 3.283 ppm2 1.256 ASSI { 2392} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 2392 weight 0.1000E+01 volume 50.24850 ppm1 6.721 ppm2 1.117 ASSI { 2402} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 2402 weight 0.1000E+01 volume 18.81290 ppm1 7.039 ppm2 1.262 ASSI { 2412} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 2412 weight 0.1000E+01 volume 6.99400 ppm1 7.041 ppm2 1.115 ASSI { 2422} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 2422 weight 0.1000E+01 volume 17.50460 ppm1 6.851 ppm2 1.110 ASSI { 2432} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 2432 weight 0.1000E+01 volume 22.40130 ppm1 6.855 ppm2 1.259 ASSI { 2442} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 2442 weight 0.1000E+01 volume 75.83130 ppm1 7.188 ppm2 1.259 ASSI { 2452} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 2452 weight 0.1000E+01 volume 51.62180 ppm1 7.191 ppm2 1.117 ASSI { 2462} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 2462 weight 0.1000E+01 volume 179.66679 ppm1 7.479 ppm2 1.259 ASSI { 2472} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 2472 weight 0.1000E+01 volume 36.35320 ppm1 -0.257 ppm2 2.473 ASSI { 2482} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 2482 weight 0.1000E+01 volume 31.94750 ppm1 -1.494 ppm2 2.473 ASSI { 2492} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 2492 weight 0.1000E+01 volume 24.04270 ppm1 0.345 ppm2 2.473 ASSI { 2502} (( segid "PROT" and resid 81 and name HB )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 2502 weight 0.1000E+01 volume 15.61880 ppm1 0.876 ppm2 2.478 ASSI { 2512} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 2512 weight 0.1000E+01 volume 13.62240 ppm1 1.199 ppm2 2.478 ASSI { 2522} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 81 and name HB )) 6 6 0 peak 2522 weight 0.1000E+01 volume 59.71540 ppm1 -0.256 ppm2 0.871 ASSI { 2532} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 81 and name HB )) 6 6 0 peak 2532 weight 0.1000E+01 volume 64.00240 ppm1 -1.493 ppm2 0.872 ASSI { 2542} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 62 and name HG12 )) 6 6 0 peak 2542 weight 0.1000E+01 volume 25.16840 ppm1 0.346 ppm2 0.881 ASSI { 2552} (( segid "PROT" and resid 81 and name HA )) (( segid "PROT" and resid 81 and name HB )) 6 6 0 peak 2552 weight 0.1000E+01 volume 21.66080 ppm1 2.476 ppm2 0.866 ASSI { 2562} (( segid "PROT" and resid 78 and name HA )) (( segid "PROT" and resid 81 and name HB )) 6 6 0 peak 2562 weight 0.1000E+01 volume 21.90610 ppm1 3.066 ppm2 0.871 ASSI { 2572} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 81 and name HB )) 6 6 0 peak 2572 weight 0.1000E+01 volume 2.95010 ppm1 6.851 ppm2 0.864 ASSI { 2582} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2582 weight 0.1000E+01 volume 111.43620 ppm1 0.344 ppm2 -0.258 ASSI { 2592} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2592 weight 0.1000E+01 volume 10.69050 ppm1 0.347 ppm2 -1.491 ASSI { 2602} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2602 weight 0.1000E+01 volume 10.76200 ppm1 0.580 ppm2 -0.264 ASSI { 2612} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2612 weight 0.1000E+01 volume 12.34170 ppm1 0.580 ppm2 -1.498 ASSI { 2622} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2622 weight 0.1000E+01 volume 27.91990 ppm1 0.676 ppm2 -0.262 ASSI { 2632} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2632 weight 0.1000E+01 volume 43.34050 ppm1 0.671 ppm2 -1.501 ASSI { 2642} (( segid "PROT" and resid 81 and name HB )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2642 weight 0.1000E+01 volume 141.60159 ppm1 0.873 ppm2 -0.258 ASSI { 2652} (( segid "PROT" and resid 81 and name HB )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2652 weight 0.1000E+01 volume 113.98910 ppm1 0.884 ppm2 -1.495 ASSI { 2662} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2662 weight 0.1000E+01 volume 18.81060 ppm1 1.184 ppm2 -0.264 ASSI { 2672} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2672 weight 0.1000E+01 volume 37.98870 ppm1 1.243 ppm2 -1.498 ASSI { 2682} (( segid "PROT" and resid 81 and name HA )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2682 weight 0.1000E+01 volume 95.21840 ppm1 2.476 ppm2 -0.265 ASSI { 2692} (( segid "PROT" and resid 81 and name HA )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2692 weight 0.1000E+01 volume 52.34660 ppm1 2.478 ppm2 -1.498 ASSI { 2702} (( segid "PROT" and resid 78 and name HB )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2702 weight 0.1000E+01 volume 2.87870 ppm1 2.216 ppm2 -0.255 ASSI { 2712} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2712 weight 0.1000E+01 volume 12.71510 ppm1 1.250 ppm2 -0.260 ASSI { 2722} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2722 weight 0.1000E+01 volume 66.61340 ppm1 1.107 ppm2 -0.258 ASSI { 2732} (( segid "PROT" and resid 78 and name HA )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2732 weight 0.1000E+01 volume 31.11850 ppm1 3.066 ppm2 -0.260 ASSI { 2742} (( segid "PROT" and resid 78 and name HA )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2742 weight 0.1000E+01 volume 18.75960 ppm1 3.067 ppm2 -1.491 ASSI { 2752} (( segid "PROT" and resid 82 and name HA )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2752 weight 0.1000E+01 volume 7.29660 ppm1 3.985 ppm2 -1.496 ASSI { 2762} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2762 weight 0.1000E+01 volume 7.85210 ppm1 6.059 ppm2 -0.250 ASSI { 2772} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2772 weight 0.1000E+01 volume 59.92750 ppm1 6.058 ppm2 -1.489 ASSI { 2782} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2782 weight 0.1000E+01 volume 25.05450 ppm1 6.615 ppm2 -0.257 ASSI { 2792} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2792 weight 0.1000E+01 volume 26.11970 ppm1 6.862 ppm2 -0.253 ASSI { 2802} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2802 weight 0.1000E+01 volume 11.29120 ppm1 6.853 ppm2 -1.501 ASSI { 2812} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2812 weight 0.1000E+01 volume 13.98190 ppm1 6.721 ppm2 -0.255 ASSI { 2822} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2822 weight 0.1000E+01 volume 7.54150 ppm1 7.042 ppm2 -0.257 ASSI { 2832} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 2832 weight 0.1000E+01 volume 35.29490 ppm1 7.186 ppm2 -0.257 ASSI { 2842} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2842 weight 0.1000E+01 volume 21.15590 ppm1 7.193 ppm2 -1.498 ASSI { 2852} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 2852 weight 0.1000E+01 volume 19.79640 ppm1 7.045 ppm2 -1.496 ASSI { 2862} (( segid "PROT" and resid 98 and name HG1# )) (( segid "PROT" and resid 98 and name HA )) 6 6 0 peak 2862 weight 0.1000E+01 volume 11.10700 ppm1 0.812 ppm2 3.292 ASSI { 2872} (( segid "PROT" and resid 98 and name HG2# )) (( segid "PROT" and resid 98 and name HA )) 6 6 0 peak 2872 weight 0.1000E+01 volume 8.21310 ppm1 0.633 ppm2 3.287 ASSI { 2882} (( segid "PROT" and resid 98 and name HB )) (( segid "PROT" and resid 98 and name HA )) 6 6 0 peak 2882 weight 0.1000E+01 volume 7.47530 ppm1 1.661 ppm2 3.294 ASSI { 2892} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 74 and name HB1 )) 6 6 0 peak 2892 weight 0.1000E+01 volume 13.59900 ppm1 0.351 ppm2 1.787 ASSI { 2902} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 74 and name HB1 )) 6 6 0 peak 2902 weight 0.1000E+01 volume 26.02210 ppm1 0.256 ppm2 1.784 ASSI { 2912} (( segid "PROT" and resid 25 and name HB1 )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 2912 weight 0.1000E+01 volume 33.23340 ppm1 2.295 ppm2 0.892 ASSI { 2922} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 2922 weight 0.1000E+01 volume 342.00119 ppm1 0.673 ppm2 0.898 ASSI { 2932} (( segid "PROT" and resid 75 and name HB2 )) (( segid "PROT" and resid 75 and name HA )) 6 6 0 peak 2932 weight 0.1000E+01 volume 61.23800 ppm1 3.258 ppm2 4.191 ASSI { 2942} (( segid "PROT" and resid 75 and name HB1 )) (( segid "PROT" and resid 75 and name HA )) 6 6 0 peak 2942 weight 0.1000E+01 volume 54.08290 ppm1 3.608 ppm2 4.197 ASSI { 2952} (( segid "PROT" and resid 75 and name HE3 )) (( segid "PROT" and resid 75 and name HA )) 6 6 0 peak 2952 weight 0.1000E+01 volume 14.06620 ppm1 7.546 ppm2 4.198 ASSI { 2962} (( segid "PROT" and resid 75 and name HD1 )) (( segid "PROT" and resid 75 and name HA )) 6 6 0 peak 2962 weight 0.1000E+01 volume 9.75600 ppm1 7.483 ppm2 4.197 ASSI { 2972} (( segid "PROT" and resid 75 and name HA )) (( segid "PROT" and resid 75 and name HB1 )) 6 6 0 peak 2972 weight 0.1000E+01 volume 25.16260 ppm1 4.204 ppm2 3.610 ASSI { 2982} (( segid "PROT" and resid 75 and name HA )) (( segid "PROT" and resid 75 and name HB2 )) 6 6 0 peak 2982 weight 0.1000E+01 volume 40.41210 ppm1 4.204 ppm2 3.262 ASSI { 2992} (( segid "PROT" and resid 75 and name HB2 )) (( segid "PROT" and resid 75 and name HB1 )) 6 6 0 peak 2992 weight 0.1000E+01 volume 71.71010 ppm1 3.260 ppm2 3.607 ASSI { 3002} (( segid "PROT" and resid 75 and name HB1 )) (( segid "PROT" and resid 75 and name HB2 )) 6 6 0 peak 3002 weight 0.1000E+01 volume 65.55940 ppm1 3.602 ppm2 3.277 ASSI { 3012} (( segid "PROT" and resid 75 and name HE3 )) (( segid "PROT" and resid 75 and name HB2 )) 6 6 0 peak 3012 weight 0.1000E+01 volume 8.30950 ppm1 7.540 ppm2 3.264 ASSI { 3022} (( segid "PROT" and resid 75 and name HD1 )) (( segid "PROT" and resid 75 and name HB2 )) 6 6 0 peak 3022 weight 0.1000E+01 volume 18.21170 ppm1 7.477 ppm2 3.268 ASSI { 3032} (( segid "PROT" and resid 75 and name HE3 )) (( segid "PROT" and resid 75 and name HB1 )) 6 6 0 peak 3032 weight 0.1000E+01 volume 4.31320 ppm1 7.546 ppm2 3.597 ASSI { 3042} (( segid "PROT" and resid 75 and name HD1 )) (( segid "PROT" and resid 75 and name HB1 )) 6 6 0 peak 3042 weight 0.1000E+01 volume 14.44380 ppm1 7.476 ppm2 3.600 ASSI { 3052} (( segid "PROT" and resid 82 and name HA )) (( segid "PROT" and resid 82 and name HB2 )) 6 6 0 peak 3052 weight 0.1000E+01 volume 6.56470 ppm1 3.984 ppm2 3.103 ASSI { 3062} (( segid "PROT" and resid 82 and name HA )) (( segid "PROT" and resid 82 and name HB1 )) 6 6 0 peak 3062 weight 0.1000E+01 volume 8.79410 ppm1 3.982 ppm2 3.296 ASSI { 3072} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 82 and name HB1 )) 6 6 0 peak 3072 weight 0.1000E+01 volume 7.76700 ppm1 7.477 ppm2 3.290 ASSI { 3082} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 82 and name HB2 )) 6 6 0 peak 3082 weight 0.1000E+01 volume 6.51620 ppm1 7.473 ppm2 3.099 ASSI { 3092} (( segid "PROT" and resid 82 and name HE3 )) (( segid "PROT" and resid 82 and name HB1 )) 6 6 0 peak 3092 weight 0.1000E+01 volume 4.78570 ppm1 7.899 ppm2 3.277 ASSI { 3102} (( segid "PROT" and resid 82 and name HB1 )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 3102 weight 0.1000E+01 volume 8.59740 ppm1 3.289 ppm2 3.973 ASSI { 3112} (( segid "PROT" and resid 82 and name HB2 )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 3112 weight 0.1000E+01 volume 20.69740 ppm1 3.097 ppm2 3.973 ASSI { 3122} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 3122 weight 0.1000E+01 volume 1.37620 ppm1 -1.494 ppm2 3.977 ASSI { 3132} (( segid "PROT" and resid 85 and name HD1 )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 3132 weight 0.1000E+01 volume 19.77790 ppm1 6.058 ppm2 3.980 ASSI { 3142} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 3142 weight 0.1000E+01 volume 7.80500 ppm1 7.483 ppm2 3.975 ASSI { 3152} (( segid "PROT" and resid 82 and name HE3 )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 3152 weight 0.1000E+01 volume 19.28220 ppm1 7.897 ppm2 3.978 ASSI { 3162} (( segid "PROT" and resid 55 and name HB1 )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 3162 weight 0.1000E+01 volume 45.11730 ppm1 2.737 ppm2 5.243 ASSI { 3172} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 3172 weight 0.1000E+01 volume 67.87960 ppm1 5.248 ppm2 2.741 ASSI { 3182} (( segid "PROT" and resid 56 and name HG2 )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 3182 weight 0.1000E+01 volume 10.12780 ppm1 1.981 ppm2 5.245 ASSI { 3192} (( segid "PROT" and resid 56 and name HG1 )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 3192 weight 0.1000E+01 volume 9.11060 ppm1 2.136 ppm2 5.247 ASSI { 3202} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 3202 weight 0.1000E+01 volume 55.59060 ppm1 3.443 ppm2 5.245 ASSI { 3212} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 3212 weight 0.1000E+01 volume 68.13080 ppm1 3.693 ppm2 5.243 ASSI { 3222} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 3222 weight 0.1000E+01 volume 90.50010 ppm1 0.886 ppm2 2.732 ASSI { 3232} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 3232 weight 0.1000E+01 volume 74.02950 ppm1 1.106 ppm2 2.737 ASSI { 3242} (( segid "PROT" and resid 51 and name HB1 )) (( segid "PROT" and resid 51 and name HB2 )) 6 6 0 peak 3242 weight 0.1000E+01 volume 87.73130 ppm1 2.946 ppm2 2.683 ASSI { 3252} (( segid "PROT" and resid 51 and name HB2 )) (( segid "PROT" and resid 51 and name HB1 )) 6 6 0 peak 3252 weight 0.1000E+01 volume 226.56210 ppm1 2.693 ppm2 2.914 ASSI { 3262} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 3262 weight 0.1000E+01 volume 7.42510 ppm1 3.439 ppm2 2.734 ASSI { 3272} (( segid "PROT" and resid 26 and name HB1 )) (( segid "PROT" and resid 26 and name HA )) 6 6 0 peak 3272 weight 0.1000E+01 volume 21.02190 ppm1 2.894 ppm2 3.707 ASSI { 3282} (( segid "PROT" and resid 26 and name HA )) (( segid "PROT" and resid 26 and name HB1 )) 6 6 0 peak 3282 weight 0.1000E+01 volume 28.30750 ppm1 3.712 ppm2 2.898 ASSI { 3292} (( segid "PROT" and resid 23 and name HA )) (( segid "PROT" and resid 26 and name HB1 )) 6 6 0 peak 3292 weight 0.1000E+01 volume 58.24110 ppm1 4.023 ppm2 2.898 ASSI { 3302} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 26 and name HB1 )) 6 6 0 peak 3302 weight 0.1000E+01 volume 9.91860 ppm1 6.610 ppm2 2.890 ASSI { 3312} (( segid "PROT" and resid 26 and name HD1 )) (( segid "PROT" and resid 26 and name HB1 )) 6 6 0 peak 3312 weight 0.1000E+01 volume 46.08170 ppm1 6.964 ppm2 2.893 ASSI { 3322} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 26 and name HA )) 6 6 0 peak 3322 weight 0.1000E+01 volume 16.84180 ppm1 0.233 ppm2 3.709 ASSI { 3332} (( segid "PROT" and resid 32 and name HA )) (( segid "PROT" and resid 26 and name HA )) 6 6 0 peak 3332 weight 0.1000E+01 volume 8.80900 ppm1 4.383 ppm2 3.706 ASSI { 3342} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 26 and name HA )) 6 6 0 peak 3342 weight 0.1000E+01 volume 1.22800 ppm1 6.609 ppm2 3.709 ASSI { 3352} (( segid "PROT" and resid 80 and name HB1 )) (( segid "PROT" and resid 77 and name HA )) 6 6 0 peak 3352 weight 0.1000E+01 volume 7.44120 ppm1 2.792 ppm2 3.386 ASSI { 3362} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 77 and name HA )) 6 6 0 peak 3362 weight 0.1000E+01 volume 7.46970 ppm1 2.641 ppm2 3.381 ASSI { 3372} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 77 and name HA )) 6 6 0 peak 3372 weight 0.1000E+01 volume 5.09310 ppm1 0.238 ppm2 3.383 ASSI { 3382} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 77 and name HA )) 6 6 0 peak 3382 weight 0.1000E+01 volume 16.30600 ppm1 6.727 ppm2 3.380 ASSI { 3392} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 77 and name HB1 )) 6 6 0 peak 3392 weight 0.1000E+01 volume 15.84400 ppm1 0.236 ppm2 2.655 ASSI { 3402} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 77 and name HB2 )) 6 6 0 peak 3402 weight 0.1000E+01 volume 11.69410 ppm1 6.725 ppm2 2.657 ASSI { 3412} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 77 and name HB2 )) 6 6 0 peak 3412 weight 0.1000E+01 volume 7.83430 ppm1 6.623 ppm2 2.646 ASSI { 3422} (( segid "PROT" and resid 50 and name HD1 )) (( segid "PROT" and resid 50 and name HA )) 6 6 0 peak 3422 weight 0.1000E+01 volume 42.78790 ppm1 7.431 ppm2 4.978 ASSI { 3432} (( segid "PROT" and resid 50 and name HB1 )) (( segid "PROT" and resid 50 and name HA )) 6 6 0 peak 3432 weight 0.1000E+01 volume 22.65440 ppm1 3.483 ppm2 4.974 ASSI { 3442} (( segid "PROT" and resid 50 and name HD1 )) (( segid "PROT" and resid 50 and name HB2 )) 6 6 0 peak 3442 weight 0.1000E+01 volume 8.26030 ppm1 7.437 ppm2 2.941 ASSI { 3452} (( segid "PROT" and resid 50 and name HD1 )) (( segid "PROT" and resid 50 and name HB1 )) 6 6 0 peak 3452 weight 0.1000E+01 volume 7.84250 ppm1 7.437 ppm2 3.484 ASSI { 3462} (( segid "PROT" and resid 50 and name HB2 )) (( segid "PROT" and resid 50 and name HA )) 6 6 0 peak 3462 weight 0.1000E+01 volume 23.74040 ppm1 2.934 ppm2 4.976 ASSI { 3472} (( segid "PROT" and resid 50 and name HA )) (( segid "PROT" and resid 50 and name HB1 )) 6 6 0 peak 3472 weight 0.1000E+01 volume 10.56030 ppm1 4.979 ppm2 3.486 ASSI { 3482} (( segid "PROT" and resid 50 and name HA )) (( segid "PROT" and resid 50 and name HB2 )) 6 6 0 peak 3482 weight 0.1000E+01 volume 8.56060 ppm1 4.982 ppm2 2.939 ASSI { 3492} (( segid "PROT" and resid 50 and name HB1 )) (( segid "PROT" and resid 50 and name HB2 )) 6 6 0 peak 3492 weight 0.1000E+01 volume 51.68760 ppm1 3.476 ppm2 2.939 ASSI { 3502} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 91 and name HA )) 6 6 0 peak 3502 weight 0.1000E+01 volume 35.00980 ppm1 6.944 ppm2 4.009 ASSI { 3512} (( segid "PROT" and resid 49 and name HB1 )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 3512 weight 0.1000E+01 volume 11.49640 ppm1 2.750 ppm2 3.581 ASSI { 3522} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 52 and name HA )) 6 6 0 peak 3522 weight 0.1000E+01 volume 100.59170 ppm1 0.992 ppm2 3.995 ASSI { 3532} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 3532 weight 0.1000E+01 volume 16.56270 ppm1 0.447 ppm2 1.819 ASSI { 3542} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 62 and name HA )) 6 6 0 peak 3542 weight 0.1000E+01 volume 13.32960 ppm1 0.348 ppm2 3.915 ASSI { 3552} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 62 and name HB )) 6 6 0 peak 3552 weight 0.1000E+01 volume 30.26840 ppm1 0.346 ppm2 1.689 ASSI { 3562} (( segid "PROT" and resid 62 and name HA )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3562 weight 0.1000E+01 volume 21.01510 ppm1 3.911 ppm2 0.345 ASSI { 3572} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 3572 weight 0.1000E+01 volume 133.84430 ppm1 0.345 ppm2 1.161 ASSI { 3582} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 62 and name HA )) 6 6 0 peak 3582 weight 0.1000E+01 volume 23.63770 ppm1 1.155 ppm2 3.917 ASSI { 3592} (( segid "PROT" and resid 62 and name HA )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 3592 weight 0.1000E+01 volume 53.64890 ppm1 3.916 ppm2 1.161 ASSI { 3602} (( segid "PROT" and resid 62 and name HB )) (( segid "PROT" and resid 62 and name HA )) 6 6 0 peak 3602 weight 0.1000E+01 volume 7.80500 ppm1 1.695 ppm2 3.920 ASSI { 3612} (( segid "PROT" and resid 62 and name HA )) (( segid "PROT" and resid 62 and name HB )) 6 6 0 peak 3612 weight 0.1000E+01 volume 5.73490 ppm1 3.917 ppm2 1.690 ASSI { 3622} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 62 and name HB )) 6 6 0 peak 3622 weight 0.1000E+01 volume 17.94760 ppm1 3.840 ppm2 1.692 ASSI { 3632} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 62 and name HB )) 6 6 0 peak 3632 weight 0.1000E+01 volume 4.53150 ppm1 0.578 ppm2 1.687 ASSI { 3642} (( segid "PROT" and resid 62 and name HB )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3642 weight 0.1000E+01 volume 45.97660 ppm1 1.696 ppm2 0.343 ASSI { 3652} (( segid "PROT" and resid 62 and name HG12 )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3652 weight 0.1000E+01 volume 78.19450 ppm1 0.887 ppm2 0.341 ASSI { 3662} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 3662 weight 0.1000E+01 volume 77.73760 ppm1 6.614 ppm2 1.161 ASSI { 3672} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 3672 weight 0.1000E+01 volume 23.98650 ppm1 6.720 ppm2 1.162 ASSI { 3682} (( segid "PROT" and resid 81 and name HA )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 3682 weight 0.1000E+01 volume 14.34150 ppm1 2.486 ppm2 1.160 ASSI { 3692} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 3692 weight 0.1000E+01 volume 27.92370 ppm1 -0.257 ppm2 1.156 ASSI { 3702} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3702 weight 0.1000E+01 volume 22.93170 ppm1 -1.490 ppm2 0.342 ASSI { 3712} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3712 weight 0.1000E+01 volume 97.29720 ppm1 -0.256 ppm2 0.342 ASSI { 3722} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3722 weight 0.1000E+01 volume 23.84370 ppm1 0.577 ppm2 0.336 ASSI { 3732} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3732 weight 0.1000E+01 volume 90.38260 ppm1 1.174 ppm2 0.346 ASSI { 3742} (( segid "PROT" and resid 62 and name HG11 )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3742 weight 0.1000E+01 volume 41.23820 ppm1 1.895 ppm2 0.343 ASSI { 3752} (( segid "PROT" and resid 84 and name HB1 )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3752 weight 0.1000E+01 volume 21.97830 ppm1 2.199 ppm2 0.347 ASSI { 3762} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 3762 weight 0.1000E+01 volume 3.44480 ppm1 6.725 ppm2 0.345 ASSI { 3772} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 3772 weight 0.1000E+01 volume 63.21270 ppm1 0.563 ppm2 3.629 ASSI { 3782} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 105 and name HB2 )) 6 6 0 peak 3782 weight 0.1000E+01 volume 32.94890 ppm1 0.568 ppm2 1.109 ASSI { 3792} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 105 and name HB1 )) 6 6 0 peak 3792 weight 0.1000E+01 volume 12.00850 ppm1 0.567 ppm2 1.506 ASSI { 3802} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 3802 weight 0.1000E+01 volume 147.21660 ppm1 0.394 ppm2 0.564 ASSI { 3812} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 3812 weight 0.1000E+01 volume 7.03450 ppm1 0.390 ppm2 3.630 ASSI { 3822} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 3822 weight 0.1000E+01 volume 29.50000 ppm1 0.956 ppm2 3.625 ASSI { 3832} (( segid "PROT" and resid 105 and name HB2 )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 3832 weight 0.1000E+01 volume 28.08500 ppm1 1.116 ppm2 3.621 ASSI { 3842} (( segid "PROT" and resid 105 and name HG )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 3842 weight 0.1000E+01 volume 17.44330 ppm1 1.651 ppm2 3.632 ASSI { 3852} (( segid "PROT" and resid 108 and name HB )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 3852 weight 0.1000E+01 volume 35.47190 ppm1 2.158 ppm2 3.623 ASSI { 3862} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 3862 weight 0.1000E+01 volume 3.47420 ppm1 6.059 ppm2 3.629 ASSI { 3872} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 105 and name HB1 )) 6 6 0 peak 3872 weight 0.1000E+01 volume 29.01630 ppm1 0.394 ppm2 1.508 ASSI { 3882} (( segid "PROT" and resid 105 and name HB2 )) (( segid "PROT" and resid 105 and name HB1 )) 6 6 0 peak 3882 weight 0.1000E+01 volume 21.74230 ppm1 1.112 ppm2 1.520 ASSI { 3892} (( segid "PROT" and resid 105 and name HB1 )) (( segid "PROT" and resid 105 and name HB2 )) 6 6 0 peak 3892 weight 0.1000E+01 volume 30.64860 ppm1 1.510 ppm2 1.113 ASSI { 3902} (( segid "PROT" and resid 105 and name HG )) (( segid "PROT" and resid 105 and name HB2 )) 6 6 0 peak 3902 weight 0.1000E+01 volume 5.43270 ppm1 1.646 ppm2 1.111 ASSI { 3912} (( segid "PROT" and resid 105 and name HA )) (( segid "PROT" and resid 105 and name HB1 )) 6 6 0 peak 3912 weight 0.1000E+01 volume 11.91120 ppm1 3.634 ppm2 1.516 ASSI { 3922} (( segid "PROT" and resid 105 and name HA )) (( segid "PROT" and resid 105 and name HB2 )) 6 6 0 peak 3922 weight 0.1000E+01 volume 22.84900 ppm1 3.632 ppm2 1.121 ASSI { 3932} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 105 and name HB1 )) 6 6 0 peak 3932 weight 0.1000E+01 volume 25.52560 ppm1 6.058 ppm2 1.502 ASSI { 3942} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 105 and name HB2 )) 6 6 0 peak 3942 weight 0.1000E+01 volume 20.20310 ppm1 6.057 ppm2 1.125 ASSI { 3952} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 3952 weight 0.1000E+01 volume 9.94490 ppm1 -1.497 ppm2 0.574 ASSI { 3962} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 3962 weight 0.1000E+01 volume 81.83070 ppm1 0.232 ppm2 0.563 ASSI { 3972} (( segid "PROT" and resid 105 and name HB2 )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 3972 weight 0.1000E+01 volume 180.59430 ppm1 1.100 ppm2 0.563 ASSI { 3982} (( segid "PROT" and resid 105 and name HB1 )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 3982 weight 0.1000E+01 volume 73.71660 ppm1 1.520 ppm2 0.563 ASSI { 3992} (( segid "PROT" and resid 105 and name HG )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 3992 weight 0.1000E+01 volume 161.23340 ppm1 1.648 ppm2 0.564 ASSI { 4002} (( segid "PROT" and resid 28 and name HG2 )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 4002 weight 0.1000E+01 volume 92.14370 ppm1 2.051 ppm2 0.567 ASSI { 4012} (( segid "PROT" and resid 28 and name HB1 )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 4012 weight 0.1000E+01 volume 62.92390 ppm1 2.137 ppm2 0.563 ASSI { 4022} (( segid "PROT" and resid 25 and name HB1 )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 4022 weight 0.1000E+01 volume 52.73810 ppm1 2.300 ppm2 0.563 ASSI { 4032} (( segid "PROT" and resid 28 and name HG1 )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 4032 weight 0.1000E+01 volume 33.66140 ppm1 2.801 ppm2 0.564 ASSI { 4042} (( segid "PROT" and resid 105 and name HA )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 4042 weight 0.1000E+01 volume 64.18540 ppm1 3.635 ppm2 0.566 ASSI { 4052} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 4052 weight 0.1000E+01 volume 57.26450 ppm1 4.108 ppm2 0.563 ASSI { 4062} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 4062 weight 0.1000E+01 volume 10.99420 ppm1 6.052 ppm2 0.566 ASSI { 4072} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 39 and name HG1# )) 6 6 0 peak 4072 weight 0.1000E+01 volume 18.49540 ppm1 6.149 ppm2 0.739 ASSI { 4082} (( segid "PROT" and resid 120 and name HA )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 4082 weight 0.1000E+01 volume 256.56851 ppm1 4.434 ppm2 0.656 ASSI { 4092} (( segid "PROT" and resid 120 and name HA )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 4092 weight 0.1000E+01 volume 31.74070 ppm1 4.437 ppm2 0.606 ASSI { 4102} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 120 and name HA )) 6 6 0 peak 4102 weight 0.1000E+01 volume 127.83420 ppm1 0.662 ppm2 4.433 ASSI { 4112} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 120 and name HB2 )) 6 6 0 peak 4112 weight 0.1000E+01 volume 49.44690 ppm1 0.659 ppm2 1.628 ASSI { 4122} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 120 and name HB1 )) 6 6 0 peak 4122 weight 0.1000E+01 volume 45.81440 ppm1 0.612 ppm2 1.764 ASSI { 4132} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 120 and name HG )) 6 6 0 peak 4132 weight 0.1000E+01 volume 78.34210 ppm1 0.661 ppm2 1.783 ASSI { 4142} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 120 and name HG )) 6 6 0 peak 4142 weight 0.1000E+01 volume 55.92010 ppm1 0.614 ppm2 1.788 ASSI { 4152} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 87 and name HA )) 6 6 0 peak 4152 weight 0.1000E+01 volume 14.48730 ppm1 0.447 ppm2 4.458 ASSI { 4162} (( segid "PROT" and resid 90 and name HD2# )) (( segid "PROT" and resid 87 and name HA )) 6 6 0 peak 4162 weight 0.1000E+01 volume 21.81770 ppm1 0.989 ppm2 4.459 ASSI { 4172} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 120 and name HB1 )) 6 6 0 peak 4172 weight 0.1000E+01 volume 46.02430 ppm1 0.659 ppm2 1.768 ASSI { 4182} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 120 and name HB2 )) 6 6 0 peak 4182 weight 0.1000E+01 volume 29.12310 ppm1 0.613 ppm2 1.628 ASSI { 4192} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 59 and name HB1 )) 6 6 0 peak 4192 weight 0.1000E+01 volume 10.14180 ppm1 0.238 ppm2 1.718 ASSI { 4202} (( segid "PROT" and resid 59 and name HB2 )) (( segid "PROT" and resid 59 and name HB1 )) 6 6 0 peak 4202 weight 0.1000E+01 volume 65.52610 ppm1 1.350 ppm2 1.726 ASSI { 4212} (( segid "PROT" and resid 120 and name HB2 )) (( segid "PROT" and resid 120 and name HB1 )) 6 6 0 peak 4212 weight 0.1000E+01 volume 71.91420 ppm1 1.631 ppm2 1.771 ASSI { 4222} (( segid "PROT" and resid 120 and name HB1 )) (( segid "PROT" and resid 120 and name HB2 )) 6 6 0 peak 4222 weight 0.1000E+01 volume 170.60100 ppm1 1.774 ppm2 1.628 ASSI { 4232} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 59 and name HB1 )) 6 6 0 peak 4232 weight 0.1000E+01 volume 4.83810 ppm1 3.841 ppm2 1.732 ASSI { 4242} (( segid "PROT" and resid 120 and name HA )) (( segid "PROT" and resid 120 and name HB1 )) 6 6 0 peak 4242 weight 0.1000E+01 volume 86.00540 ppm1 4.435 ppm2 1.773 ASSI { 4252} (( segid "PROT" and resid 120 and name HA )) (( segid "PROT" and resid 120 and name HB2 )) 6 6 0 peak 4252 weight 0.1000E+01 volume 48.32230 ppm1 4.432 ppm2 1.633 ASSI { 4262} (( segid "PROT" and resid 120 and name HA )) (( segid "PROT" and resid 120 and name HG )) 6 6 0 peak 4262 weight 0.1000E+01 volume 12.93660 ppm1 4.435 ppm2 1.785 ASSI { 4272} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 4272 weight 0.1000E+01 volume 48.23740 ppm1 -1.493 ppm2 0.670 ASSI { 4282} (( segid "PROT" and resid 120 and name HB2 )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 4282 weight 0.1000E+01 volume 172.17860 ppm1 1.629 ppm2 0.608 ASSI { 4292} (( segid "PROT" and resid 120 and name HG )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 4292 weight 0.1000E+01 volume 426.09991 ppm1 1.781 ppm2 0.610 ASSI { 4302} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 4302 weight 0.1000E+01 volume 19.20510 ppm1 3.784 ppm2 0.618 ASSI { 4322} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 4322 weight 0.1000E+01 volume 48.19300 ppm1 6.061 ppm2 0.665 ASSI { 4332} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 4332 weight 0.1000E+01 volume 50.15680 ppm1 7.046 ppm2 0.668 ASSI { 4342} (( segid "PROT" and resid 120 and name HG )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 4342 weight 0.1000E+01 volume 399.03201 ppm1 1.783 ppm2 0.660 ASSI { 4352} (( segid "PROT" and resid 120 and name HB2 )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 4352 weight 0.1000E+01 volume 102.52940 ppm1 1.632 ppm2 0.660 ASSI { 4362} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 4362 weight 0.1000E+01 volume 30.82260 ppm1 3.786 ppm2 0.658 ASSI { 4372} (( segid "PROT" and resid 40 and name HB2 )) (( segid "PROT" and resid 40 and name HA )) 6 6 0 peak 4372 weight 0.1000E+01 volume 27.16270 ppm1 2.384 ppm2 5.085 ASSI { 4382} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 40 and name HA )) 6 6 0 peak 4382 weight 0.1000E+01 volume 6.58340 ppm1 -0.363 ppm2 5.084 ASSI { 4392} (( segid "PROT" and resid 41 and name HD1 )) (( segid "PROT" and resid 40 and name HA )) 6 6 0 peak 4392 weight 0.1000E+01 volume 48.58690 ppm1 3.801 ppm2 5.084 ASSI { 4402} (( segid "PROT" and resid 102 and name HB1 )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 4402 weight 0.1000E+01 volume 33.14950 ppm1 3.040 ppm2 3.237 ASSI { 4412} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 4412 weight 0.1000E+01 volume 11.94840 ppm1 0.394 ppm2 3.239 ASSI { 4422} (( segid "PROT" and resid 35 and name HZ )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 4422 weight 0.1000E+01 volume 8.53610 ppm1 7.031 ppm2 3.237 ASSI { 4432} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 4432 weight 0.1000E+01 volume 6.56040 ppm1 7.354 ppm2 3.236 ASSI { 4442} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 66 and name HA )) 6 6 0 peak 4442 weight 0.1000E+01 volume 33.49580 ppm1 0.837 ppm2 4.350 ASSI { 4452} (( segid "PROT" and resid 66 and name HB1 )) (( segid "PROT" and resid 66 and name HA )) 6 6 0 peak 4452 weight 0.1000E+01 volume 62.86240 ppm1 1.933 ppm2 4.347 ASSI { 4472} (( segid "PROT" and resid 71 and name HD1 )) (( segid "PROT" and resid 66 and name HA )) 6 6 0 peak 4472 weight 0.1000E+01 volume 21.56540 ppm1 6.874 ppm2 4.353 ASSI { 4482} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 4482 weight 0.1000E+01 volume 32.47490 ppm1 0.838 ppm2 1.924 ASSI { 4492} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 4492 weight 0.1000E+01 volume 53.94190 ppm1 0.737 ppm2 1.932 ASSI { 4502} (( segid "PROT" and resid 66 and name HB2 )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 4502 weight 0.1000E+01 volume 149.92300 ppm1 1.748 ppm2 1.924 ASSI { 4512} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 66 and name HG )) 6 6 0 peak 4512 weight 0.1000E+01 volume 88.15190 ppm1 0.739 ppm2 1.720 ASSI { 4522} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 4522 weight 0.1000E+01 volume 19.27050 ppm1 6.612 ppm2 0.834 ASSI { 4532} (( segid "PROT" and resid 66 and name HB2 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 4532 weight 0.1000E+01 volume 330.33780 ppm1 1.753 ppm2 0.834 ASSI { 4542} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 4542 weight 0.1000E+01 volume 103.94100 ppm1 0.236 ppm2 0.837 ASSI { 4552} (( segid "PROT" and resid 16 and name HG2 )) (( segid "PROT" and resid 16 and name HA )) 6 6 0 peak 4552 weight 0.1000E+01 volume 50.14890 ppm1 2.400 ppm2 3.919 ASSI { 4562} (( segid "PROT" and resid 16 and name HA )) (( segid "PROT" and resid 16 and name HG1 )) 6 6 0 peak 4562 weight 0.1000E+01 volume 75.22950 ppm1 3.923 ppm2 2.484 ASSI { 4572} (( segid "PROT" and resid 16 and name HB2 )) (( segid "PROT" and resid 16 and name HA )) 6 6 0 peak 4572 weight 0.1000E+01 volume 160.00810 ppm1 2.075 ppm2 3.921 ASSI { 4582} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 9 and name HB1 )) 6 6 0 peak 4582 weight 0.1000E+01 volume 51.90460 ppm1 7.327 ppm2 2.866 ASSI { 4592} (( segid "PROT" and resid 9 and name HA )) (( segid "PROT" and resid 9 and name HB1 )) 6 6 0 peak 4592 weight 0.1000E+01 volume 82.34560 ppm1 4.652 ppm2 2.863 ASSI { 4602} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 67 and name HB1 )) 6 6 0 peak 4602 weight 0.1000E+01 volume 29.65640 ppm1 4.163 ppm2 2.839 ASSI { 4612} (( segid "PROT" and resid 9 and name HB1 )) (( segid "PROT" and resid 9 and name HA )) 6 6 0 peak 4612 weight 0.1000E+01 volume 60.00880 ppm1 2.866 ppm2 4.641 ASSI { 4622} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 9 and name HA )) 6 6 0 peak 4622 weight 0.1000E+01 volume 13.02130 ppm1 7.313 ppm2 4.643 ASSI { 4632} (( segid "PROT" and resid 13 and name HB1 )) (( segid "PROT" and resid 13 and name HA )) 6 6 0 peak 4632 weight 0.1000E+01 volume 97.92800 ppm1 2.340 ppm2 4.139 ASSI { 4642} (( segid "PROT" and resid 117 and name HB1 )) (( segid "PROT" and resid 117 and name HB2 )) 6 6 0 peak 4642 weight 0.1000E+01 volume 430.58740 ppm1 2.202 ppm2 1.976 ASSI { 4652} (( segid "PROT" and resid 13 and name HA )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 4652 weight 0.1000E+01 volume 174.42239 ppm1 4.139 ppm2 2.341 ASSI { 4662} (( segid "PROT" and resid 13 and name HB2 )) (( segid "PROT" and resid 13 and name HA )) 6 6 0 peak 4662 weight 0.1000E+01 volume 190.27890 ppm1 2.207 ppm2 4.130 ASSI { 4672} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 23 and name HG1 )) 6 6 0 peak 4672 weight 0.1000E+01 volume 25.57600 ppm1 4.434 ppm2 2.309 ASSI { 4682} (( segid "PROT" and resid 10 and name HB2 )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 4682 weight 0.1000E+01 volume 33.75870 ppm1 1.675 ppm2 2.341 ASSI { 4692} (( segid "PROT" and resid 12 and name HA )) (( segid "PROT" and resid 12 and name HG1 )) 6 6 0 peak 4692 weight 0.1000E+01 volume 248.88049 ppm1 4.150 ppm2 2.333 ASSI { 4702} (( segid "PROT" and resid 12 and name HA )) (( segid "PROT" and resid 12 and name HB1 )) 6 6 0 peak 4702 weight 0.1000E+01 volume 326.53720 ppm1 4.145 ppm2 2.037 ASSI { 4712} (( segid "PROT" and resid 12 and name HG1 )) (( segid "PROT" and resid 12 and name HA )) 6 6 0 peak 4712 weight 0.1000E+01 volume 65.20830 ppm1 2.342 ppm2 4.144 ASSI { 4722} (( segid "PROT" and resid 67 and name HB1 )) (( segid "PROT" and resid 64 and name HA )) 6 6 0 peak 4722 weight 0.1000E+01 volume 67.49200 ppm1 2.839 ppm2 4.162 ASSI { 4742} (( segid "PROT" and resid 64 and name HG2 )) (( segid "PROT" and resid 64 and name HA )) 6 6 0 peak 4742 weight 0.1000E+01 volume 12.49080 ppm1 1.507 ppm2 4.166 ASSI { 4752} (( segid "PROT" and resid 115 and name HA )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 4752 weight 0.1000E+01 volume 151.65250 ppm1 4.260 ppm2 2.045 ASSI { 4762} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 4762 weight 0.1000E+01 volume 140.19099 ppm1 3.768 ppm2 2.040 ASSI { 4772} (( segid "PROT" and resid 115 and name HD2 )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 4772 weight 0.1000E+01 volume 115.54720 ppm1 3.520 ppm2 2.038 ASSI { 4782} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 73 and name HG1 )) 6 6 0 peak 4782 weight 0.1000E+01 volume 19.22240 ppm1 4.617 ppm2 2.431 ASSI { 4792} (( segid "PROT" and resid 12 and name HB1 )) (( segid "PROT" and resid 12 and name HG1 )) 6 6 0 peak 4792 weight 0.1000E+01 volume 251.66679 ppm1 2.041 ppm2 2.335 ASSI { 4802} (( segid "PROT" and resid 51 and name HB1 )) (( segid "PROT" and resid 51 and name HA )) 6 6 0 peak 4802 weight 0.1000E+01 volume 51.60450 ppm1 2.944 ppm2 4.462 ASSI { 4812} (( segid "PROT" and resid 51 and name HA )) (( segid "PROT" and resid 51 and name HB1 )) 6 6 0 peak 4812 weight 0.1000E+01 volume 35.28530 ppm1 4.463 ppm2 2.942 ASSI { 4822} (( segid "PROT" and resid 51 and name HA )) (( segid "PROT" and resid 51 and name HB2 )) 6 6 0 peak 4822 weight 0.1000E+01 volume 37.23380 ppm1 4.459 ppm2 2.689 ASSI { 4832} (( segid "PROT" and resid 52 and name HA )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 4832 weight 0.1000E+01 volume 64.41250 ppm1 4.000 ppm2 0.998 ASSI { 4842} (( segid "PROT" and resid 52 and name HA )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 4842 weight 0.1000E+01 volume 131.39211 ppm1 3.994 ppm2 0.886 ASSI { 4852} (( segid "PROT" and resid 52 and name HA )) (( segid "PROT" and resid 52 and name HG12 )) 6 6 0 peak 4852 weight 0.1000E+01 volume 44.08580 ppm1 3.988 ppm2 1.391 ASSI { 4862} (( segid "PROT" and resid 52 and name HG12 )) (( segid "PROT" and resid 52 and name HA )) 6 6 0 peak 4862 weight 0.1000E+01 volume 36.48920 ppm1 1.403 ppm2 3.988 ASSI { 4872} (( segid "PROT" and resid 52 and name HD1# )) (( segid "PROT" and resid 52 and name HA )) 6 6 0 peak 4872 weight 0.1000E+01 volume 76.85870 ppm1 0.883 ppm2 3.990 ASSI { 4882} (( segid "PROT" and resid 52 and name HD1# )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 4882 weight 0.1000E+01 volume 63.71390 ppm1 0.883 ppm2 1.819 ASSI { 4892} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 52 and name HG11 )) 6 6 0 peak 4892 weight 0.1000E+01 volume 68.60310 ppm1 0.986 ppm2 1.559 ASSI { 4902} (( segid "PROT" and resid 52 and name HD1# )) (( segid "PROT" and resid 52 and name HG11 )) 6 6 0 peak 4902 weight 0.1000E+01 volume 84.18940 ppm1 0.884 ppm2 1.559 ASSI { 4912} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 4912 weight 0.1000E+01 volume 34.41670 ppm1 6.707 ppm2 1.000 ASSI { 4922} (( segid "PROT" and resid 53 and name HA )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 4922 weight 0.1000E+01 volume 14.48070 ppm1 3.539 ppm2 0.997 ASSI { 4932} (( segid "PROT" and resid 52 and name HB )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 4932 weight 0.1000E+01 volume 203.73090 ppm1 1.826 ppm2 0.995 ASSI { 4942} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 4942 weight 0.1000E+01 volume 83.89900 ppm1 0.446 ppm2 0.995 ASSI { 4952} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 4952 weight 0.1000E+01 volume 13.92940 ppm1 6.910 ppm2 0.881 ASSI { 4962} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 4962 weight 0.1000E+01 volume 85.88030 ppm1 6.707 ppm2 0.883 ASSI { 4972} (( segid "PROT" and resid 48 and name HB1 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 4972 weight 0.1000E+01 volume 10.15610 ppm1 3.122 ppm2 0.879 ASSI { 4982} (( segid "PROT" and resid 52 and name HB )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 4982 weight 0.1000E+01 volume 74.96340 ppm1 1.831 ppm2 0.885 ASSI { 4992} (( segid "PROT" and resid 52 and name HG12 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 4992 weight 0.1000E+01 volume 149.66220 ppm1 1.400 ppm2 0.881 ASSI { 5002} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 5002 weight 0.1000E+01 volume 91.98610 ppm1 1.017 ppm2 0.884 ASSI { 5012} (( segid "PROT" and resid 107 and name HB1 )) (( segid "PROT" and resid 107 and name HA )) 6 6 0 peak 5012 weight 0.1000E+01 volume 126.91110 ppm1 2.263 ppm2 4.142 ASSI { 5022} (( segid "PROT" and resid 112 and name HG1 )) (( segid "PROT" and resid 112 and name HB1 )) 6 6 0 peak 5022 weight 0.1000E+01 volume 34.94950 ppm1 2.506 ppm2 1.982 ASSI { 5032} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 107 and name HG1 )) 6 6 0 peak 5032 weight 0.1000E+01 volume 70.02520 ppm1 4.134 ppm2 2.485 ASSI { 5042} (( segid "PROT" and resid 107 and name HG1 )) (( segid "PROT" and resid 107 and name HA )) 6 6 0 peak 5042 weight 0.1000E+01 volume 39.55350 ppm1 2.498 ppm2 4.131 ASSI { 5052} (( segid "PROT" and resid 107 and name HB1 )) (( segid "PROT" and resid 107 and name HG1 )) 6 6 0 peak 5052 weight 0.1000E+01 volume 523.97632 ppm1 2.199 ppm2 2.486 ASSI { 5062} (( segid "PROT" and resid 114 and name HB1 )) (( segid "PROT" and resid 114 and name HA )) 6 6 0 peak 5062 weight 0.1000E+01 volume 31.10280 ppm1 2.835 ppm2 4.554 ASSI { 5072} (( segid "PROT" and resid 114 and name HB2 )) (( segid "PROT" and resid 114 and name HA )) 6 6 0 peak 5072 weight 0.1000E+01 volume 22.63580 ppm1 2.688 ppm2 4.549 ASSI { 5082} (( segid "PROT" and resid 114 and name HA )) (( segid "PROT" and resid 114 and name HB1 )) 6 6 0 peak 5082 weight 0.1000E+01 volume 88.13830 ppm1 4.552 ppm2 2.844 ASSI { 5092} (( segid "PROT" and resid 114 and name HA )) (( segid "PROT" and resid 114 and name HB2 )) 6 6 0 peak 5092 weight 0.1000E+01 volume 38.86500 ppm1 4.553 ppm2 2.679 ASSI { 5102} (( segid "PROT" and resid 115 and name HD2 )) (( segid "PROT" and resid 114 and name HB1 )) 6 6 0 peak 5102 weight 0.1000E+01 volume 38.21580 ppm1 3.516 ppm2 2.841 ASSI { 5112} (( segid "PROT" and resid 115 and name HD2 )) (( segid "PROT" and resid 114 and name HB2 )) 6 6 0 peak 5112 weight 0.1000E+01 volume 19.98390 ppm1 3.515 ppm2 2.675 ASSI { 5122} (( segid "PROT" and resid 114 and name HB2 )) (( segid "PROT" and resid 114 and name HB1 )) 6 6 0 peak 5122 weight 0.1000E+01 volume 184.14850 ppm1 2.684 ppm2 2.837 ASSI { 5132} (( segid "PROT" and resid 114 and name HB1 )) (( segid "PROT" and resid 114 and name HB2 )) 6 6 0 peak 5132 weight 0.1000E+01 volume 346.30719 ppm1 2.839 ppm2 2.684 ASSI { 5142} (( segid "PROT" and resid 115 and name HG1 )) (( segid "PROT" and resid 114 and name HB2 )) 6 6 0 peak 5142 weight 0.1000E+01 volume 19.19760 ppm1 2.040 ppm2 2.684 ASSI { 5152} (( segid "PROT" and resid 115 and name HG1 )) (( segid "PROT" and resid 114 and name HB1 )) 6 6 0 peak 5152 weight 0.1000E+01 volume 13.72630 ppm1 2.040 ppm2 2.851 ASSI { 5162} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 5162 weight 0.1000E+01 volume 47.62800 ppm1 5.244 ppm2 3.691 ASSI { 5172} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 5172 weight 0.1000E+01 volume 34.40170 ppm1 5.249 ppm2 3.432 ASSI { 5182} (( segid "PROT" and resid 56 and name HG1 )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 5182 weight 0.1000E+01 volume 91.92640 ppm1 2.139 ppm2 3.698 ASSI { 5192} (( segid "PROT" and resid 56 and name HG1 )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 5192 weight 0.1000E+01 volume 106.69040 ppm1 2.139 ppm2 3.448 ASSI { 5202} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 5202 weight 0.1000E+01 volume 61.26340 ppm1 3.695 ppm2 3.443 ASSI { 5212} (( segid "PROT" and resid 56 and name HG2 )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 5212 weight 0.1000E+01 volume 86.95500 ppm1 1.981 ppm2 3.448 ASSI { 5222} (( segid "PROT" and resid 56 and name HG2 )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 5222 weight 0.1000E+01 volume 68.57390 ppm1 1.973 ppm2 3.702 ASSI { 5232} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 5232 weight 0.1000E+01 volume 5.83920 ppm1 0.612 ppm2 3.437 ASSI { 5242} (( segid "PROT" and resid 114 and name HA )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5242 weight 0.1000E+01 volume 5.57020 ppm1 4.550 ppm2 3.754 ASSI { 5252} (( segid "PROT" and resid 114 and name HA )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 5252 weight 0.1000E+01 volume 6.45330 ppm1 4.553 ppm2 3.508 ASSI { 5262} (( segid "PROT" and resid 112 and name HA )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 5262 weight 0.1000E+01 volume 8.87870 ppm1 4.116 ppm2 3.518 ASSI { 5272} (( segid "PROT" and resid 112 and name HA )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5272 weight 0.1000E+01 volume 17.66530 ppm1 4.114 ppm2 3.754 ASSI { 5282} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 5282 weight 0.1000E+01 volume 81.86390 ppm1 3.763 ppm2 3.518 ASSI { 5292} (( segid "PROT" and resid 115 and name HD2 )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5292 weight 0.1000E+01 volume 116.57590 ppm1 3.514 ppm2 3.766 ASSI { 5302} (( segid "PROT" and resid 114 and name HB1 )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5302 weight 0.1000E+01 volume 26.52120 ppm1 2.841 ppm2 3.763 ASSI { 5312} (( segid "PROT" and resid 114 and name HB1 )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 5312 weight 0.1000E+01 volume 40.00560 ppm1 2.840 ppm2 3.518 ASSI { 5322} (( segid "PROT" and resid 114 and name HB2 )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5322 weight 0.1000E+01 volume 45.36940 ppm1 2.691 ppm2 3.763 ASSI { 5332} (( segid "PROT" and resid 115 and name HG1 )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5332 weight 0.1000E+01 volume 122.79030 ppm1 2.041 ppm2 3.760 ASSI { 5342} (( segid "PROT" and resid 115 and name HG1 )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 5342 weight 0.1000E+01 volume 90.73140 ppm1 2.044 ppm2 3.511 ASSI { 5352} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 74 and name HD1 )) 6 6 0 peak 5352 weight 0.1000E+01 volume 2.90990 ppm1 0.269 ppm2 3.743 ASSI { 5362} (( segid "PROT" and resid 115 and name HA )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5362 weight 0.1000E+01 volume 9.79210 ppm1 4.266 ppm2 3.752 ASSI { 5372} (( segid "PROT" and resid 115 and name HA )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 5372 weight 0.1000E+01 volume 14.61470 ppm1 4.267 ppm2 3.519 ASSI { 5382} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 5382 weight 0.1000E+01 volume 9.73510 ppm1 5.247 ppm2 2.129 ASSI { 5392} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 5392 weight 0.1000E+01 volume 3.92750 ppm1 5.247 ppm2 1.977 ASSI { 5402} (( segid "PROT" and resid 50 and name HE1 )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 5402 weight 0.1000E+01 volume 40.24620 ppm1 7.399 ppm2 2.136 ASSI { 5412} (( segid "PROT" and resid 50 and name HE1 )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 5412 weight 0.1000E+01 volume 23.77450 ppm1 7.403 ppm2 1.977 ASSI { 5422} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 5422 weight 0.1000E+01 volume 2.29310 ppm1 6.150 ppm2 1.979 ASSI { 5432} (( segid "PROT" and resid 16 and name HA )) (( segid "PROT" and resid 16 and name HB1 )) 6 6 0 peak 5432 weight 0.1000E+01 volume 261.26669 ppm1 3.924 ppm2 2.107 ASSI { 5442} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 5442 weight 0.1000E+01 volume 68.31700 ppm1 3.448 ppm2 1.966 ASSI { 5452} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 5452 weight 0.1000E+01 volume 7.41650 ppm1 3.769 ppm2 4.260 ASSI { 5462} (( segid "PROT" and resid 115 and name HD2 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 5462 weight 0.1000E+01 volume 2.42170 ppm1 3.514 ppm2 4.260 ASSI { 5472} (( segid "PROT" and resid 115 and name HB1 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 5472 weight 0.1000E+01 volume 59.66990 ppm1 2.278 ppm2 4.265 ASSI { 5482} (( segid "PROT" and resid 115 and name HG1 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 5482 weight 0.1000E+01 volume 63.52150 ppm1 2.048 ppm2 4.272 ASSI { 5492} (( segid "PROT" and resid 56 and name HA )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 5492 weight 0.1000E+01 volume 7.13010 ppm1 4.127 ppm2 3.450 ASSI { 5502} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 56 and name HA )) 6 6 0 peak 5502 weight 0.1000E+01 volume 8.89790 ppm1 3.696 ppm2 4.132 ASSI { 5512} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 56 and name HA )) 6 6 0 peak 5512 weight 0.1000E+01 volume 6.34110 ppm1 3.448 ppm2 4.132 ASSI { 5522} (( segid "PROT" and resid 38 and name HG1 )) (( segid "PROT" and resid 38 and name HA )) 6 6 0 peak 5522 weight 0.1000E+01 volume 57.75800 ppm1 1.971 ppm2 4.138 ASSI { 5532} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 56 and name HA )) 6 6 0 peak 5532 weight 0.1000E+01 volume 44.00370 ppm1 0.613 ppm2 4.125 ASSI { 5542} (( segid "PROT" and resid 115 and name HD2 )) (( segid "PROT" and resid 115 and name HB1 )) 6 6 0 peak 5542 weight 0.1000E+01 volume 14.70810 ppm1 3.517 ppm2 2.269 ASSI { 5552} (( segid "PROT" and resid 115 and name HD2 )) (( segid "PROT" and resid 115 and name HB2 )) 6 6 0 peak 5552 weight 0.1000E+01 volume 10.44890 ppm1 3.515 ppm2 1.852 ASSI { 5562} (( segid "PROT" and resid 115 and name HA )) (( segid "PROT" and resid 115 and name HB1 )) 6 6 0 peak 5562 weight 0.1000E+01 volume 120.53190 ppm1 4.273 ppm2 2.281 ASSI { 5572} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 115 and name HB1 )) 6 6 0 peak 5572 weight 0.1000E+01 volume 16.72010 ppm1 3.764 ppm2 2.279 ASSI { 5582} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 5582 weight 0.1000E+01 volume 14.86660 ppm1 3.453 ppm2 2.149 ASSI { 5592} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 56 and name HB2 )) 6 6 0 peak 5592 weight 0.1000E+01 volume 47.60220 ppm1 3.691 ppm2 2.141 ASSI { 5602} (( segid "PROT" and resid 50 and name HE1 )) (( segid "PROT" and resid 56 and name HB2 )) 6 6 0 peak 5602 weight 0.1000E+01 volume 19.27350 ppm1 7.403 ppm2 2.137 ASSI { 5612} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 56 and name HB2 )) 6 6 0 peak 5612 weight 0.1000E+01 volume 2.66410 ppm1 6.150 ppm2 2.131 ASSI { 5622} (( segid "PROT" and resid 56 and name HA )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 5622 weight 0.1000E+01 volume 32.91330 ppm1 4.132 ppm2 2.139 ASSI { 5632} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 5632 weight 0.1000E+01 volume 15.36040 ppm1 6.149 ppm2 2.442 ASSI { 5642} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 5642 weight 0.1000E+01 volume 9.02350 ppm1 0.612 ppm2 2.436 ASSI { 5652} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 5652 weight 0.1000E+01 volume 78.92920 ppm1 3.444 ppm2 3.695 ASSI { 5662} (( segid "PROT" and resid 56 and name HB2 )) (( segid "PROT" and resid 56 and name HA )) 6 6 0 peak 5662 weight 0.1000E+01 volume 66.01550 ppm1 2.142 ppm2 4.131 ASSI { 5672} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 5672 weight 0.1000E+01 volume 81.53870 ppm1 3.697 ppm2 1.976 ASSI { 5682} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 5682 weight 0.1000E+01 volume 21.95490 ppm1 3.442 ppm2 2.131 ASSI { 5692} (( segid "PROT" and resid 115 and name HG1 )) (( segid "PROT" and resid 115 and name HB1 )) 6 6 0 peak 5692 weight 0.1000E+01 volume 113.72460 ppm1 2.044 ppm2 2.279 ASSI { 5702} (( segid "PROT" and resid 115 and name HB1 )) (( segid "PROT" and resid 115 and name HD1 )) 6 6 0 peak 5702 weight 0.1000E+01 volume 60.91840 ppm1 2.272 ppm2 3.757 ASSI { 5712} (( segid "PROT" and resid 115 and name HB1 )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 5712 weight 0.1000E+01 volume 23.03740 ppm1 2.275 ppm2 3.510 ASSI { 5722} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 107 and name HB1 )) 6 6 0 peak 5722 weight 0.1000E+01 volume 443.03311 ppm1 4.125 ppm2 2.229 ASSI { 5732} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 112 and name HA )) 6 6 0 peak 5732 weight 0.1000E+01 volume 12.05290 ppm1 3.767 ppm2 4.122 ASSI { 5742} (( segid "PROT" and resid 111 and name HG2 )) (( segid "PROT" and resid 111 and name HA )) 6 6 0 peak 5742 weight 0.1000E+01 volume 97.61870 ppm1 2.438 ppm2 4.107 ASSI { 5752} (( segid "PROT" and resid 111 and name HB1 )) (( segid "PROT" and resid 111 and name HA )) 6 6 0 peak 5752 weight 0.1000E+01 volume 117.32290 ppm1 2.280 ppm2 4.119 ASSI { 5762} (( segid "PROT" and resid 111 and name HB2 )) (( segid "PROT" and resid 111 and name HA )) 6 6 0 peak 5762 weight 0.1000E+01 volume 192.16200 ppm1 2.179 ppm2 4.103 ASSI { 5772} (( segid "PROT" and resid 112 and name HB1 )) (( segid "PROT" and resid 112 and name HA )) 6 6 0 peak 5772 weight 0.1000E+01 volume 172.79041 ppm1 2.027 ppm2 4.114 ASSI { 5782} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 25 and name HA )) 6 6 0 peak 5782 weight 0.1000E+01 volume 142.10870 ppm1 0.895 ppm2 4.104 ASSI { 5792} (( segid "PROT" and resid 112 and name HA )) (( segid "PROT" and resid 112 and name HG1 )) 6 6 0 peak 5792 weight 0.1000E+01 volume 44.03420 ppm1 4.124 ppm2 2.495 ASSI { 5802} (( segid "PROT" and resid 24 and name HB# )) (( segid "PROT" and resid 112 and name HG1 )) 6 6 0 peak 5802 weight 0.1000E+01 volume 25.39870 ppm1 1.415 ppm2 2.481 ASSI { 5812} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 112 and name HG1 )) 6 6 0 peak 5812 weight 0.1000E+01 volume 18.91930 ppm1 0.870 ppm2 2.480 ASSI { 5822} (( segid "PROT" and resid 107 and name HG1 )) (( segid "PROT" and resid 107 and name HB1 )) 6 6 0 peak 5822 weight 0.1000E+01 volume 317.32840 ppm1 2.503 ppm2 2.237 ASSI { 5832} (( segid "PROT" and resid 87 and name HA )) (( segid "PROT" and resid 87 and name HB1 )) 6 6 0 peak 5832 weight 0.1000E+01 volume 21.22330 ppm1 4.455 ppm2 3.076 ASSI { 5842} (( segid "PROT" and resid 87 and name HA )) (( segid "PROT" and resid 87 and name HB2 )) 6 6 0 peak 5842 weight 0.1000E+01 volume 29.99460 ppm1 4.457 ppm2 2.756 ASSI { 5852} (( segid "PROT" and resid 86 and name HB1 )) (( segid "PROT" and resid 86 and name HB2 )) 6 6 0 peak 5852 weight 0.1000E+01 volume 74.81410 ppm1 3.112 ppm2 2.881 ASSI { 5862} (( segid "PROT" and resid 86 and name HB1 )) (( segid "PROT" and resid 86 and name HA )) 6 6 0 peak 5862 weight 0.1000E+01 volume 6.95340 ppm1 3.124 ppm2 4.810 ASSI { 5872} (( segid "PROT" and resid 89 and name HE3 )) (( segid "PROT" and resid 86 and name HA )) 6 6 0 peak 5872 weight 0.1000E+01 volume 8.01920 ppm1 7.612 ppm2 4.792 ASSI { 5882} (( segid "PROT" and resid 86 and name HA )) (( segid "PROT" and resid 86 and name HB1 )) 6 6 0 peak 5882 weight 0.1000E+01 volume 13.08460 ppm1 4.807 ppm2 3.123 ASSI { 5892} (( segid "PROT" and resid 86 and name HA )) (( segid "PROT" and resid 86 and name HB2 )) 6 6 0 peak 5892 weight 0.1000E+01 volume 14.75270 ppm1 4.808 ppm2 2.889 ASSI { 5902} (( segid "PROT" and resid 83 and name HA )) (( segid "PROT" and resid 86 and name HB2 )) 6 6 0 peak 5902 weight 0.1000E+01 volume 4.18360 ppm1 4.232 ppm2 2.884 ASSI { 5912} (( segid "PROT" and resid 83 and name HA )) (( segid "PROT" and resid 86 and name HB1 )) 6 6 0 peak 5912 weight 0.1000E+01 volume 8.70560 ppm1 4.233 ppm2 3.123 ASSI { 5922} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 86 and name HB1 )) 6 6 0 peak 5922 weight 0.1000E+01 volume 6.74740 ppm1 1.104 ppm2 3.117 ASSI { 5932} (( segid "PROT" and resid 87 and name HB1 )) (( segid "PROT" and resid 87 and name HB2 )) 6 6 0 peak 5932 weight 0.1000E+01 volume 17.64080 ppm1 3.088 ppm2 2.750 ASSI { 5942} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 87 and name HB2 )) 6 6 0 peak 5942 weight 0.1000E+01 volume 4.81320 ppm1 0.446 ppm2 2.750 ASSI { 5952} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 5952 weight 0.1000E+01 volume 87.41720 ppm1 0.504 ppm2 4.191 ASSI { 5962} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 41 and name HD1 )) 6 6 0 peak 5962 weight 0.1000E+01 volume 42.51860 ppm1 5.084 ppm2 3.780 ASSI { 5972} (( segid "PROT" and resid 41 and name HG1 )) (( segid "PROT" and resid 41 and name HD1 )) 6 6 0 peak 5972 weight 0.1000E+01 volume 34.97970 ppm1 1.575 ppm2 3.782 ASSI { 5982} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 41 and name HD1 )) 6 6 0 peak 5982 weight 0.1000E+01 volume 6.06200 ppm1 -0.355 ppm2 3.783 ASSI { 5992} (( segid "PROT" and resid 10 and name HA )) (( segid "PROT" and resid 11 and name HD1 )) 6 6 0 peak 5992 weight 0.1000E+01 volume 24.61030 ppm1 4.678 ppm2 3.913 ASSI { 6002} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 6002 weight 0.1000E+01 volume 6.82160 ppm1 3.901 ppm2 4.228 ASSI { 6012} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 6012 weight 0.1000E+01 volume 6.48250 ppm1 4.432 ppm2 3.337 ASSI { 6022} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 6022 weight 0.1000E+01 volume 6.39000 ppm1 4.423 ppm2 3.613 ASSI { 6032} (( segid "PROT" and resid 79 and name HA )) (( segid "PROT" and resid 79 and name HB1 )) 6 6 0 peak 6032 weight 0.1000E+01 volume 59.72170 ppm1 4.552 ppm2 2.844 ASSI { 6042} (( segid "PROT" and resid 80 and name HB2 )) (( segid "PROT" and resid 80 and name HB1 )) 6 6 0 peak 6042 weight 0.1000E+01 volume 23.24870 ppm1 2.491 ppm2 2.790 ASSI { 6052} (( segid "PROT" and resid 79 and name HA )) (( segid "PROT" and resid 79 and name HB2 )) 6 6 0 peak 6052 weight 0.1000E+01 volume 47.13520 ppm1 4.550 ppm2 2.703 ASSI { 6062} (( segid "PROT" and resid 67 and name HA )) (( segid "PROT" and resid 67 and name HB2 )) 6 6 0 peak 6062 weight 0.1000E+01 volume 74.80790 ppm1 4.353 ppm2 2.586 ASSI { 6072} (( segid "PROT" and resid 67 and name HA )) (( segid "PROT" and resid 67 and name HB1 )) 6 6 0 peak 6072 weight 0.1000E+01 volume 39.61320 ppm1 4.356 ppm2 2.842 ASSI { 6082} (( segid "PROT" and resid 67 and name HB1 )) (( segid "PROT" and resid 67 and name HA )) 6 6 0 peak 6082 weight 0.1000E+01 volume 37.33840 ppm1 2.845 ppm2 4.345 ASSI { 6092} (( segid "PROT" and resid 67 and name HB2 )) (( segid "PROT" and resid 67 and name HA )) 6 6 0 peak 6092 weight 0.1000E+01 volume 80.37990 ppm1 2.598 ppm2 4.352 ASSI { 6102} (( segid "PROT" and resid 15 and name HD1 )) (( segid "PROT" and resid 67 and name HA )) 6 6 0 peak 6102 weight 0.1000E+01 volume 48.44370 ppm1 3.281 ppm2 4.350 ASSI { 6112} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 66 and name HA )) 6 6 0 peak 6112 weight 0.1000E+01 volume 35.09890 ppm1 0.739 ppm2 4.347 ASSI { 6122} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 67 and name HB2 )) 6 6 0 peak 6122 weight 0.1000E+01 volume 25.06080 ppm1 4.167 ppm2 2.588 ASSI { 6132} (( segid "PROT" and resid 57 and name HE# )) (( segid "PROT" and resid 57 and name HA )) 6 6 0 peak 6132 weight 0.1000E+01 volume 45.91850 ppm1 1.990 ppm2 5.069 ASSI { 6142} (( segid "PROT" and resid 30 and name HA )) (( segid "PROT" and resid 29 and name HB2 )) 6 6 0 peak 6142 weight 0.1000E+01 volume 4.03250 ppm1 5.037 ppm2 2.252 ASSI { 6152} (( segid "PROT" and resid 57 and name HB1 )) (( segid "PROT" and resid 57 and name HA )) 6 6 0 peak 6152 weight 0.1000E+01 volume 32.23280 ppm1 2.169 ppm2 5.064 ASSI { 6162} (( segid "PROT" and resid 61 and name HB )) (( segid "PROT" and resid 57 and name HA )) 6 6 0 peak 6162 weight 0.1000E+01 volume 3.67820 ppm1 4.233 ppm2 5.058 ASSI { 6172} (( segid "PROT" and resid 57 and name HG1 )) (( segid "PROT" and resid 57 and name HA )) 6 6 0 peak 6172 weight 0.1000E+01 volume 5.01050 ppm1 3.010 ppm2 5.067 ASSI { 6182} (( segid "PROT" and resid 57 and name HB2 )) (( segid "PROT" and resid 57 and name HA )) 6 6 0 peak 6182 weight 0.1000E+01 volume 21.20200 ppm1 1.245 ppm2 5.070 ASSI { 6192} (( segid "PROT" and resid 61 and name HG2# )) (( segid "PROT" and resid 57 and name HA )) 6 6 0 peak 6192 weight 0.1000E+01 volume 8.65120 ppm1 1.136 ppm2 5.061 ASSI { 6202} (( segid "PROT" and resid 30 and name HA )) (( segid "PROT" and resid 29 and name HB1 )) 6 6 0 peak 6202 weight 0.1000E+01 volume 2.19150 ppm1 5.035 ppm2 2.787 ASSI { 6212} (( segid "PROT" and resid 97 and name HA )) (( segid "PROT" and resid 97 and name HB1 )) 6 6 0 peak 6212 weight 0.1000E+01 volume 90.55210 ppm1 3.649 ppm2 1.610 ASSI { 6222} (( segid "PROT" and resid 80 and name HA )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 6222 weight 0.1000E+01 volume 12.26960 ppm1 4.551 ppm2 1.985 ASSI { 6232} (( segid "PROT" and resid 61 and name HB )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 6232 weight 0.1000E+01 volume 8.29350 ppm1 4.225 ppm2 1.985 ASSI { 6242} (( segid "PROT" and resid 57 and name HA )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 6242 weight 0.1000E+01 volume 105.13470 ppm1 5.058 ppm2 1.988 ASSI { 6252} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 6252 weight 0.1000E+01 volume 128.44360 ppm1 1.137 ppm2 1.985 ASSI { 6262} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 6262 weight 0.1000E+01 volume 117.62990 ppm1 0.885 ppm2 1.988 ASSI { 6272} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 6272 weight 0.1000E+01 volume 6.75420 ppm1 0.341 ppm2 1.988 ASSI { 6282} (( segid "PROT" and resid 75 and name HD1 )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6282 weight 0.1000E+01 volume 6.33930 ppm1 7.479 ppm2 1.469 ASSI { 6292} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6292 weight 0.1000E+01 volume 18.13580 ppm1 4.310 ppm2 1.470 ASSI { 6302} (( segid "PROT" and resid 75 and name HA )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6302 weight 0.1000E+01 volume 10.94660 ppm1 4.202 ppm2 1.468 ASSI { 6312} (( segid "PROT" and resid 117 and name HG1 )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6312 weight 0.1000E+01 volume 14.75430 ppm1 2.604 ppm2 1.470 ASSI { 6322} (( segid "PROT" and resid 117 and name HG2 )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6322 weight 0.1000E+01 volume 12.49270 ppm1 2.507 ppm2 1.470 ASSI { 6332} (( segid "PROT" and resid 117 and name HB1 )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6332 weight 0.1000E+01 volume 20.62230 ppm1 2.206 ppm2 1.472 ASSI { 6342} (( segid "PROT" and resid 117 and name HB2 )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6342 weight 0.1000E+01 volume 34.40160 ppm1 1.974 ppm2 1.471 ASSI { 6352} (( segid "PROT" and resid 120 and name HG )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6352 weight 0.1000E+01 volume 65.04310 ppm1 1.784 ppm2 1.471 ASSI { 6362} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6362 weight 0.1000E+01 volume 17.71240 ppm1 1.113 ppm2 1.472 ASSI { 6382} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6382 weight 0.1000E+01 volume 3.13480 ppm1 0.609 ppm2 1.471 ASSI { 6392} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6392 weight 0.1000E+01 volume 8.53810 ppm1 0.888 ppm2 1.471 ASSI { 6402} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 6402 weight 0.1000E+01 volume 3.83860 ppm1 0.504 ppm2 1.472 ASSI { 6412} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 6412 weight 0.1000E+01 volume 35.98480 ppm1 1.094 ppm2 2.016 ASSI { 6422} (( segid "PROT" and resid 15 and name HD1 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 6422 weight 0.1000E+01 volume 34.86220 ppm1 3.285 ppm2 2.014 ASSI { 6432} (( segid "PROT" and resid 63 and name HE1 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 6432 weight 0.1000E+01 volume 40.86030 ppm1 2.801 ppm2 2.013 ASSI { 6442} (( segid "PROT" and resid 63 and name HG2 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 6442 weight 0.1000E+01 volume 29.25700 ppm1 1.188 ppm2 2.014 ASSI { 6452} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 6452 weight 0.1000E+01 volume 29.06300 ppm1 0.837 ppm2 2.014 ASSI { 6462} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 6462 weight 0.1000E+01 volume 69.16730 ppm1 0.739 ppm2 2.015 ASSI { 6472} (( segid "PROT" and resid 72 and name HG1 )) (( segid "PROT" and resid 72 and name HA )) 6 6 0 peak 6472 weight 0.1000E+01 volume 55.01170 ppm1 2.409 ppm2 4.297 ASSI { 6482} (( segid "PROT" and resid 22 and name HB1 )) (( segid "PROT" and resid 22 and name HA )) 6 6 0 peak 6482 weight 0.1000E+01 volume 147.22411 ppm1 2.246 ppm2 4.292 ASSI { 6492} (( segid "PROT" and resid 72 and name HA )) (( segid "PROT" and resid 72 and name HB1 )) 6 6 0 peak 6492 weight 0.1000E+01 volume 129.28030 ppm1 4.288 ppm2 2.250 ASSI { 6502} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 22 and name HA )) 6 6 0 peak 6502 weight 0.1000E+01 volume 7.85940 ppm1 0.669 ppm2 4.310 ASSI { 6512} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 72 and name HA )) 6 6 0 peak 6512 weight 0.1000E+01 volume 15.12860 ppm1 0.353 ppm2 4.296 ASSI { 6522} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 72 and name HA )) 6 6 0 peak 6522 weight 0.1000E+01 volume 4.99920 ppm1 0.266 ppm2 4.299 ASSI { 6532} (( segid "PROT" and resid 72 and name HA )) (( segid "PROT" and resid 72 and name HB2 )) 6 6 0 peak 6532 weight 0.1000E+01 volume 89.91720 ppm1 4.288 ppm2 2.131 ASSI { 6542} (( segid "PROT" and resid 72 and name HA )) (( segid "PROT" and resid 72 and name HG1 )) 6 6 0 peak 6542 weight 0.1000E+01 volume 116.20240 ppm1 4.292 ppm2 2.430 ASSI { 6552} (( segid "PROT" and resid 5 and name HD1 )) (( segid "PROT" and resid 5 and name HB1 )) 6 6 0 peak 6552 weight 0.1000E+01 volume 104.24170 ppm1 3.152 ppm2 1.754 ASSI { 6562} (( segid "PROT" and resid 115 and name HA )) (( segid "PROT" and resid 115 and name HB2 )) 6 6 0 peak 6562 weight 0.1000E+01 volume 90.54950 ppm1 4.269 ppm2 1.855 ASSI { 6572} (( segid "PROT" and resid 93 and name HB2 )) (( segid "PROT" and resid 93 and name HA )) 6 6 0 peak 6572 weight 0.1000E+01 volume 194.52020 ppm1 1.744 ppm2 4.307 ASSI { 6582} (( segid "PROT" and resid 93 and name HB1 )) (( segid "PROT" and resid 93 and name HA )) 6 6 0 peak 6582 weight 0.1000E+01 volume 63.86300 ppm1 1.904 ppm2 4.300 ASSI { 6592} (( segid "PROT" and resid 5 and name HG1 )) (( segid "PROT" and resid 5 and name HD1 )) 6 6 0 peak 6592 weight 0.1000E+01 volume 151.50529 ppm1 1.603 ppm2 3.148 ASSI { 6602} (( segid "PROT" and resid 5 and name HA )) (( segid "PROT" and resid 5 and name HD1 )) 6 6 0 peak 6602 weight 0.1000E+01 volume 53.98700 ppm1 4.324 ppm2 3.151 ASSI { 6612} (( segid "PROT" and resid 6 and name HA )) (( segid "PROT" and resid 6 and name HB1 )) 6 6 0 peak 6612 weight 0.1000E+01 volume 265.56351 ppm1 4.273 ppm2 1.756 ASSI { 6622} (( segid "PROT" and resid 20 and name HG1 )) (( segid "PROT" and resid 17 and name HA )) 6 6 0 peak 6622 weight 0.1000E+01 volume 2.74950 ppm1 2.127 ppm2 4.189 ASSI { 6632} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 17 and name HA )) 6 6 0 peak 6632 weight 0.1000E+01 volume 3.07760 ppm1 3.334 ppm2 4.170 ASSI { 6642} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 6642 weight 0.1000E+01 volume 106.74150 ppm1 0.776 ppm2 1.335 ASSI { 6652} (( segid "PROT" and resid 102 and name HA )) (( segid "PROT" and resid 105 and name HB1 )) 6 6 0 peak 6652 weight 0.1000E+01 volume 3.19860 ppm1 3.240 ppm2 1.510 ASSI { 6662} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 6662 weight 0.1000E+01 volume 10.15870 ppm1 0.354 ppm2 4.230 ASSI { 6672} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 6672 weight 0.1000E+01 volume 2.44110 ppm1 0.266 ppm2 4.223 ASSI { 6682} (( segid "PROT" and resid 11 and name HB1 )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 6682 weight 0.1000E+01 volume 82.21030 ppm1 2.434 ppm2 4.226 ASSI { 6692} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 115 and name HB2 )) 6 6 0 peak 6692 weight 0.1000E+01 volume 35.85090 ppm1 3.765 ppm2 1.851 ASSI { 6702} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 108 and name HA )) 6 6 0 peak 6702 weight 0.1000E+01 volume 7.06490 ppm1 4.116 ppm2 3.649 ASSI { 6712} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 6712 weight 0.1000E+01 volume 18.92280 ppm1 0.354 ppm2 3.775 ASSI { 6722} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 6722 weight 0.1000E+01 volume 34.20910 ppm1 0.241 ppm2 3.777 ASSI { 6732} (( segid "PROT" and resid 74 and name HB1 )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 6732 weight 0.1000E+01 volume 149.56020 ppm1 1.784 ppm2 3.776 ASSI { 6742} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 6742 weight 0.1000E+01 volume 5.93870 ppm1 0.505 ppm2 3.772 ASSI { 6752} (( segid "PROT" and resid 62 and name HG12 )) (( segid "PROT" and resid 62 and name HA )) 6 6 0 peak 6752 weight 0.1000E+01 volume 12.32750 ppm1 0.889 ppm2 3.912 ASSI { 6762} (( segid "PROT" and resid 74 and name HG2 )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 6762 weight 0.1000E+01 volume 14.91060 ppm1 1.407 ppm2 3.775 ASSI { 6772} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 6772 weight 0.1000E+01 volume 3.58100 ppm1 6.723 ppm2 3.777 ASSI { 6782} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 41 and name HA )) 6 6 0 peak 6782 weight 0.1000E+01 volume 4.78040 ppm1 -0.358 ppm2 3.629 ASSI { 6792} (( segid "PROT" and resid 49 and name HB2 )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 6792 weight 0.1000E+01 volume 9.79200 ppm1 1.978 ppm2 3.580 ASSI { 6802} (( segid "PROT" and resid 91 and name HA )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 6802 weight 0.1000E+01 volume 17.25900 ppm1 3.999 ppm2 0.445 ASSI { 6812} (( segid "PROT" and resid 52 and name HG11 )) (( segid "PROT" and resid 52 and name HA )) 6 6 0 peak 6812 weight 0.1000E+01 volume 25.55410 ppm1 1.560 ppm2 3.986 ASSI { 6822} (( segid "PROT" and resid 65 and name HG2 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 6822 weight 0.1000E+01 volume 23.40610 ppm1 0.729 ppm2 3.411 ASSI { 6832} (( segid "PROT" and resid 65 and name HB2 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 6832 weight 0.1000E+01 volume 19.64230 ppm1 0.560 ppm2 3.410 ASSI { 6842} (( segid "PROT" and resid 70 and name HB2 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 6842 weight 0.1000E+01 volume 31.22740 ppm1 1.090 ppm2 3.412 ASSI { 6852} (( segid "PROT" and resid 65 and name HD2 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 6852 weight 0.1000E+01 volume 4.32820 ppm1 1.344 ppm2 3.412 ASSI { 6862} (( segid "PROT" and resid 70 and name HG1 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 6862 weight 0.1000E+01 volume 13.50320 ppm1 2.262 ppm2 3.416 ASSI { 6872} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 6872 weight 0.1000E+01 volume 40.23530 ppm1 0.738 ppm2 3.670 ASSI { 6882} (( segid "PROT" and resid 15 and name HG1 )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 6882 weight 0.1000E+01 volume 20.04540 ppm1 1.548 ppm2 3.661 ASSI { 6892} (( segid "PROT" and resid 15 and name HD1 )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 6892 weight 0.1000E+01 volume 16.14350 ppm1 3.286 ppm2 3.664 ASSI { 6902} (( segid "PROT" and resid 66 and name HA )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 6902 weight 0.1000E+01 volume 5.70780 ppm1 4.356 ppm2 3.676 ASSI { 6912} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 32 and name HA )) 6 6 0 peak 6912 weight 0.1000E+01 volume 12.78950 ppm1 0.394 ppm2 4.364 ASSI { 6922} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 32 and name HA )) 6 6 0 peak 6922 weight 0.1000E+01 volume 6.93220 ppm1 0.233 ppm2 4.361 ASSI { 6932} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 32 and name HA )) 6 6 0 peak 6932 weight 0.1000E+01 volume 11.47910 ppm1 0.565 ppm2 4.360 ASSI { 6942} (( segid "PROT" and resid 100 and name HG2 )) (( segid "PROT" and resid 100 and name HA )) 6 6 0 peak 6942 weight 0.1000E+01 volume 24.98670 ppm1 1.607 ppm2 4.313 ASSI { 6952} (( segid "PROT" and resid 100 and name HB1 )) (( segid "PROT" and resid 100 and name HA )) 6 6 0 peak 6952 weight 0.1000E+01 volume 47.40060 ppm1 2.032 ppm2 4.318 ASSI { 6962} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 36 and name HA )) 6 6 0 peak 6962 weight 0.1000E+01 volume 17.29670 ppm1 0.235 ppm2 3.944 ASSI { 6972} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 36 and name HA )) 6 6 0 peak 6972 weight 0.1000E+01 volume 4.29050 ppm1 0.586 ppm2 3.953 ASSI { 6982} (( segid "PROT" and resid 36 and name HG2 )) (( segid "PROT" and resid 36 and name HA )) 6 6 0 peak 6982 weight 0.1000E+01 volume 59.06830 ppm1 1.335 ppm2 3.947 ASSI { 6992} (( segid "PROT" and resid 105 and name HB1 )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 6992 weight 0.1000E+01 volume 4.38380 ppm1 1.515 ppm2 3.244 ASSI { 7002} (( segid "PROT" and resid 105 and name HG )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 7002 weight 0.1000E+01 volume 1.52330 ppm1 1.639 ppm2 3.236 ASSI { 7012} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 7012 weight 0.1000E+01 volume 32.55350 ppm1 0.836 ppm2 3.668 ASSI { 7022} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 7022 weight 0.1000E+01 volume 3.13970 ppm1 0.240 ppm2 3.660 ASSI { 7032} (( segid "PROT" and resid 63 and name HG2 )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 7032 weight 0.1000E+01 volume 38.60640 ppm1 1.187 ppm2 3.694 ASSI { 7042} (( segid "PROT" and resid 22 and name HD1# )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 7042 weight 0.1000E+01 volume 41.82830 ppm1 1.089 ppm2 3.694 ASSI { 7052} (( segid "PROT" and resid 15 and name HA )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 7052 weight 0.1000E+01 volume 17.18740 ppm1 3.665 ppm2 3.280 ASSI { 7062} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 7062 weight 0.1000E+01 volume 206.05701 ppm1 0.582 ppm2 0.228 ASSI { 7072} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 7072 weight 0.1000E+01 volume 155.27290 ppm1 0.235 ppm2 0.582 ASSI { 7082} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 7082 weight 0.1000E+01 volume 20.13860 ppm1 6.609 ppm2 0.578 ASSI { 7092} (( segid "PROT" and resid 22 and name HD1# )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 7092 weight 0.1000E+01 volume 55.90550 ppm1 1.098 ppm2 0.232 ASSI { 7102} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 7102 weight 0.1000E+01 volume 15.69320 ppm1 3.940 ppm2 0.225 ASSI { 7112} (( segid "PROT" and resid 32 and name HA )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 7112 weight 0.1000E+01 volume 40.20330 ppm1 4.375 ppm2 0.232 ASSI { 7122} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 7122 weight 0.1000E+01 volume 29.33880 ppm1 6.609 ppm2 0.234 ASSI { 7132} (( segid "PROT" and resid 26 and name HD1 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 7132 weight 0.1000E+01 volume 23.06250 ppm1 6.951 ppm2 0.232 ASSI { 7142} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 59 and name HB1 )) 6 6 0 peak 7142 weight 0.1000E+01 volume 7.23360 ppm1 3.943 ppm2 1.724 ASSI { 7152} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 59 and name HB1 )) 6 6 0 peak 7152 weight 0.1000E+01 volume 60.58010 ppm1 0.589 ppm2 1.725 ASSI { 7162} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 7162 weight 0.1000E+01 volume 82.29150 ppm1 3.698 ppm2 1.089 ASSI { 7172} (( segid "PROT" and resid 66 and name HB2 )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 7172 weight 0.1000E+01 volume 29.25340 ppm1 1.749 ppm2 3.678 ASSI { 7182} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7182 weight 0.1000E+01 volume 63.22130 ppm1 -1.494 ppm2 1.219 ASSI { 7192} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7192 weight 0.1000E+01 volume 14.29340 ppm1 -0.255 ppm2 1.221 ASSI { 7202} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7202 weight 0.1000E+01 volume 11.68390 ppm1 0.235 ppm2 1.219 ASSI { 7212} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7212 weight 0.1000E+01 volume 12.82850 ppm1 0.351 ppm2 1.223 ASSI { 7222} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7222 weight 0.1000E+01 volume 30.73530 ppm1 0.574 ppm2 1.221 ASSI { 7232} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7232 weight 0.1000E+01 volume 12.34490 ppm1 0.670 ppm2 1.219 ASSI { 7242} (( segid "PROT" and resid 84 and name HA )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7242 weight 0.1000E+01 volume 15.26080 ppm1 3.649 ppm2 1.224 ASSI { 7252} (( segid "PROT" and resid 85 and name HD1 )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7252 weight 0.1000E+01 volume 34.61690 ppm1 6.049 ppm2 1.217 ASSI { 7262} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 7262 weight 0.1000E+01 volume 113.18530 ppm1 6.914 ppm2 0.994 ASSI { 7272} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 7272 weight 0.1000E+01 volume 10.25750 ppm1 7.371 ppm2 1.212 ASSI { 7282} (( segid "PROT" and resid 67 and name HA )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 7282 weight 0.1000E+01 volume 72.79710 ppm1 4.357 ppm2 3.278 ASSI { 7292} (( segid "PROT" and resid 111 and name HG1 )) (( segid "PROT" and resid 111 and name HA )) 6 6 0 peak 7292 weight 0.1000E+01 volume 38.56110 ppm1 2.519 ppm2 4.103 ASSI { 7302} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 25 and name HA )) 6 6 0 peak 7302 weight 0.1000E+01 volume 23.31490 ppm1 0.567 ppm2 4.102 ASSI { 7312} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 25 and name HA )) 6 6 0 peak 7312 weight 0.1000E+01 volume 13.57400 ppm1 0.674 ppm2 4.104 ASSI { 7322} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 14 and name HB2 )) 6 6 0 peak 7322 weight 0.1000E+01 volume 13.08680 ppm1 4.230 ppm2 1.308 ASSI { 7332} (( segid "PROT" and resid 18 and name HB2 )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 7332 weight 0.1000E+01 volume 19.70730 ppm1 0.316 ppm2 4.188 ASSI { 7342} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 7342 weight 0.1000E+01 volume 14.27450 ppm1 0.235 ppm2 4.186 ASSI { 7352} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 7352 weight 0.1000E+01 volume 2.14820 ppm1 0.268 ppm2 4.615 ASSI { 7362} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 7362 weight 0.1000E+01 volume 27.78140 ppm1 3.334 ppm2 3.618 ASSI { 7382} (( segid "PROT" and resid 41 and name HD2 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 7382 weight 0.1000E+01 volume 19.06980 ppm1 3.732 ppm2 -0.371 ASSI { 7392} (( segid "PROT" and resid 17 and name HA )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 7392 weight 0.1000E+01 volume 2.40460 ppm1 4.186 ppm2 3.332 ASSI { 7402} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 7402 weight 0.1000E+01 volume 44.85800 ppm1 3.611 ppm2 3.334 ASSI { 7412} (( segid "PROT" and resid 82 and name HZ2 )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 7412 weight 0.1000E+01 volume 8.44730 ppm1 7.718 ppm2 2.823 ASSI { 7422} (( segid "PROT" and resid 82 and name HZ2 )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 7422 weight 0.1000E+01 volume 39.47780 ppm1 7.722 ppm2 2.515 ASSI { 7432} (( segid "PROT" and resid 82 and name HH2 )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 7432 weight 0.1000E+01 volume 13.89610 ppm1 7.480 ppm2 2.515 ASSI { 7442} (( segid "PROT" and resid 82 and name HH2 )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 7442 weight 0.1000E+01 volume 20.29230 ppm1 7.476 ppm2 2.822 ASSI { 7452} (( segid "PROT" and resid 111 and name HA )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 7452 weight 0.1000E+01 volume 18.38770 ppm1 4.003 ppm2 2.817 ASSI { 7462} (( segid "PROT" and resid 110 and name HA )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 7462 weight 0.1000E+01 volume 62.83170 ppm1 4.001 ppm2 2.513 ASSI { 7472} (( segid "PROT" and resid 110 and name HG1 )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 7472 weight 0.1000E+01 volume 253.06950 ppm1 2.819 ppm2 2.522 ASSI { 7482} (( segid "PROT" and resid 110 and name HG2 )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 7482 weight 0.1000E+01 volume 159.04289 ppm1 2.522 ppm2 2.820 ASSI { 7492} (( segid "PROT" and resid 110 and name HB1 )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 7492 weight 0.1000E+01 volume 41.01720 ppm1 2.373 ppm2 2.820 ASSI { 7502} (( segid "PROT" and resid 110 and name HB2 )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 7502 weight 0.1000E+01 volume 66.13920 ppm1 2.162 ppm2 2.822 ASSI { 7512} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 7512 weight 0.1000E+01 volume 20.81930 ppm1 0.721 ppm2 2.523 ASSI { 7522} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 7522 weight 0.1000E+01 volume 10.25810 ppm1 0.720 ppm2 2.817 ASSI { 7532} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 19 and name HA )) 6 6 0 peak 7532 weight 0.1000E+01 volume 68.32680 ppm1 2.212 ppm2 4.411 ASSI { 7542} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 19 and name HA )) 6 6 0 peak 7542 weight 0.1000E+01 volume 10.70920 ppm1 1.084 ppm2 4.409 ASSI { 7552} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 114 and name HA )) 6 6 0 peak 7552 weight 0.1000E+01 volume 17.02430 ppm1 0.717 ppm2 4.548 ASSI { 7562} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 19 and name HB1 )) 6 6 0 peak 7562 weight 0.1000E+01 volume 65.80720 ppm1 4.426 ppm2 2.215 ASSI { 7572} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 19 and name HG1 )) 6 6 0 peak 7572 weight 0.1000E+01 volume 18.64750 ppm1 4.422 ppm2 2.660 ASSI { 7582} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 36 and name HA )) 6 6 0 peak 7582 weight 0.1000E+01 volume 6.80480 ppm1 6.607 ppm2 3.963 ASSI { 7592} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 80 and name HA )) 6 6 0 peak 7592 weight 0.1000E+01 volume 20.34570 ppm1 0.885 ppm2 4.552 ASSI { 7602} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 80 and name HA )) 6 6 0 peak 7602 weight 0.1000E+01 volume 8.21410 ppm1 1.106 ppm2 4.558 ASSI { 7612} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 83 and name HA )) 6 6 0 peak 7612 weight 0.1000E+01 volume 71.79300 ppm1 1.106 ppm2 4.237 ASSI { 7622} (( segid "PROT" and resid 86 and name HB1 )) (( segid "PROT" and resid 83 and name HA )) 6 6 0 peak 7622 weight 0.1000E+01 volume 15.42830 ppm1 3.121 ppm2 4.232 ASSI { 7632} (( segid "PROT" and resid 85 and name HD1 )) (( segid "PROT" and resid 85 and name HA )) 6 6 0 peak 7632 weight 0.1000E+01 volume 38.86450 ppm1 6.056 ppm2 4.179 ASSI { 7642} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 98 and name HA )) 6 6 0 peak 7642 weight 0.1000E+01 volume 10.29530 ppm1 7.095 ppm2 3.292 ASSI { 7652} (( segid "PROT" and resid 109 and name HB2 )) (( segid "PROT" and resid 106 and name HA )) 6 6 0 peak 7652 weight 0.1000E+01 volume 12.01920 ppm1 3.061 ppm2 3.424 ASSI { 7662} (( segid "PROT" and resid 90 and name HD2# )) (( segid "PROT" and resid 90 and name HB2 )) 6 6 0 peak 7662 weight 0.1000E+01 volume 102.93980 ppm1 0.986 ppm2 1.826 ASSI { 7672} (( segid "PROT" and resid 65 and name HD2 )) (( segid "PROT" and resid 65 and name HE1 )) 6 6 0 peak 7672 weight 0.1000E+01 volume 42.35620 ppm1 1.346 ppm2 2.371 ASSI { 7682} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 9 and name HB1 )) 6 6 0 peak 7682 weight 0.1000E+01 volume 12.43030 ppm1 0.354 ppm2 2.860 ASSI { 7692} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 9 and name HB1 )) 6 6 0 peak 7692 weight 0.1000E+01 volume 11.29940 ppm1 0.268 ppm2 2.857 ASSI { 7702} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 14 and name HB2 )) 6 6 0 peak 7702 weight 0.1000E+01 volume 66.68630 ppm1 0.268 ppm2 1.312 ASSI { 7712} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 80 and name HB1 )) 6 6 0 peak 7712 weight 0.1000E+01 volume 2.80540 ppm1 0.350 ppm2 2.790 ASSI { 7722} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 80 and name HB2 )) 6 6 0 peak 7722 weight 0.1000E+01 volume 3.64700 ppm1 0.348 ppm2 2.504 ASSI { 7732} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 109 and name HB1 )) 6 6 0 peak 7732 weight 0.1000E+01 volume 7.87190 ppm1 7.046 ppm2 3.346 ASSI { 7742} (( segid "PROT" and resid 109 and name HA )) (( segid "PROT" and resid 109 and name HB2 )) 6 6 0 peak 7742 weight 0.1000E+01 volume 16.33290 ppm1 4.025 ppm2 3.346 ASSI { 7752} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 35 and name HB2 )) 6 6 0 peak 7752 weight 0.1000E+01 volume 4.02490 ppm1 0.232 ppm2 2.629 ASSI { 7762} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 109 and name HB2 )) 6 6 0 peak 7762 weight 0.1000E+01 volume 9.40150 ppm1 0.897 ppm2 3.066 ASSI { 7772} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 109 and name HB1 )) 6 6 0 peak 7772 weight 0.1000E+01 volume 6.43740 ppm1 0.896 ppm2 3.339 ASSI { 7782} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 109 and name HB2 )) 6 6 0 peak 7782 weight 0.1000E+01 volume 13.97380 ppm1 6.054 ppm2 3.059 ASSI { 7792} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 35 and name HB1 )) 6 6 0 peak 7792 weight 0.1000E+01 volume 5.27410 ppm1 7.375 ppm2 3.846 ASSI { 7802} (( segid "PROT" and resid 109 and name HA )) (( segid "PROT" and resid 109 and name HB1 )) 6 6 0 peak 7802 weight 0.1000E+01 volume 5.27780 ppm1 4.034 ppm2 3.050 ASSI { 7812} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 35 and name HB1 )) 6 6 0 peak 7812 weight 0.1000E+01 volume 1.45930 ppm1 0.231 ppm2 3.846 ASSI { 7822} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 109 and name HB2 )) 6 6 0 peak 7822 weight 0.1000E+01 volume 5.11750 ppm1 7.052 ppm2 3.065 ASSI { 7832} (( segid "PROT" and resid 34 and name HD1 )) (( segid "PROT" and resid 33 and name HB2 )) 6 6 0 peak 7832 weight 0.1000E+01 volume 26.67930 ppm1 3.839 ppm2 1.598 ASSI { 7842} (( segid "PROT" and resid 33 and name HA )) (( segid "PROT" and resid 33 and name HB2 )) 6 6 0 peak 7842 weight 0.1000E+01 volume 28.33770 ppm1 3.914 ppm2 1.598 ASSI { 7852} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 77 and name HB2 )) 6 6 0 peak 7852 weight 0.1000E+01 volume 5.74540 ppm1 6.743 ppm2 1.778 ASSI { 7862} (( segid "PROT" and resid 77 and name HA )) (( segid "PROT" and resid 77 and name HB2 )) 6 6 0 peak 7862 weight 0.1000E+01 volume 23.56720 ppm1 3.387 ppm2 1.776 ASSI { 7872} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 77 and name HB2 )) 6 6 0 peak 7872 weight 0.1000E+01 volume 16.61380 ppm1 0.233 ppm2 1.783 ASSI { 7882} (( segid "PROT" and resid 77 and name HB2 )) (( segid "PROT" and resid 77 and name HB1 )) 6 6 0 peak 7882 weight 0.1000E+01 volume 37.29020 ppm1 1.772 ppm2 2.635 ASSI { 7892} (( segid "PROT" and resid 77 and name HA )) (( segid "PROT" and resid 77 and name HB1 )) 6 6 0 peak 7892 weight 0.1000E+01 volume 27.99290 ppm1 3.384 ppm2 2.640 ASSI { 7902} (( segid "PROT" and resid 7 and name HG2 )) (( segid "PROT" and resid 7 and name HB1 )) 6 6 0 peak 7902 weight 0.1000E+01 volume 61.12390 ppm1 0.964 ppm2 1.603 ASSI { 7912} (( segid "PROT" and resid 7 and name HG1 )) (( segid "PROT" and resid 7 and name HB1 )) 6 6 0 peak 7912 weight 0.1000E+01 volume 74.43580 ppm1 1.097 ppm2 1.602 ASSI { 7922} (( segid "PROT" and resid 7 and name HA )) (( segid "PROT" and resid 7 and name HB1 )) 6 6 0 peak 7922 weight 0.1000E+01 volume 246.83611 ppm1 4.238 ppm2 1.609 ASSI { 7932} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 7 and name HB1 )) 6 6 0 peak 7932 weight 0.1000E+01 volume 28.31920 ppm1 7.392 ppm2 1.604 ASSI { 7942} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 28 and name HG1 )) 6 6 0 peak 7942 weight 0.1000E+01 volume 9.32510 ppm1 0.568 ppm2 2.800 ASSI { 7952} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 28 and name HG1 )) 6 6 0 peak 7952 weight 0.1000E+01 volume 3.66990 ppm1 0.956 ppm2 2.800 ASSI { 7962} (( segid "PROT" and resid 28 and name HA )) (( segid "PROT" and resid 28 and name HG1 )) 6 6 0 peak 7962 weight 0.1000E+01 volume 5.42670 ppm1 4.113 ppm2 2.794 ASSI { 7972} (( segid "PROT" and resid 118 and name HA )) (( segid "PROT" and resid 118 and name HG2 )) 6 6 0 peak 7972 weight 0.1000E+01 volume 176.77390 ppm1 4.112 ppm2 2.417 ASSI { 7982} (( segid "PROT" and resid 50 and name HA )) (( segid "PROT" and resid 53 and name HB )) 6 6 0 peak 7982 weight 0.1000E+01 volume 6.57230 ppm1 4.977 ppm2 1.024 ASSI { 7992} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 62 and name HG11 )) 6 6 0 peak 7992 weight 0.1000E+01 volume 22.32890 ppm1 0.347 ppm2 1.892 ASSI { 8002} (( segid "PROT" and resid 90 and name HD2# )) (( segid "PROT" and resid 90 and name HG )) 6 6 0 peak 8002 weight 0.1000E+01 volume 181.41299 ppm1 0.983 ppm2 1.413 ASSI { 8012} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 8012 weight 0.1000E+01 volume 23.46040 ppm1 1.203 ppm2 0.232 ASSI { 8022} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 8022 weight 0.1000E+01 volume 23.41340 ppm1 -1.491 ppm2 0.898 ASSI { 8032} (( segid "PROT" and resid 25 and name HG )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 8032 weight 0.1000E+01 volume 88.09440 ppm1 2.383 ppm2 0.894 ASSI { 8042} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 8042 weight 0.1000E+01 volume 131.46170 ppm1 4.104 ppm2 0.896 ASSI { 8052} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 8052 weight 0.1000E+01 volume 68.92910 ppm1 7.044 ppm2 0.888 ASSI { 8062} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 8062 weight 0.1000E+01 volume 32.98010 ppm1 2.218 ppm2 0.831 ASSI { 8072} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 8072 weight 0.1000E+01 volume 32.69140 ppm1 0.740 ppm2 0.231 ASSI { 8082} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 8082 weight 0.1000E+01 volume 47.22320 ppm1 0.837 ppm2 0.231 ASSI { 8092} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 8092 weight 0.1000E+01 volume 10.63390 ppm1 -1.491 ppm2 1.262 ASSI { 8102} (( segid "PROT" and resid 113 and name HA )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 8102 weight 0.1000E+01 volume 29.06940 ppm1 4.092 ppm2 0.775 ASSI { 8112} (( segid "PROT" and resid 87 and name HA )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 8112 weight 0.1000E+01 volume 36.29260 ppm1 4.456 ppm2 0.444 ASSI { 8122} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 8122 weight 0.1000E+01 volume 119.20950 ppm1 -0.260 ppm2 -1.498 ASSI { 8132} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 8132 weight 0.1000E+01 volume 206.84270 ppm1 -1.495 ppm2 -0.261 ASSI { 8142} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 8142 weight 0.1000E+01 volume 112.00890 ppm1 0.871 ppm2 1.412 ASSI { 8152} (( segid "PROT" and resid 81 and name HA )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 8152 weight 0.1000E+01 volume 72.21630 ppm1 2.479 ppm2 0.342 ASSI { 8162} (( segid "PROT" and resid 117 and name HG2 )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8162 weight 0.1000E+01 volume 11.51490 ppm1 2.509 ppm2 0.890 ASSI { 8172} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8172 weight 0.1000E+01 volume 29.87400 ppm1 2.068 ppm2 0.888 ASSI { 8182} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8182 weight 0.1000E+01 volume 142.12590 ppm1 1.300 ppm2 0.887 ASSI { 8192} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8192 weight 0.1000E+01 volume 165.98660 ppm1 0.718 ppm2 0.889 ASSI { 8202} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8202 weight 0.1000E+01 volume 12.85800 ppm1 0.235 ppm2 0.888 ASSI { 8212} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8212 weight 0.1000E+01 volume 54.47260 ppm1 6.613 ppm2 0.890 ASSI { 8222} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8222 weight 0.1000E+01 volume 12.41300 ppm1 6.734 ppm2 0.890 ASSI { 8232} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8232 weight 0.1000E+01 volume 22.88290 ppm1 6.852 ppm2 0.887 ASSI { 8242} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8242 weight 0.1000E+01 volume 7.82260 ppm1 7.055 ppm2 0.889 ASSI { 8252} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 8252 weight 0.1000E+01 volume 28.94980 ppm1 7.190 ppm2 0.888 ASSI { 8262} (( segid "PROT" and resid 46 and name HB )) (( segid "PROT" and resid 46 and name HG2# )) 6 6 0 peak 8262 weight 0.1000E+01 volume 9.49780 ppm1 2.266 ppm2 0.749 ASSI { 8272} (( segid "PROT" and resid 46 and name HA )) (( segid "PROT" and resid 46 and name HG2# )) 6 6 0 peak 8272 weight 0.1000E+01 volume 19.65360 ppm1 4.880 ppm2 0.750 ASSI { 8282} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 46 and name HG2# )) 6 6 0 peak 8282 weight 0.1000E+01 volume 9.97770 ppm1 6.707 ppm2 0.734 ASSI { 8292} (( segid "PROT" and resid 113 and name HG11 )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 8292 weight 0.1000E+01 volume 63.07410 ppm1 1.219 ppm2 0.772 ASSI { 8302} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 105 and name HB2 )) 6 6 0 peak 8302 weight 0.1000E+01 volume 10.68170 ppm1 0.394 ppm2 1.105 ASSI { 8312} (( segid "PROT" and resid 29 and name HB2 )) (( segid "PROT" and resid 30 and name HA )) 6 6 0 peak 8312 weight 0.1000E+01 volume 5.64760 ppm1 2.256 ppm2 5.037 ASSI { 8322} (( segid "PROT" and resid 33 and name HB1 )) (( segid "PROT" and resid 30 and name HA )) 6 6 0 peak 8322 weight 0.1000E+01 volume 26.70900 ppm1 2.111 ppm2 5.039 ASSI { 8332} (( segid "PROT" and resid 33 and name HD1# )) (( segid "PROT" and resid 30 and name HA )) 6 6 0 peak 8332 weight 0.1000E+01 volume 8.14900 ppm1 0.967 ppm2 5.043 ASSI { 8342} (( segid "PROT" and resid 33 and name HG )) (( segid "PROT" and resid 30 and name HA )) 6 6 0 peak 8342 weight 0.1000E+01 volume 6.89820 ppm1 1.683 ppm2 5.045 ASSI { 8352} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 110 and name HA )) 6 6 0 peak 8352 weight 0.1000E+01 volume 7.13880 ppm1 6.975 ppm2 4.014 ASSI { 8362} (( segid "PROT" and resid 110 and name HG1 )) (( segid "PROT" and resid 110 and name HA )) 6 6 0 peak 8362 weight 0.1000E+01 volume 22.14250 ppm1 2.834 ppm2 4.012 ASSI { 8372} (( segid "PROT" and resid 26 and name HB1 )) (( segid "PROT" and resid 23 and name HA )) 6 6 0 peak 8372 weight 0.1000E+01 volume 44.53830 ppm1 2.897 ppm2 4.016 ASSI { 8382} (( segid "PROT" and resid 89 and name HZ2 )) (( segid "PROT" and resid 103 and name HA )) 6 6 0 peak 8382 weight 0.1000E+01 volume 25.79350 ppm1 6.962 ppm2 4.453 ASSI { 8392} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 11 and name HD1 )) 6 6 0 peak 8392 weight 0.1000E+01 volume 3.26160 ppm1 4.232 ppm2 3.923 ASSI { 8402} (( segid "PROT" and resid 11 and name HB1 )) (( segid "PROT" and resid 11 and name HD1 )) 6 6 0 peak 8402 weight 0.1000E+01 volume 9.13100 ppm1 2.440 ppm2 3.941 ASSI { 8412} (( segid "PROT" and resid 11 and name HG1 )) (( segid "PROT" and resid 11 and name HD1 )) 6 6 0 peak 8412 weight 0.1000E+01 volume 36.59800 ppm1 2.289 ppm2 3.936 ASSI { 8422} (( segid "PROT" and resid 11 and name HG2 )) (( segid "PROT" and resid 11 and name HD1 )) 6 6 0 peak 8422 weight 0.1000E+01 volume 31.42280 ppm1 2.191 ppm2 3.936 ASSI { 8432} (( segid "PROT" and resid 10 and name HB2 )) (( segid "PROT" and resid 11 and name HD2 )) 6 6 0 peak 8432 weight 0.1000E+01 volume 10.02950 ppm1 1.663 ppm2 3.930 ASSI { 8442} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 10 and name HA )) 6 6 0 peak 8442 weight 0.1000E+01 volume 15.09080 ppm1 3.985 ppm2 4.680 ASSI { 8452} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 59 and name HB2 )) 6 6 0 peak 8452 weight 0.1000E+01 volume 19.70060 ppm1 0.239 ppm2 1.352 ASSI { 8462} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 101 and name HA )) 6 6 0 peak 8462 weight 0.1000E+01 volume 11.98860 ppm1 7.098 ppm2 4.498 ASSI { 8472} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 101 and name HA )) 6 6 0 peak 8472 weight 0.1000E+01 volume 6.72440 ppm1 7.327 ppm2 4.505 ASSI { 8482} (( segid "PROT" and resid 101 and name HB1 )) (( segid "PROT" and resid 101 and name HA )) 6 6 0 peak 8482 weight 0.1000E+01 volume 1.52300 ppm1 3.915 ppm2 4.498 ASSI { 8492} (( segid "PROT" and resid 104 and name HB2 )) (( segid "PROT" and resid 101 and name HA )) 6 6 0 peak 8492 weight 0.1000E+01 volume 2.42640 ppm1 2.008 ppm2 4.500 ASSI { 8502} (( segid "PROT" and resid 31 and name HG1 )) (( segid "PROT" and resid 101 and name HA )) 6 6 0 peak 8502 weight 0.1000E+01 volume 1.73960 ppm1 2.298 ppm2 4.512 ASSI { 8512} (( segid "PROT" and resid 31 and name HB1 )) (( segid "PROT" and resid 101 and name HA )) 6 6 0 peak 8512 weight 0.1000E+01 volume 2.51460 ppm1 1.587 ppm2 4.507 ASSI { 8522} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 26 and name HB1 )) 6 6 0 peak 8522 weight 0.1000E+01 volume 1.35000 ppm1 0.236 ppm2 2.900 ASSI { 8532} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 8532 weight 0.1000E+01 volume 10.86410 ppm1 6.709 ppm2 3.585 ASSI { 8542} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 8542 weight 0.1000E+01 volume 1.13110 ppm1 6.148 ppm2 3.585 ASSI { 8552} (( segid "PROT" and resid 49 and name HD1 )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 8552 weight 0.1000E+01 volume 0.92530 ppm1 5.447 ppm2 3.577 ASSI { 8562} (( segid "PROT" and resid 52 and name HB )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 8562 weight 0.1000E+01 volume 1.06430 ppm1 1.829 ppm2 3.576 ASSI { 8572} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 8572 weight 0.1000E+01 volume 1.30380 ppm1 1.003 ppm2 3.568 ASSI { 8582} (( segid "PROT" and resid 49 and name HD1 )) (( segid "PROT" and resid 49 and name HB2 )) 6 6 0 peak 8582 weight 0.1000E+01 volume 1.13800 ppm1 5.423 ppm2 1.969 ASSI { 8592} (( segid "PROT" and resid 49 and name HA )) (( segid "PROT" and resid 49 and name HB2 )) 6 6 0 peak 8592 weight 0.1000E+01 volume 3.12780 ppm1 3.591 ppm2 1.979 ASSI { 8602} (( segid "PROT" and resid 77 and name HB2 )) (( segid "PROT" and resid 77 and name HA )) 6 6 0 peak 8602 weight 0.1000E+01 volume 18.21600 ppm1 1.777 ppm2 3.381 ASSI { 8612} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 77 and name HA )) 6 6 0 peak 8612 weight 0.1000E+01 volume 2.40300 ppm1 6.619 ppm2 3.383 ASSI { 8622} (( segid "PROT" and resid 71 and name HD1 )) (( segid "PROT" and resid 71 and name HB1 )) 6 6 0 peak 8622 weight 0.1000E+01 volume 3.45550 ppm1 6.868 ppm2 2.693 ASSI { 8632} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 77 and name HB2 )) 6 6 0 peak 8632 weight 0.1000E+01 volume 1.04970 ppm1 6.640 ppm2 1.780 ASSI { 8642} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 91 and name HB1 )) 6 6 0 peak 8642 weight 0.1000E+01 volume 3.44820 ppm1 6.932 ppm2 2.962 ASSI { 8652} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 91 and name HB2 )) 6 6 0 peak 8652 weight 0.1000E+01 volume 3.37150 ppm1 6.934 ppm2 2.901 ASSI { 8662} (( segid "PROT" and resid 91 and name HA )) (( segid "PROT" and resid 91 and name HB2 )) 6 6 0 peak 8662 weight 0.1000E+01 volume 3.36910 ppm1 4.010 ppm2 2.910 ASSI { 8672} (( segid "PROT" and resid 91 and name HA )) (( segid "PROT" and resid 91 and name HB1 )) 6 6 0 peak 8672 weight 0.1000E+01 volume 3.67120 ppm1 4.008 ppm2 2.977 ASSI { 8682} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 91 and name HB2 )) 6 6 0 peak 8682 weight 0.1000E+01 volume 2.47070 ppm1 0.446 ppm2 2.911 ASSI { 8692} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 91 and name HB1 )) 6 6 0 peak 8692 weight 0.1000E+01 volume 2.97440 ppm1 0.445 ppm2 2.970 ASSI { 8702} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 91 and name HB1 )) 6 6 0 peak 8702 weight 0.1000E+01 volume 2.23900 ppm1 0.993 ppm2 2.967 ASSI { 8712} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 91 and name HB2 )) 6 6 0 peak 8712 weight 0.1000E+01 volume 2.57370 ppm1 0.994 ppm2 2.915 ASSI { 8722} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 91 and name HA )) 6 6 0 peak 8722 weight 0.1000E+01 volume 3.88660 ppm1 6.707 ppm2 4.006 ASSI { 8732} (( segid "PROT" and resid 109 and name HB2 )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 8732 weight 0.1000E+01 volume 4.04440 ppm1 3.056 ppm2 4.021 ASSI { 8742} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 8742 weight 0.1000E+01 volume 15.23610 ppm1 7.038 ppm2 4.028 ASSI { 8752} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 109 and name HB1 )) 6 6 0 peak 8752 weight 0.1000E+01 volume 5.53550 ppm1 6.063 ppm2 3.338 ASSI { 8762} (( segid "PROT" and resid 109 and name HB1 )) (( segid "PROT" and resid 109 and name HB2 )) 6 6 0 peak 8762 weight 0.1000E+01 volume 4.99460 ppm1 3.344 ppm2 3.065 ASSI { 8772} (( segid "PROT" and resid 106 and name HA )) (( segid "PROT" and resid 109 and name HB2 )) 6 6 0 peak 8772 weight 0.1000E+01 volume 0.98400 ppm1 3.420 ppm2 3.063 ASSI { 8782} (( segid "PROT" and resid 106 and name HA )) (( segid "PROT" and resid 109 and name HB1 )) 6 6 0 peak 8782 weight 0.1000E+01 volume 2.06380 ppm1 3.425 ppm2 3.349 ASSI { 8792} (( segid "PROT" and resid 109 and name HB2 )) (( segid "PROT" and resid 109 and name HB1 )) 6 6 0 peak 8792 weight 0.1000E+01 volume 2.40750 ppm1 3.053 ppm2 3.342 ASSI { 8802} (( segid "PROT" and resid 109 and name HB1 )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 8802 weight 0.1000E+01 volume 7.52430 ppm1 3.344 ppm2 4.023 ASSI { 8812} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 101 and name HB1 )) 6 6 0 peak 8812 weight 0.1000E+01 volume 1.62140 ppm1 7.090 ppm2 3.922 ASSI { 8822} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 101 and name HB2 )) 6 6 0 peak 8822 weight 0.1000E+01 volume 2.79050 ppm1 7.099 ppm2 3.673 ASSI { 8832} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 101 and name HB2 )) 6 6 0 peak 8832 weight 0.1000E+01 volume 2.50990 ppm1 7.353 ppm2 3.659 ASSI { 8842} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 101 and name HB1 )) 6 6 0 peak 8842 weight 0.1000E+01 volume 1.59510 ppm1 7.342 ppm2 3.910 ASSI { 8852} (( segid "PROT" and resid 101 and name HB1 )) (( segid "PROT" and resid 101 and name HB2 )) 6 6 0 peak 8852 weight 0.1000E+01 volume 2.41940 ppm1 3.921 ppm2 3.669 ASSI { 8862} (( segid "PROT" and resid 101 and name HB2 )) (( segid "PROT" and resid 101 and name HB1 )) 6 6 0 peak 8862 weight 0.1000E+01 volume 1.50700 ppm1 3.667 ppm2 3.916 ASSI { 8872} (( segid "PROT" and resid 98 and name HA )) (( segid "PROT" and resid 101 and name HB2 )) 6 6 0 peak 8872 weight 0.1000E+01 volume 1.58310 ppm1 3.289 ppm2 3.672 ASSI { 8882} (( segid "PROT" and resid 98 and name HA )) (( segid "PROT" and resid 101 and name HB1 )) 6 6 0 peak 8882 weight 0.1000E+01 volume 0.95860 ppm1 3.283 ppm2 3.919 ASSI { 8892} (( segid "PROT" and resid 99 and name HD1 )) (( segid "PROT" and resid 99 and name HB1 )) 6 6 0 peak 8892 weight 0.1000E+01 volume 3.71520 ppm1 7.125 ppm2 3.409 ASSI { 8902} (( segid "PROT" and resid 82 and name HB2 )) (( segid "PROT" and resid 82 and name HB1 )) 6 6 0 peak 8902 weight 0.1000E+01 volume 23.84520 ppm1 3.099 ppm2 3.303 ASSI { 8912} (( segid "PROT" and resid 82 and name HB1 )) (( segid "PROT" and resid 82 and name HB2 )) 6 6 0 peak 8912 weight 0.1000E+01 volume 23.64630 ppm1 3.295 ppm2 3.099 ASSI { 8922} (( segid "PROT" and resid 79 and name HA )) (( segid "PROT" and resid 82 and name HB1 )) 6 6 0 peak 8922 weight 0.1000E+01 volume 1.43860 ppm1 4.555 ppm2 3.295 ASSI { 8932} (( segid "PROT" and resid 79 and name HA )) (( segid "PROT" and resid 82 and name HB2 )) 6 6 0 peak 8932 weight 0.1000E+01 volume 2.09880 ppm1 4.552 ppm2 3.111 ASSI { 8942} (( segid "PROT" and resid 82 and name HB1 )) (( segid "PROT" and resid 79 and name HA )) 6 6 0 peak 8942 weight 0.1000E+01 volume 2.17290 ppm1 3.295 ppm2 4.540 ASSI { 8952} (( segid "PROT" and resid 82 and name HB2 )) (( segid "PROT" and resid 79 and name HA )) 6 6 0 peak 8952 weight 0.1000E+01 volume 0.71310 ppm1 3.108 ppm2 4.550 ASSI { 8962} (( segid "PROT" and resid 79 and name HB1 )) (( segid "PROT" and resid 79 and name HA )) 6 6 0 peak 8962 weight 0.1000E+01 volume 10.29950 ppm1 2.855 ppm2 4.560 ASSI { 8972} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 79 and name HA )) 6 6 0 peak 8972 weight 0.1000E+01 volume 1.42910 ppm1 7.475 ppm2 4.536 ASSI { 8982} (( segid "PROT" and resid 103 and name HB2 )) (( segid "PROT" and resid 103 and name HA )) 6 6 0 peak 8982 weight 0.1000E+01 volume 4.24080 ppm1 4.107 ppm2 4.445 ASSI { 8992} (( segid "PROT" and resid 103 and name HB1 )) (( segid "PROT" and resid 103 and name HA )) 6 6 0 peak 8992 weight 0.1000E+01 volume 4.49460 ppm1 4.259 ppm2 4.447 ASSI { 9002} (( segid "PROT" and resid 106 and name HB# )) (( segid "PROT" and resid 103 and name HA )) 6 6 0 peak 9002 weight 0.1000E+01 volume 5.12920 ppm1 0.928 ppm2 4.455 ASSI { 9012} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 100 and name HA )) 6 6 0 peak 9012 weight 0.1000E+01 volume 0.91340 ppm1 7.129 ppm2 4.332 ASSI { 9022} (( segid "PROT" and resid 99 and name HD1 )) (( segid "PROT" and resid 99 and name HB2 )) 6 6 0 peak 9022 weight 0.1000E+01 volume 2.35620 ppm1 7.133 ppm2 2.600 ASSI { 9032} (( segid "PROT" and resid 99 and name HB1 )) (( segid "PROT" and resid 99 and name HB2 )) 6 6 0 peak 9032 weight 0.1000E+01 volume 9.14350 ppm1 3.405 ppm2 2.607 ASSI { 9042} (( segid "PROT" and resid 99 and name HA )) (( segid "PROT" and resid 99 and name HB2 )) 6 6 0 peak 9042 weight 0.1000E+01 volume 1.69660 ppm1 3.776 ppm2 2.598 ASSI { 9052} (( segid "PROT" and resid 99 and name HA )) (( segid "PROT" and resid 99 and name HB1 )) 6 6 0 peak 9052 weight 0.1000E+01 volume 2.64600 ppm1 3.783 ppm2 3.411 ASSI { 9062} (( segid "PROT" and resid 99 and name HB2 )) (( segid "PROT" and resid 99 and name HB1 )) 6 6 0 peak 9062 weight 0.1000E+01 volume 5.39780 ppm1 2.604 ppm2 3.407 ASSI { 9072} (( segid "PROT" and resid 85 and name HD1 )) (( segid "PROT" and resid 85 and name HB1 )) 6 6 0 peak 9072 weight 0.1000E+01 volume 5.13290 ppm1 6.052 ppm2 2.495 ASSI { 9082} (( segid "PROT" and resid 85 and name HD1 )) (( segid "PROT" and resid 85 and name HB2 )) 6 6 0 peak 9082 weight 0.1000E+01 volume 5.35040 ppm1 6.048 ppm2 1.450 ASSI { 9092} (( segid "PROT" and resid 85 and name HA )) (( segid "PROT" and resid 85 and name HB2 )) 6 6 0 peak 9092 weight 0.1000E+01 volume 2.87950 ppm1 4.170 ppm2 1.465 ASSI { 9102} (( segid "PROT" and resid 82 and name HA )) (( segid "PROT" and resid 85 and name HB2 )) 6 6 0 peak 9102 weight 0.1000E+01 volume 1.27720 ppm1 3.979 ppm2 1.455 ASSI { 9112} (( segid "PROT" and resid 85 and name HB2 )) (( segid "PROT" and resid 85 and name HB1 )) 6 6 0 peak 9112 weight 0.1000E+01 volume 3.37650 ppm1 1.459 ppm2 2.481 ASSI { 9122} (( segid "PROT" and resid 85 and name HB1 )) (( segid "PROT" and resid 85 and name HB2 )) 6 6 0 peak 9122 weight 0.1000E+01 volume 4.33890 ppm1 2.491 ppm2 1.455 ASSI { 9132} (( segid "PROT" and resid 85 and name HD1 )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 9132 weight 0.1000E+01 volume 4.48960 ppm1 6.053 ppm2 1.743 ASSI { 9142} (( segid "PROT" and resid 50 and name HB2 )) (( segid "PROT" and resid 50 and name HB1 )) 6 6 0 peak 9142 weight 0.1000E+01 volume 13.62740 ppm1 2.946 ppm2 3.470 ASSI { 9152} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 35 and name HB2 )) 6 6 0 peak 9152 weight 0.1000E+01 volume 0.63670 ppm1 7.374 ppm2 2.626 ASSI { 9162} (( segid "PROT" and resid 35 and name HB1 )) (( segid "PROT" and resid 35 and name HB2 )) 6 6 0 peak 9162 weight 0.1000E+01 volume 3.69570 ppm1 3.845 ppm2 2.624 ASSI { 9172} (( segid "PROT" and resid 35 and name HB1 )) (( segid "PROT" and resid 35 and name HA )) 6 6 0 peak 9172 weight 0.1000E+01 volume 1.16500 ppm1 3.840 ppm2 4.752 ASSI { 9182} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 35 and name HA )) 6 6 0 peak 9182 weight 0.1000E+01 volume 1.56940 ppm1 7.364 ppm2 4.752 ASSI { 9192} (( segid "PROT" and resid 57 and name HE# )) (( segid "PROT" and resid 61 and name HB )) 6 6 0 peak 9192 weight 0.1000E+01 volume 2.64110 ppm1 1.986 ppm2 4.220 ASSI { 9202} (( segid "PROT" and resid 61 and name HB )) (( segid "PROT" and resid 61 and name HA )) 6 6 0 peak 9202 weight 0.1000E+01 volume 8.61410 ppm1 4.226 ppm2 3.878 ASSI { 9212} (( segid "PROT" and resid 61 and name HG2# )) (( segid "PROT" and resid 61 and name HA )) 6 6 0 peak 9212 weight 0.1000E+01 volume 15.56760 ppm1 1.139 ppm2 3.879 ASSI { 9222} (( segid "PROT" and resid 94 and name HG2 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 9222 weight 0.1000E+01 volume 10.25530 ppm1 1.057 ppm2 2.175 ASSI { 9232} (( segid "PROT" and resid 94 and name HG1 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 9232 weight 0.1000E+01 volume 6.88100 ppm1 1.168 ppm2 2.180 ASSI { 9242} (( segid "PROT" and resid 94 and name HB2 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 9242 weight 0.1000E+01 volume 8.15140 ppm1 1.371 ppm2 2.181 ASSI { 9252} (( segid "PROT" and resid 94 and name HB1 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 9252 weight 0.1000E+01 volume 3.42100 ppm1 1.431 ppm2 2.181 ASSI { 9262} (( segid "PROT" and resid 96 and name HB2 )) (( segid "PROT" and resid 96 and name HA )) 6 6 0 peak 9262 weight 0.1000E+01 volume 6.74240 ppm1 3.998 ppm2 4.422 ASSI { 9282} (( segid "PROT" and resid 46 and name HG2# )) (( segid "PROT" and resid 46 and name HA )) 6 6 0 peak 9282 weight 0.1000E+01 volume 2.74460 ppm1 0.743 ppm2 4.877 ASSI { 9292} (( segid "PROT" and resid 47 and name HG1 )) (( segid "PROT" and resid 46 and name HA )) 6 6 0 peak 9292 weight 0.1000E+01 volume 0.79000 ppm1 1.932 ppm2 4.871 ASSI { 9302} (( segid "PROT" and resid 46 and name HB )) (( segid "PROT" and resid 46 and name HA )) 6 6 0 peak 9302 weight 0.1000E+01 volume 2.01360 ppm1 2.267 ppm2 4.865 ASSI { 9312} (( segid "PROT" and resid 47 and name HD2 )) (( segid "PROT" and resid 46 and name HA )) 6 6 0 peak 9312 weight 0.1000E+01 volume 3.50470 ppm1 3.277 ppm2 4.871 ASSI { 9322} (( segid "PROT" and resid 47 and name HD1 )) (( segid "PROT" and resid 46 and name HA )) 6 6 0 peak 9322 weight 0.1000E+01 volume 2.84250 ppm1 3.730 ppm2 4.871 ASSI { 9332} (( segid "PROT" and resid 46 and name HG2# )) (( segid "PROT" and resid 46 and name HB )) 6 6 0 peak 9332 weight 0.1000E+01 volume 3.97090 ppm1 0.749 ppm2 2.261 ASSI { 9342} (( segid "PROT" and resid 46 and name HG11 )) (( segid "PROT" and resid 46 and name HB )) 6 6 0 peak 9342 weight 0.1000E+01 volume 1.99360 ppm1 1.490 ppm2 2.303 ASSI { 9352} (( segid "PROT" and resid 46 and name HA )) (( segid "PROT" and resid 46 and name HB )) 6 6 0 peak 9352 weight 0.1000E+01 volume 2.91250 ppm1 4.876 ppm2 2.263 ASSI { 9362} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 46 and name HG11 )) 6 6 0 peak 9362 weight 0.1000E+01 volume 1.67740 ppm1 3.635 ppm2 1.604 ASSI { 9372} (( segid "PROT" and resid 52 and name HG11 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 9372 weight 0.1000E+01 volume 34.11280 ppm1 1.560 ppm2 0.882 ASSI { 9382} (( segid "PROT" and resid 51 and name HB1 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 9382 weight 0.1000E+01 volume 10.69160 ppm1 2.939 ppm2 0.886 ASSI { 9392} (( segid "PROT" and resid 49 and name HA )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 9392 weight 0.1000E+01 volume 5.02970 ppm1 3.583 ppm2 0.881 ASSI { 9402} (( segid "PROT" and resid 48 and name HA )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 9402 weight 0.1000E+01 volume 2.14330 ppm1 4.600 ppm2 0.883 ASSI { 9412} (( segid "PROT" and resid 52 and name HG11 )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 9412 weight 0.1000E+01 volume 29.14780 ppm1 1.560 ppm2 0.997 ASSI { 9422} (( segid "PROT" and resid 52 and name HG12 )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 9422 weight 0.1000E+01 volume 36.94800 ppm1 1.410 ppm2 0.998 ASSI { 9432} (( segid "PROT" and resid 91 and name HB1 )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 9432 weight 0.1000E+01 volume 6.22250 ppm1 2.969 ppm2 0.999 ASSI { 9442} (( segid "PROT" and resid 91 and name HB2 )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 9442 weight 0.1000E+01 volume 4.31090 ppm1 2.908 ppm2 0.997 ASSI { 9452} (( segid "PROT" and resid 52 and name HB )) (( segid "PROT" and resid 52 and name HA )) 6 6 0 peak 9452 weight 0.1000E+01 volume 9.14670 ppm1 1.830 ppm2 3.988 ASSI { 9462} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 52 and name HB )) 6 6 0 peak 9462 weight 0.1000E+01 volume 1.35700 ppm1 6.941 ppm2 1.823 ASSI { 9472} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 52 and name HG11 )) 6 6 0 peak 9472 weight 0.1000E+01 volume 2.97500 ppm1 6.705 ppm2 1.566 ASSI { 9482} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 52 and name HG12 )) 6 6 0 peak 9482 weight 0.1000E+01 volume 1.63770 ppm1 6.710 ppm2 1.399 ASSI { 9492} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 52 and name HG12 )) 6 6 0 peak 9492 weight 0.1000E+01 volume 3.63200 ppm1 6.909 ppm2 1.391 ASSI { 9502} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 52 and name HG11 )) 6 6 0 peak 9502 weight 0.1000E+01 volume 0.41020 ppm1 6.898 ppm2 1.562 ASSI { 9512} (( segid "PROT" and resid 52 and name HD1# )) (( segid "PROT" and resid 52 and name HG12 )) 6 6 0 peak 9512 weight 0.1000E+01 volume 16.46810 ppm1 0.882 ppm2 1.402 ASSI { 9522} (( segid "PROT" and resid 52 and name HG2# )) (( segid "PROT" and resid 52 and name HG12 )) 6 6 0 peak 9522 weight 0.1000E+01 volume 19.47360 ppm1 0.987 ppm2 1.399 ASSI { 9532} (( segid "PROT" and resid 52 and name HA )) (( segid "PROT" and resid 52 and name HG11 )) 6 6 0 peak 9532 weight 0.1000E+01 volume 7.48160 ppm1 3.993 ppm2 1.562 ASSI { 9542} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 9542 weight 0.1000E+01 volume 6.43120 ppm1 0.439 ppm2 0.884 ASSI { 9552} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 9552 weight 0.1000E+01 volume 1.69230 ppm1 0.580 ppm2 0.886 ASSI { 9572} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 9572 weight 0.1000E+01 volume 9.06840 ppm1 3.837 ppm2 0.342 ASSI { 9582} (( segid "PROT" and resid 57 and name HE# )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 9582 weight 0.1000E+01 volume 9.98300 ppm1 1.979 ppm2 0.346 ASSI { 9602} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 9602 weight 0.1000E+01 volume 4.02240 ppm1 6.615 ppm2 0.342 ASSI { 9612} (( segid "PROT" and resid 62 and name HG12 )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 9612 weight 0.1000E+01 volume 14.90700 ppm1 0.887 ppm2 1.162 ASSI { 9622} (( segid "PROT" and resid 62 and name HB )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 9622 weight 0.1000E+01 volume 19.42690 ppm1 1.693 ppm2 1.157 ASSI { 9632} (( segid "PROT" and resid 62 and name HG11 )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 9632 weight 0.1000E+01 volume 11.07200 ppm1 1.898 ppm2 1.161 ASSI { 9642} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 9642 weight 0.1000E+01 volume 3.21380 ppm1 3.842 ppm2 1.162 ASSI { 9652} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 9652 weight 0.1000E+01 volume 1.92160 ppm1 3.693 ppm2 1.171 ASSI { 9662} (( segid "PROT" and resid 77 and name HA )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 9662 weight 0.1000E+01 volume 2.82700 ppm1 3.384 ppm2 1.165 ASSI { 9672} (( segid "PROT" and resid 65 and name HD2 )) (( segid "PROT" and resid 62 and name HA )) 6 6 0 peak 9672 weight 0.1000E+01 volume 0.58420 ppm1 1.340 ppm2 3.915 ASSI { 9682} (( segid "PROT" and resid 62 and name HG11 )) (( segid "PROT" and resid 62 and name HA )) 6 6 0 peak 9682 weight 0.1000E+01 volume 3.96000 ppm1 1.903 ppm2 3.919 ASSI { 9692} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 59 and name HG )) 6 6 0 peak 9692 weight 0.1000E+01 volume 2.29990 ppm1 3.937 ppm2 1.554 ASSI { 9702} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 59 and name HG )) 6 6 0 peak 9702 weight 0.1000E+01 volume 4.25050 ppm1 3.844 ppm2 1.555 ASSI { 9712} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9712 weight 0.1000E+01 volume 3.04540 ppm1 6.616 ppm2 0.717 ASSI { 9722} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9722 weight 0.1000E+01 volume 4.15310 ppm1 6.852 ppm2 0.720 ASSI { 9732} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9732 weight 0.1000E+01 volume 3.28030 ppm1 7.039 ppm2 0.721 ASSI { 9742} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9742 weight 0.1000E+01 volume 8.53600 ppm1 7.187 ppm2 0.720 ASSI { 9752} (( segid "PROT" and resid 110 and name HA )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9752 weight 0.1000E+01 volume 22.55020 ppm1 4.001 ppm2 0.717 ASSI { 9762} (( segid "PROT" and resid 113 and name HA )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9762 weight 0.1000E+01 volume 11.49350 ppm1 4.092 ppm2 0.717 ASSI { 9772} (( segid "PROT" and resid 114 and name HA )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9772 weight 0.1000E+01 volume 12.72910 ppm1 4.551 ppm2 0.718 ASSI { 9782} (( segid "PROT" and resid 110 and name HG1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9782 weight 0.1000E+01 volume 11.36100 ppm1 2.832 ppm2 0.718 ASSI { 9792} (( segid "PROT" and resid 110 and name HG2 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9792 weight 0.1000E+01 volume 20.05540 ppm1 2.514 ppm2 0.720 ASSI { 9802} (( segid "PROT" and resid 110 and name HB1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9802 weight 0.1000E+01 volume 5.82840 ppm1 2.371 ppm2 0.717 ASSI { 9812} (( segid "PROT" and resid 110 and name HB2 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9812 weight 0.1000E+01 volume 5.75470 ppm1 2.166 ppm2 0.716 ASSI { 9822} (( segid "PROT" and resid 113 and name HG11 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9822 weight 0.1000E+01 volume 20.65690 ppm1 1.220 ppm2 0.715 ASSI { 9832} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9832 weight 0.1000E+01 volume 17.44980 ppm1 1.116 ppm2 0.717 ASSI { 9842} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 9842 weight 0.1000E+01 volume 34.06450 ppm1 0.889 ppm2 0.718 ASSI { 9852} (( segid "PROT" and resid 21 and name HB )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 9852 weight 0.1000E+01 volume 13.79630 ppm1 4.188 ppm2 0.889 ASSI { 9862} (( segid "PROT" and resid 113 and name HG11 )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 9862 weight 0.1000E+01 volume 68.06600 ppm1 1.213 ppm2 0.887 ASSI { 9872} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 9872 weight 0.1000E+01 volume 31.28540 ppm1 1.113 ppm2 0.884 ASSI { 9882} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 9882 weight 0.1000E+01 volume 21.28610 ppm1 1.040 ppm2 0.887 ASSI { 9892} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 9892 weight 0.1000E+01 volume 12.88370 ppm1 0.505 ppm2 0.890 ASSI { 9902} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 113 and name HB )) 6 6 0 peak 9902 weight 0.1000E+01 volume 7.45470 ppm1 0.889 ppm2 0.715 ASSI { 9912} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 113 and name HB )) 6 6 0 peak 9912 weight 0.1000E+01 volume 1.64900 ppm1 1.117 ppm2 0.715 ASSI { 9922} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 113 and name HB )) 6 6 0 peak 9922 weight 0.1000E+01 volume 1.41750 ppm1 1.296 ppm2 0.713 ASSI { 9932} (( segid "PROT" and resid 113 and name HG11 )) (( segid "PROT" and resid 113 and name HB )) 6 6 0 peak 9932 weight 0.1000E+01 volume 8.18300 ppm1 1.214 ppm2 0.713 ASSI { 9942} (( segid "PROT" and resid 113 and name HA )) (( segid "PROT" and resid 113 and name HG11 )) 6 6 0 peak 9942 weight 0.1000E+01 volume 1.24680 ppm1 4.091 ppm2 1.223 ASSI { 9952} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 113 and name HG11 )) 6 6 0 peak 9952 weight 0.1000E+01 volume 22.74670 ppm1 0.718 ppm2 1.213 ASSI { 9962} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 113 and name HG11 )) 6 6 0 peak 9962 weight 0.1000E+01 volume 12.28120 ppm1 0.884 ppm2 1.215 ASSI { 9982} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 9982 weight 0.1000E+01 volume 10.04870 ppm1 3.616 ppm2 -0.369 ASSI { 9992} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 39 and name HG1# )) 6 6 0 peak 9992 weight 0.1000E+01 volume 6.26380 ppm1 7.383 ppm2 0.749 ASSI { 10012} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 39 and name HB )) 6 6 0 peak 10012 weight 0.1000E+01 volume 17.93330 ppm1 -0.365 ppm2 1.469 ASSI { 10022} (( segid "PROT" and resid 39 and name HA )) (( segid "PROT" and resid 39 and name HB )) 6 6 0 peak 10022 weight 0.1000E+01 volume 2.39220 ppm1 3.208 ppm2 1.461 ASSI { 10032} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10032 weight 0.1000E+01 volume 1.73400 ppm1 5.251 ppm2 0.603 ASSI { 10042} (( segid "PROT" and resid 56 and name HA )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10042 weight 0.1000E+01 volume 10.26060 ppm1 4.131 ppm2 0.605 ASSI { 10052} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10052 weight 0.1000E+01 volume 8.32190 ppm1 3.453 ppm2 0.613 ASSI { 10062} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10062 weight 0.1000E+01 volume 2.71890 ppm1 3.691 ppm2 0.609 ASSI { 10072} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10072 weight 0.1000E+01 volume 6.53450 ppm1 2.443 ppm2 0.608 ASSI { 10082} (( segid "PROT" and resid 56 and name HB2 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10082 weight 0.1000E+01 volume 12.44520 ppm1 2.142 ppm2 0.606 ASSI { 10092} (( segid "PROT" and resid 54 and name HB1 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10092 weight 0.1000E+01 volume 0.39520 ppm1 1.833 ppm2 0.606 ASSI { 10102} (( segid "PROT" and resid 56 and name HG2 )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 10102 weight 0.1000E+01 volume 6.04350 ppm1 1.983 ppm2 0.607 ASSI { 10112} (( segid "PROT" and resid 52 and name HB )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 10112 weight 0.1000E+01 volume 18.44380 ppm1 1.825 ppm2 0.449 ASSI { 10122} (( segid "PROT" and resid 91 and name HB1 )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 10122 weight 0.1000E+01 volume 24.04020 ppm1 2.979 ppm2 0.440 ASSI { 10132} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 10132 weight 0.1000E+01 volume 12.05280 ppm1 0.773 ppm2 1.301 ASSI { 10142} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 10142 weight 0.1000E+01 volume 28.07030 ppm1 1.034 ppm2 1.308 ASSI { 10152} (( segid "PROT" and resid 79 and name HA )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 10152 weight 0.1000E+01 volume 3.70730 ppm1 4.555 ppm2 1.262 ASSI { 10162} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 10162 weight 0.1000E+01 volume 6.00320 ppm1 6.614 ppm2 1.277 ASSI { 10172} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10172 weight 0.1000E+01 volume 3.57530 ppm1 -0.255 ppm2 1.107 ASSI { 10182} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10182 weight 0.1000E+01 volume 3.17770 ppm1 0.508 ppm2 1.114 ASSI { 10192} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10192 weight 0.1000E+01 volume 9.58320 ppm1 0.719 ppm2 1.114 ASSI { 10202} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10202 weight 0.1000E+01 volume 25.13510 ppm1 0.882 ppm2 1.115 ASSI { 10212} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10212 weight 0.1000E+01 volume 42.75390 ppm1 1.261 ppm2 1.112 ASSI { 10222} (( segid "PROT" and resid 77 and name HB2 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10222 weight 0.1000E+01 volume 6.13330 ppm1 1.780 ppm2 1.114 ASSI { 10232} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10232 weight 0.1000E+01 volume 6.02030 ppm1 2.617 ppm2 1.114 ASSI { 10242} (( segid "PROT" and resid 75 and name HA )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10242 weight 0.1000E+01 volume 10.95030 ppm1 4.202 ppm2 1.107 ASSI { 10252} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10252 weight 0.1000E+01 volume 20.90240 ppm1 6.617 ppm2 1.110 ASSI { 10262} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 10262 weight 0.1000E+01 volume 5.80260 ppm1 7.480 ppm2 1.114 ASSI { 10272} (( segid "PROT" and resid 38 and name HB2 )) (( segid "PROT" and resid 38 and name HB1 )) 6 6 0 peak 10272 weight 0.1000E+01 volume 23.38120 ppm1 1.646 ppm2 2.264 ASSI { 10282} (( segid "PROT" and resid 109 and name HB1 )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 10282 weight 0.1000E+01 volume 1.88460 ppm1 3.338 ppm2 -1.498 ASSI { 10292} (( segid "PROT" and resid 78 and name HB )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 10292 weight 0.1000E+01 volume 1.75480 ppm1 2.205 ppm2 -1.498 ASSI { 10302} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 10302 weight 0.1000E+01 volume 9.56740 ppm1 1.098 ppm2 -1.495 ASSI { 10312} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 10312 weight 0.1000E+01 volume 5.72650 ppm1 1.199 ppm2 -1.498 ASSI { 10322} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 62 and name HG12 )) 6 6 0 peak 10322 weight 0.1000E+01 volume 3.71570 ppm1 1.182 ppm2 0.875 ASSI { 10332} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 81 and name HB )) 6 6 0 peak 10332 weight 0.1000E+01 volume 3.66030 ppm1 1.259 ppm2 0.869 ASSI { 10342} (( segid "PROT" and resid 62 and name HG11 )) (( segid "PROT" and resid 62 and name HG12 )) 6 6 0 peak 10342 weight 0.1000E+01 volume 4.14260 ppm1 1.895 ppm2 0.894 ASSI { 10352} (( segid "PROT" and resid 62 and name HA )) (( segid "PROT" and resid 62 and name HG12 )) 6 6 0 peak 10352 weight 0.1000E+01 volume 1.92470 ppm1 3.911 ppm2 0.897 ASSI { 10362} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 62 and name HG11 )) 6 6 0 peak 10362 weight 0.1000E+01 volume 4.86960 ppm1 1.152 ppm2 1.883 ASSI { 10372} (( segid "PROT" and resid 62 and name HA )) (( segid "PROT" and resid 62 and name HG11 )) 6 6 0 peak 10372 weight 0.1000E+01 volume 17.34920 ppm1 3.939 ppm2 1.877 ASSI { 10382} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 10382 weight 0.1000E+01 volume 15.34400 ppm1 6.611 ppm2 1.090 ASSI { 10392} (( segid "PROT" and resid 26 and name HD1 )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 10392 weight 0.1000E+01 volume 1.82440 ppm1 6.958 ppm2 1.090 ASSI { 10402} (( segid "PROT" and resid 105 and name HA )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 10402 weight 0.1000E+01 volume 10.15350 ppm1 3.636 ppm2 0.896 ASSI { 10412} (( segid "PROT" and resid 101 and name HB2 )) (( segid "PROT" and resid 98 and name HA )) 6 6 0 peak 10412 weight 0.1000E+01 volume 5.47290 ppm1 3.671 ppm2 3.292 ASSI { 10422} (( segid "PROT" and resid 101 and name HB1 )) (( segid "PROT" and resid 98 and name HA )) 6 6 0 peak 10422 weight 0.1000E+01 volume 2.11970 ppm1 3.936 ppm2 3.292 ASSI { 10432} (( segid "PROT" and resid 98 and name HG2# )) (( segid "PROT" and resid 98 and name HB )) 6 6 0 peak 10432 weight 0.1000E+01 volume 4.35800 ppm1 0.610 ppm2 1.658 ASSI { 10442} (( segid "PROT" and resid 98 and name HG1# )) (( segid "PROT" and resid 98 and name HB )) 6 6 0 peak 10442 weight 0.1000E+01 volume 1.41610 ppm1 0.806 ppm2 1.657 ASSI { 10452} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 10452 weight 0.1000E+01 volume 29.35300 ppm1 6.058 ppm2 0.897 ASSI { 10462} (( segid "PROT" and resid 24 and name HA )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 10462 weight 0.1000E+01 volume 3.63680 ppm1 3.948 ppm2 0.871 ASSI { 10472} (( segid "PROT" and resid 109 and name HA )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 10472 weight 0.1000E+01 volume 3.66170 ppm1 4.035 ppm2 0.867 ASSI { 10482} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 10482 weight 0.1000E+01 volume 5.81380 ppm1 4.110 ppm2 0.864 ASSI { 10492} (( segid "PROT" and resid 112 and name HB1 )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 10492 weight 0.1000E+01 volume 13.21090 ppm1 2.024 ppm2 0.867 ASSI { 10502} (( segid "PROT" and resid 24 and name HB# )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 10502 weight 0.1000E+01 volume 22.02210 ppm1 1.409 ppm2 0.872 ASSI { 10512} (( segid "PROT" and resid 28 and name HG1 )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 10512 weight 0.1000E+01 volume 23.12900 ppm1 2.822 ppm2 0.958 ASSI { 10522} (( segid "PROT" and resid 28 and name HG1 )) (( segid "PROT" and resid 108 and name HG2# )) 6 6 0 peak 10522 weight 0.1000E+01 volume 3.69220 ppm1 2.820 ppm2 0.867 ASSI { 10532} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 10 and name HB1 )) 6 6 0 peak 10532 weight 0.1000E+01 volume 4.69010 ppm1 3.910 ppm2 2.157 ASSI { 10542} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 10 and name HB1 )) 6 6 0 peak 10542 weight 0.1000E+01 volume 1.90230 ppm1 4.004 ppm2 2.161 ASSI { 10552} (( segid "PROT" and resid 57 and name HA )) (( segid "PROT" and resid 57 and name HB1 )) 6 6 0 peak 10552 weight 0.1000E+01 volume 1.06050 ppm1 5.068 ppm2 2.174 ASSI { 10562} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 10562 weight 0.1000E+01 volume 1.20810 ppm1 4.240 ppm2 0.963 ASSI { 10572} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 10572 weight 0.1000E+01 volume 2.11850 ppm1 4.116 ppm2 0.959 ASSI { 10582} (( segid "PROT" and resid 104 and name HG2 )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 10582 weight 0.1000E+01 volume 9.08990 ppm1 1.237 ppm2 0.961 ASSI { 10592} (( segid "PROT" and resid 104 and name HG1 )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 10592 weight 0.1000E+01 volume 4.76010 ppm1 1.480 ppm2 0.959 ASSI { 10602} (( segid "PROT" and resid 104 and name HD2 )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 10602 weight 0.1000E+01 volume 4.99420 ppm1 1.630 ppm2 0.956 ASSI { 10612} (( segid "PROT" and resid 104 and name HD1 )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 10612 weight 0.1000E+01 volume 8.07050 ppm1 1.794 ppm2 0.964 ASSI { 10622} (( segid "PROT" and resid 83 and name HB2 )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 10622 weight 0.1000E+01 volume 13.04250 ppm1 1.642 ppm2 1.105 ASSI { 10632} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 116 and name HG1# )) 6 6 0 peak 10632 weight 0.1000E+01 volume 44.62240 ppm1 1.300 ppm2 1.033 ASSI { 10642} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 100 and name HB1 )) 6 6 0 peak 10642 weight 0.1000E+01 volume 1.84470 ppm1 7.105 ppm2 2.024 ASSI { 10652} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 116 and name HA )) 6 6 0 peak 10652 weight 0.1000E+01 volume 3.78260 ppm1 1.305 ppm2 3.683 ASSI { 10662} (( segid "PROT" and resid 119 and name HB2 )) (( segid "PROT" and resid 116 and name HA )) 6 6 0 peak 10662 weight 0.1000E+01 volume 3.80610 ppm1 3.982 ppm2 3.678 ASSI { 10672} (( segid "PROT" and resid 119 and name HB1 )) (( segid "PROT" and resid 116 and name HA )) 6 6 0 peak 10672 weight 0.1000E+01 volume 2.66730 ppm1 4.030 ppm2 3.676 ASSI { 10682} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 21 and name HA )) 6 6 0 peak 10682 weight 0.1000E+01 volume 1.52990 ppm1 0.884 ppm2 4.142 ASSI { 10692} (( segid "PROT" and resid 41 and name HB2 )) (( segid "PROT" and resid 47 and name HA )) 6 6 0 peak 10692 weight 0.1000E+01 volume 8.62850 ppm1 1.735 ppm2 4.068 ASSI { 10702} (( segid "PROT" and resid 47 and name HB2 )) (( segid "PROT" and resid 47 and name HA )) 6 6 0 peak 10702 weight 0.1000E+01 volume 11.92640 ppm1 2.022 ppm2 4.059 ASSI { 10712} (( segid "PROT" and resid 47 and name HB1 )) (( segid "PROT" and resid 47 and name HA )) 6 6 0 peak 10712 weight 0.1000E+01 volume 11.89860 ppm1 2.205 ppm2 4.059 ASSI { 10722} (( segid "PROT" and resid 47 and name HG1 )) (( segid "PROT" and resid 47 and name HA )) 6 6 0 peak 10722 weight 0.1000E+01 volume 9.26090 ppm1 1.927 ppm2 4.064 ASSI { 10732} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 10732 weight 0.1000E+01 volume 3.74110 ppm1 0.887 ppm2 4.191 ASSI { 10742} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 10742 weight 0.1000E+01 volume 2.07810 ppm1 0.713 ppm2 4.195 ASSI { 10752} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 10752 weight 0.1000E+01 volume 2.17590 ppm1 1.759 ppm2 4.192 ASSI { 10762} (( segid "PROT" and resid 112 and name HB1 )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 10762 weight 0.1000E+01 volume 2.92370 ppm1 2.013 ppm2 4.196 ASSI { 10772} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 10772 weight 0.1000E+01 volume 2.31400 ppm1 7.190 ppm2 4.198 ASSI { 10782} (( segid "PROT" and resid 109 and name HD1 )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 10782 weight 0.1000E+01 volume 2.17020 ppm1 7.046 ppm2 4.194 ASSI { 10792} (( segid "PROT" and resid 112 and name HB1 )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 10792 weight 0.1000E+01 volume 16.28000 ppm1 2.020 ppm2 1.298 ASSI { 10802} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 10802 weight 0.1000E+01 volume 2.21560 ppm1 4.167 ppm2 1.221 ASSI { 10812} (( segid "PROT" and resid 67 and name HA )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 10812 weight 0.1000E+01 volume 2.96410 ppm1 4.360 ppm2 1.223 ASSI { 10822} (( segid "PROT" and resid 64 and name HG1 )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 10822 weight 0.1000E+01 volume 11.83420 ppm1 1.673 ppm2 1.225 ASSI { 10832} (( segid "PROT" and resid 64 and name HG2 )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 10832 weight 0.1000E+01 volume 4.24930 ppm1 1.505 ppm2 1.222 ASSI { 10842} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 17 and name HA )) 6 6 0 peak 10842 weight 0.1000E+01 volume 2.33350 ppm1 0.659 ppm2 4.178 ASSI { 10852} (( segid "PROT" and resid 27 and name HD2 )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 10852 weight 0.1000E+01 volume 1.41540 ppm1 3.123 ppm2 3.950 ASSI { 10862} (( segid "PROT" and resid 27 and name HG1 )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 10862 weight 0.1000E+01 volume 9.04300 ppm1 1.694 ppm2 3.947 ASSI { 10872} (( segid "PROT" and resid 27 and name HB2 )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 10872 weight 0.1000E+01 volume 4.69910 ppm1 1.816 ppm2 3.950 ASSI { 10882} (( segid "PROT" and resid 27 and name HB1 )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 10882 weight 0.1000E+01 volume 5.82920 ppm1 1.894 ppm2 3.950 ASSI { 10892} (( segid "PROT" and resid 23 and name HB1 )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 10892 weight 0.1000E+01 volume 2.81520 ppm1 2.023 ppm2 3.950 ASSI { 10902} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 24 and name HA )) 6 6 0 peak 10902 weight 0.1000E+01 volume 2.66890 ppm1 0.871 ppm2 3.950 ASSI { 10912} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 10912 weight 0.1000E+01 volume 9.31400 ppm1 1.757 ppm2 1.409 ASSI { 10922} (( segid "PROT" and resid 35 and name HB1 )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 10922 weight 0.1000E+01 volume 2.39940 ppm1 3.785 ppm2 1.751 ASSI { 10932} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 10932 weight 0.1000E+01 volume 89.45000 ppm1 0.349 ppm2 0.262 ASSI { 10942} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 10942 weight 0.1000E+01 volume 40.48810 ppm1 0.512 ppm2 0.231 ASSI { 10952} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 10952 weight 0.1000E+01 volume 5.60310 ppm1 7.184 ppm2 0.668 ASSI { 10962} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 10962 weight 0.1000E+01 volume 2.56560 ppm1 7.394 ppm2 0.358 ASSI { 10972} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 10972 weight 0.1000E+01 volume 3.21120 ppm1 7.333 ppm2 0.358 ASSI { 10982} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 10982 weight 0.1000E+01 volume 13.58280 ppm1 4.624 ppm2 0.352 ASSI { 10992} (( segid "PROT" and resid 72 and name HA )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 10992 weight 0.1000E+01 volume 2.77640 ppm1 4.293 ppm2 0.350 ASSI { 11002} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11002 weight 0.1000E+01 volume 3.56230 ppm1 4.231 ppm2 0.352 ASSI { 11012} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11012 weight 0.1000E+01 volume 16.18150 ppm1 3.785 ppm2 0.356 ASSI { 11022} (( segid "PROT" and resid 9 and name HB1 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11022 weight 0.1000E+01 volume 16.14290 ppm1 2.864 ppm2 0.349 ASSI { 11032} (( segid "PROT" and resid 74 and name HD2 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11032 weight 0.1000E+01 volume 10.73210 ppm1 2.762 ppm2 0.351 ASSI { 11042} (( segid "PROT" and resid 13 and name HB2 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11042 weight 0.1000E+01 volume 3.85110 ppm1 2.197 ppm2 0.346 ASSI { 11052} (( segid "PROT" and resid 13 and name HB1 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11052 weight 0.1000E+01 volume 5.50780 ppm1 2.434 ppm2 0.353 ASSI { 11062} (( segid "PROT" and resid 74 and name HB1 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11062 weight 0.1000E+01 volume 10.92710 ppm1 1.786 ppm2 0.353 ASSI { 11072} (( segid "PROT" and resid 14 and name HB1 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11072 weight 0.1000E+01 volume 16.43780 ppm1 1.648 ppm2 0.349 ASSI { 11092} (( segid "PROT" and resid 14 and name HG )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11092 weight 0.1000E+01 volume 13.45510 ppm1 1.396 ppm2 0.349 ASSI { 11102} (( segid "PROT" and resid 14 and name HB2 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11102 weight 0.1000E+01 volume 33.47940 ppm1 1.311 ppm2 0.351 ASSI { 11112} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 11112 weight 0.1000E+01 volume 34.41310 ppm1 0.265 ppm2 0.346 ASSI { 11122} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 14 and name HA )) 6 6 0 peak 11122 weight 0.1000E+01 volume 2.67380 ppm1 1.555 ppm2 3.795 ASSI { 11132} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11132 weight 0.1000E+01 volume 9.02020 ppm1 7.422 ppm2 0.388 ASSI { 11142} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11142 weight 0.1000E+01 volume 3.95720 ppm1 0.234 ppm2 0.390 ASSI { 11152} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11152 weight 0.1000E+01 volume 14.08140 ppm1 0.896 ppm2 0.391 ASSI { 11162} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11162 weight 0.1000E+01 volume 3.71620 ppm1 1.243 ppm2 0.393 ASSI { 11172} (( segid "PROT" and resid 105 and name HB1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11172 weight 0.1000E+01 volume 27.40590 ppm1 1.510 ppm2 0.392 ASSI { 11182} (( segid "PROT" and resid 105 and name HG )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11182 weight 0.1000E+01 volume 29.90590 ppm1 1.645 ppm2 0.391 ASSI { 11192} (( segid "PROT" and resid 28 and name HB1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11192 weight 0.1000E+01 volume 3.17970 ppm1 2.137 ppm2 0.391 ASSI { 11202} (( segid "PROT" and resid 28 and name HB2 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11202 weight 0.1000E+01 volume 4.58660 ppm1 2.055 ppm2 0.391 ASSI { 11212} (( segid "PROT" and resid 25 and name HB1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11212 weight 0.1000E+01 volume 1.85630 ppm1 2.298 ppm2 0.391 ASSI { 11222} (( segid "PROT" and resid 102 and name HA )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11222 weight 0.1000E+01 volume 8.05520 ppm1 3.238 ppm2 0.394 ASSI { 11232} (( segid "PROT" and resid 105 and name HA )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11232 weight 0.1000E+01 volume 12.24890 ppm1 3.637 ppm2 0.390 ASSI { 11242} (( segid "PROT" and resid 35 and name HB1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11242 weight 0.1000E+01 volume 2.07950 ppm1 3.837 ppm2 0.390 ASSI { 11252} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11252 weight 0.1000E+01 volume 2.43250 ppm1 4.116 ppm2 0.393 ASSI { 11262} (( segid "PROT" and resid 32 and name HA )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 11262 weight 0.1000E+01 volume 19.26370 ppm1 4.365 ppm2 0.391 ASSI { 11272} (( segid "PROT" and resid 9 and name HB1 )) (( segid "PROT" and resid 14 and name HG )) 6 6 0 peak 11272 weight 0.1000E+01 volume 7.55920 ppm1 2.865 ppm2 1.393 ASSI { 11282} (( segid "PROT" and resid 14 and name HB1 )) (( segid "PROT" and resid 14 and name HG )) 6 6 0 peak 11282 weight 0.1000E+01 volume 15.57200 ppm1 1.657 ppm2 1.402 ASSI { 11292} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 11292 weight 0.1000E+01 volume 8.33390 ppm1 0.763 ppm2 4.189 ASSI { 11302} (( segid "PROT" and resid 18 and name HB1 )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 11302 weight 0.1000E+01 volume 8.63060 ppm1 1.311 ppm2 4.185 ASSI { 11312} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 11312 weight 0.1000E+01 volume 7.82080 ppm1 1.559 ppm2 4.191 ASSI { 11322} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 11322 weight 0.1000E+01 volume 11.04440 ppm1 4.188 ppm2 0.233 ASSI { 11332} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 11332 weight 0.1000E+01 volume 32.38300 ppm1 1.555 ppm2 0.233 ASSI { 11342} (( segid "PROT" and resid 77 and name HA )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 11342 weight 0.1000E+01 volume 3.05720 ppm1 3.383 ppm2 0.230 ASSI { 11352} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 11352 weight 0.1000E+01 volume 8.58300 ppm1 6.616 ppm2 0.235 ASSI { 11362} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 11362 weight 0.1000E+01 volume 7.89060 ppm1 6.725 ppm2 0.232 ASSI { 11372} (( segid "PROT" and resid 109 and name HZ )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 11372 weight 0.1000E+01 volume 2.26060 ppm1 6.833 ppm2 0.232 ASSI { 11382} (( segid "PROT" and resid 74 and name HA )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11382 weight 0.1000E+01 volume 4.99330 ppm1 3.781 ppm2 0.504 ASSI { 11392} (( segid "PROT" and resid 77 and name HB2 )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11392 weight 0.1000E+01 volume 14.19600 ppm1 1.783 ppm2 0.507 ASSI { 11402} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11402 weight 0.1000E+01 volume 14.65980 ppm1 1.554 ppm2 0.505 ASSI { 11412} (( segid "PROT" and resid 18 and name HB1 )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11412 weight 0.1000E+01 volume 15.34180 ppm1 1.366 ppm2 0.509 ASSI { 11422} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11422 weight 0.1000E+01 volume 7.87560 ppm1 1.104 ppm2 0.507 ASSI { 11432} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11432 weight 0.1000E+01 volume 22.01330 ppm1 0.886 ppm2 0.507 ASSI { 11442} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11442 weight 0.1000E+01 volume 32.40310 ppm1 0.774 ppm2 0.502 ASSI { 11452} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 18 and name HB1 )) 6 6 0 peak 11452 weight 0.1000E+01 volume 3.71450 ppm1 4.191 ppm2 1.375 ASSI { 11462} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 18 and name HB2 )) 6 6 0 peak 11462 weight 0.1000E+01 volume 4.68760 ppm1 4.188 ppm2 0.319 ASSI { 11472} (( segid "PROT" and resid 18 and name HB1 )) (( segid "PROT" and resid 18 and name HB2 )) 6 6 0 peak 11472 weight 0.1000E+01 volume 8.62620 ppm1 1.374 ppm2 0.321 ASSI { 11482} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 18 and name HB2 )) 6 6 0 peak 11482 weight 0.1000E+01 volume 3.47400 ppm1 1.554 ppm2 0.321 ASSI { 11492} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 18 and name HB2 )) 6 6 0 peak 11492 weight 0.1000E+01 volume 2.05300 ppm1 0.823 ppm2 0.316 ASSI { 11502} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 18 and name HB2 )) 6 6 0 peak 11502 weight 0.1000E+01 volume 2.28280 ppm1 0.739 ppm2 0.327 ASSI { 11512} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 18 and name HB2 )) 6 6 0 peak 11512 weight 0.1000E+01 volume 5.17460 ppm1 0.503 ppm2 0.325 ASSI { 11522} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 18 and name HB2 )) 6 6 0 peak 11522 weight 0.1000E+01 volume 3.30770 ppm1 0.232 ppm2 0.327 ASSI { 11532} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 18 and name HB1 )) 6 6 0 peak 11532 weight 0.1000E+01 volume 2.73480 ppm1 0.509 ppm2 1.359 ASSI { 11542} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 18 and name HB1 )) 6 6 0 peak 11542 weight 0.1000E+01 volume 3.12490 ppm1 0.738 ppm2 1.344 ASSI { 11552} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 18 and name HB1 )) 6 6 0 peak 11552 weight 0.1000E+01 volume 0.78740 ppm1 0.833 ppm2 1.352 ASSI { 11562} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 18 and name HB1 )) 6 6 0 peak 11562 weight 0.1000E+01 volume 2.97090 ppm1 1.560 ppm2 1.354 ASSI { 11572} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 18 and name HG )) 6 6 0 peak 11572 weight 0.1000E+01 volume 34.48490 ppm1 0.236 ppm2 1.552 ASSI { 11582} (( segid "PROT" and resid 18 and name HB2 )) (( segid "PROT" and resid 18 and name HG )) 6 6 0 peak 11582 weight 0.1000E+01 volume 7.11100 ppm1 0.350 ppm2 1.551 ASSI { 11592} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 18 and name HG )) 6 6 0 peak 11592 weight 0.1000E+01 volume 7.95320 ppm1 0.506 ppm2 1.551 ASSI { 11602} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 18 and name HG )) 6 6 0 peak 11602 weight 0.1000E+01 volume 10.77000 ppm1 1.365 ppm2 1.551 ASSI { 11612} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 18 and name HG )) 6 6 0 peak 11612 weight 0.1000E+01 volume 2.47760 ppm1 4.187 ppm2 1.544 ASSI { 11622} (( segid "PROT" and resid 18 and name HB1 )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 11622 weight 0.1000E+01 volume 47.89710 ppm1 1.394 ppm2 0.238 ASSI { 11632} (( segid "PROT" and resid 18 and name HB2 )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 11632 weight 0.1000E+01 volume 31.03050 ppm1 0.345 ppm2 0.507 ASSI { 11642} (( segid "PROT" and resid 25 and name HB2 )) (( segid "PROT" and resid 25 and name HA )) 6 6 0 peak 11642 weight 0.1000E+01 volume 6.26170 ppm1 1.090 ppm2 4.112 ASSI { 11652} (( segid "PROT" and resid 109 and name HB1 )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11652 weight 0.1000E+01 volume 13.93440 ppm1 3.337 ppm2 0.893 ASSI { 11662} (( segid "PROT" and resid 109 and name HB2 )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11662 weight 0.1000E+01 volume 10.73750 ppm1 3.061 ppm2 0.894 ASSI { 11672} (( segid "PROT" and resid 108 and name HB )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11672 weight 0.1000E+01 volume 10.13860 ppm1 2.151 ppm2 0.904 ASSI { 11692} (( segid "PROT" and resid 105 and name HB2 )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11692 weight 0.1000E+01 volume 22.92060 ppm1 1.098 ppm2 0.897 ASSI { 11702} (( segid "PROT" and resid 105 and name HG )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11702 weight 0.1000E+01 volume 10.42760 ppm1 1.650 ppm2 0.890 ASSI { 11712} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11712 weight 0.1000E+01 volume 24.63370 ppm1 0.566 ppm2 0.896 ASSI { 11722} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11722 weight 0.1000E+01 volume 8.07420 ppm1 0.395 ppm2 0.889 ASSI { 11732} (( segid "PROT" and resid 22 and name HA )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 11732 weight 0.1000E+01 volume 2.01870 ppm1 4.316 ppm2 0.909 ASSI { 11742} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 11742 weight 0.1000E+01 volume 3.99750 ppm1 4.105 ppm2 0.667 ASSI { 11752} (( segid "PROT" and resid 25 and name HB1 )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 11752 weight 0.1000E+01 volume 24.81190 ppm1 2.300 ppm2 0.668 ASSI { 11762} (( segid "PROT" and resid 25 and name HG )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 11762 weight 0.1000E+01 volume 20.59750 ppm1 2.379 ppm2 0.668 ASSI { 11772} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 11772 weight 0.1000E+01 volume 5.41530 ppm1 -0.255 ppm2 0.659 ASSI { 11782} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 11782 weight 0.1000E+01 volume 35.35590 ppm1 0.896 ppm2 0.676 ASSI { 11792} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 11792 weight 0.1000E+01 volume 11.76800 ppm1 1.198 ppm2 0.672 ASSI { 11802} (( segid "PROT" and resid 25 and name HB2 )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 11802 weight 0.1000E+01 volume 25.14610 ppm1 1.096 ppm2 0.668 ASSI { 11812} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 25 and name HB1 )) 6 6 0 peak 11812 weight 0.1000E+01 volume 3.83830 ppm1 0.673 ppm2 2.301 ASSI { 11822} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 25 and name HB1 )) 6 6 0 peak 11822 weight 0.1000E+01 volume 4.70050 ppm1 0.899 ppm2 2.291 ASSI { 11832} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 25 and name HB2 )) 6 6 0 peak 11832 weight 0.1000E+01 volume 4.32150 ppm1 0.670 ppm2 1.090 ASSI { 11842} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 25 and name HB2 )) 6 6 0 peak 11842 weight 0.1000E+01 volume 5.25390 ppm1 0.900 ppm2 1.093 ASSI { 11852} (( segid "PROT" and resid 25 and name HB1 )) (( segid "PROT" and resid 25 and name HB2 )) 6 6 0 peak 11852 weight 0.1000E+01 volume 5.16370 ppm1 2.294 ppm2 1.087 ASSI { 11872} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 25 and name HB2 )) 6 6 0 peak 11872 weight 0.1000E+01 volume 3.06580 ppm1 4.103 ppm2 1.087 ASSI { 11882} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 25 and name HB1 )) 6 6 0 peak 11882 weight 0.1000E+01 volume 0.70470 ppm1 4.092 ppm2 2.295 ASSI { 11892} (( segid "PROT" and resid 25 and name HB2 )) (( segid "PROT" and resid 25 and name HB1 )) 6 6 0 peak 11892 weight 0.1000E+01 volume 15.86720 ppm1 1.094 ppm2 2.297 ASSI { 11902} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 25 and name HG )) 6 6 0 peak 11902 weight 0.1000E+01 volume 3.85910 ppm1 0.571 ppm2 2.374 ASSI { 11912} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 25 and name HG )) 6 6 0 peak 11912 weight 0.1000E+01 volume 17.65510 ppm1 0.674 ppm2 2.376 ASSI { 11922} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 25 and name HG )) 6 6 0 peak 11922 weight 0.1000E+01 volume 19.85850 ppm1 0.897 ppm2 2.376 ASSI { 11932} (( segid "PROT" and resid 25 and name HB2 )) (( segid "PROT" and resid 25 and name HG )) 6 6 0 peak 11932 weight 0.1000E+01 volume 6.42810 ppm1 1.096 ppm2 2.374 ASSI { 11942} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 25 and name HG )) 6 6 0 peak 11942 weight 0.1000E+01 volume 2.34340 ppm1 4.099 ppm2 2.378 ASSI { 11952} (( segid "PROT" and resid 22 and name HA )) (( segid "PROT" and resid 25 and name HG )) 6 6 0 peak 11952 weight 0.1000E+01 volume 1.79110 ppm1 4.318 ppm2 2.376 ASSI { 11962} (( segid "PROT" and resid 33 and name HA )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 11962 weight 0.1000E+01 volume 28.85920 ppm1 3.912 ppm2 0.827 ASSI { 11972} (( segid "PROT" and resid 36 and name HD1 )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 11972 weight 0.1000E+01 volume 15.39880 ppm1 3.204 ppm2 0.824 ASSI { 11982} (( segid "PROT" and resid 36 and name HD2 )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 11982 weight 0.1000E+01 volume 17.99970 ppm1 3.050 ppm2 0.828 ASSI { 11992} (( segid "PROT" and resid 33 and name HB2 )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 11992 weight 0.1000E+01 volume 28.27970 ppm1 1.598 ppm2 0.821 ASSI { 12002} (( segid "PROT" and resid 33 and name HG )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 12002 weight 0.1000E+01 volume 48.11690 ppm1 1.685 ppm2 0.824 ASSI { 12012} (( segid "PROT" and resid 33 and name HB1 )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 12012 weight 0.1000E+01 volume 17.59350 ppm1 2.100 ppm2 0.822 ASSI { 12022} (( segid "PROT" and resid 33 and name HD1# )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 12022 weight 0.1000E+01 volume 17.43470 ppm1 0.967 ppm2 0.826 ASSI { 12032} (( segid "PROT" and resid 33 and name HA )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 12032 weight 0.1000E+01 volume 13.16650 ppm1 3.911 ppm2 0.966 ASSI { 12042} (( segid "PROT" and resid 34 and name HD1 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 12042 weight 0.1000E+01 volume 7.53580 ppm1 3.840 ppm2 0.961 ASSI { 12052} (( segid "PROT" and resid 33 and name HB1 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 12052 weight 0.1000E+01 volume 33.31500 ppm1 2.104 ppm2 0.965 ASSI { 12062} (( segid "PROT" and resid 33 and name HG )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 12062 weight 0.1000E+01 volume 34.68080 ppm1 1.684 ppm2 0.966 ASSI { 12072} (( segid "PROT" and resid 33 and name HB2 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 12072 weight 0.1000E+01 volume 53.73690 ppm1 1.598 ppm2 0.961 ASSI { 12082} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 12082 weight 0.1000E+01 volume 31.92520 ppm1 0.826 ppm2 0.966 ASSI { 12092} (( segid "PROT" and resid 34 and name HD1 )) (( segid "PROT" and resid 33 and name HB1 )) 6 6 0 peak 12092 weight 0.1000E+01 volume 5.47160 ppm1 3.831 ppm2 2.088 ASSI { 12102} (( segid "PROT" and resid 33 and name HA )) (( segid "PROT" and resid 33 and name HB1 )) 6 6 0 peak 12102 weight 0.1000E+01 volume 2.98460 ppm1 3.912 ppm2 2.087 ASSI { 12112} (( segid "PROT" and resid 33 and name HD1# )) (( segid "PROT" and resid 33 and name HB1 )) 6 6 0 peak 12112 weight 0.1000E+01 volume 4.99920 ppm1 0.968 ppm2 2.093 ASSI { 12122} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 33 and name HB1 )) 6 6 0 peak 12122 weight 0.1000E+01 volume 4.81370 ppm1 0.828 ppm2 2.091 ASSI { 12132} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 33 and name HB2 )) 6 6 0 peak 12132 weight 0.1000E+01 volume 12.03680 ppm1 0.824 ppm2 1.594 ASSI { 12142} (( segid "PROT" and resid 33 and name HD1# )) (( segid "PROT" and resid 33 and name HB2 )) 6 6 0 peak 12142 weight 0.1000E+01 volume 9.04400 ppm1 0.967 ppm2 1.592 ASSI { 12152} (( segid "PROT" and resid 33 and name HB2 )) (( segid "PROT" and resid 33 and name HB1 )) 6 6 0 peak 12152 weight 0.1000E+01 volume 8.17240 ppm1 1.594 ppm2 2.093 ASSI { 12162} (( segid "PROT" and resid 33 and name HB1 )) (( segid "PROT" and resid 33 and name HB2 )) 6 6 0 peak 12162 weight 0.1000E+01 volume 24.81240 ppm1 2.098 ppm2 1.596 ASSI { 12172} (( segid "PROT" and resid 33 and name HG )) (( segid "PROT" and resid 33 and name HB1 )) 6 6 0 peak 12172 weight 0.1000E+01 volume 11.83640 ppm1 1.678 ppm2 2.091 ASSI { 12182} (( segid "PROT" and resid 33 and name HA )) (( segid "PROT" and resid 33 and name HG )) 6 6 0 peak 12182 weight 0.1000E+01 volume 11.55570 ppm1 3.914 ppm2 1.684 ASSI { 12192} (( segid "PROT" and resid 30 and name HA )) (( segid "PROT" and resid 33 and name HG )) 6 6 0 peak 12192 weight 0.1000E+01 volume 6.72180 ppm1 5.037 ppm2 1.686 ASSI { 12202} (( segid "PROT" and resid 33 and name HD1# )) (( segid "PROT" and resid 33 and name HG )) 6 6 0 peak 12202 weight 0.1000E+01 volume 17.49130 ppm1 0.964 ppm2 1.687 ASSI { 12212} (( segid "PROT" and resid 33 and name HB2 )) (( segid "PROT" and resid 33 and name HG )) 6 6 0 peak 12212 weight 0.1000E+01 volume 55.26750 ppm1 1.550 ppm2 1.692 ASSI { 12222} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 33 and name HG )) 6 6 0 peak 12222 weight 0.1000E+01 volume 12.65270 ppm1 0.829 ppm2 1.681 ASSI { 12232} (( segid "PROT" and resid 30 and name HA )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 12232 weight 0.1000E+01 volume 7.70890 ppm1 5.035 ppm2 0.827 ASSI { 12242} (( segid "PROT" and resid 29 and name HA )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 12242 weight 0.1000E+01 volume 7.52540 ppm1 4.723 ppm2 0.827 ASSI { 12252} (( segid "PROT" and resid 30 and name HA )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 12252 weight 0.1000E+01 volume 27.80920 ppm1 5.042 ppm2 0.964 ASSI { 12262} (( segid "PROT" and resid 29 and name HA )) (( segid "PROT" and resid 33 and name HG )) 6 6 0 peak 12262 weight 0.1000E+01 volume 2.14240 ppm1 4.733 ppm2 1.667 ASSI { 12272} (( segid "PROT" and resid 33 and name HB1 )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12272 weight 0.1000E+01 volume 11.32350 ppm1 2.108 ppm2 3.911 ASSI { 12282} (( segid "PROT" and resid 33 and name HG )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12282 weight 0.1000E+01 volume 4.42970 ppm1 1.689 ppm2 3.913 ASSI { 12292} (( segid "PROT" and resid 33 and name HB2 )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12292 weight 0.1000E+01 volume 8.30920 ppm1 1.598 ppm2 3.915 ASSI { 12302} (( segid "PROT" and resid 36 and name HG2 )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12302 weight 0.1000E+01 volume 2.50260 ppm1 1.331 ppm2 3.913 ASSI { 12312} (( segid "PROT" and resid 33 and name HD1# )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12312 weight 0.1000E+01 volume 5.29670 ppm1 0.966 ppm2 3.906 ASSI { 12322} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12322 weight 0.1000E+01 volume 14.74830 ppm1 0.825 ppm2 3.915 ASSI { 12332} (( segid "PROT" and resid 36 and name HB1 )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12332 weight 0.1000E+01 volume 1.67030 ppm1 2.169 ppm2 3.912 ASSI { 12342} (( segid "PROT" and resid 36 and name HD2 )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12342 weight 0.1000E+01 volume 6.13210 ppm1 3.052 ppm2 3.916 ASSI { 12352} (( segid "PROT" and resid 36 and name HD1 )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 12352 weight 0.1000E+01 volume 3.52530 ppm1 3.204 ppm2 3.906 ASSI { 12362} (( segid "PROT" and resid 43 and name HD2# )) (( segid "PROT" and resid 43 and name HA )) 6 6 0 peak 12362 weight 0.1000E+01 volume 45.58830 ppm1 0.862 ppm2 4.014 ASSI { 12372} (( segid "PROT" and resid 43 and name HG )) (( segid "PROT" and resid 43 and name HA )) 6 6 0 peak 12372 weight 0.1000E+01 volume 31.38520 ppm1 1.527 ppm2 4.005 ASSI { 12382} (( segid "PROT" and resid 43 and name HB1 )) (( segid "PROT" and resid 43 and name HA )) 6 6 0 peak 12382 weight 0.1000E+01 volume 3.78170 ppm1 1.576 ppm2 4.005 ASSI { 12392} (( segid "PROT" and resid 43 and name HA )) (( segid "PROT" and resid 43 and name HD1# )) 6 6 0 peak 12392 weight 0.1000E+01 volume 50.23500 ppm1 4.013 ppm2 0.862 ASSI { 12402} (( segid "PROT" and resid 43 and name HG )) (( segid "PROT" and resid 43 and name HD2# )) 6 6 0 peak 12402 weight 0.1000E+01 volume 26.92420 ppm1 1.497 ppm2 0.861 ASSI { 12412} (( segid "PROT" and resid 43 and name HD2# )) (( segid "PROT" and resid 43 and name HB1 )) 6 6 0 peak 12412 weight 0.1000E+01 volume 90.91870 ppm1 0.850 ppm2 1.556 ASSI { 12422} (( segid "PROT" and resid 43 and name HA )) (( segid "PROT" and resid 43 and name HB1 )) 6 6 0 peak 12422 weight 0.1000E+01 volume 49.47570 ppm1 4.011 ppm2 1.556 ASSI { 12432} (( segid "PROT" and resid 40 and name HB1 )) (( segid "PROT" and resid 43 and name HB1 )) 6 6 0 peak 12432 weight 0.1000E+01 volume 27.70100 ppm1 2.928 ppm2 1.560 ASSI { 12442} (( segid "PROT" and resid 40 and name HB2 )) (( segid "PROT" and resid 43 and name HB1 )) 6 6 0 peak 12442 weight 0.1000E+01 volume 32.17910 ppm1 2.385 ppm2 1.558 ASSI { 12452} (( segid "PROT" and resid 43 and name HA )) (( segid "PROT" and resid 43 and name HG )) 6 6 0 peak 12452 weight 0.1000E+01 volume 21.72600 ppm1 4.011 ppm2 1.495 ASSI { 12462} (( segid "PROT" and resid 90 and name HA )) (( segid "PROT" and resid 90 and name HG )) 6 6 0 peak 12462 weight 0.1000E+01 volume 9.17600 ppm1 4.453 ppm2 1.414 ASSI { 12472} (( segid "PROT" and resid 40 and name HB1 )) (( segid "PROT" and resid 43 and name HD1# )) 6 6 0 peak 12472 weight 0.1000E+01 volume 20.06250 ppm1 2.932 ppm2 0.851 ASSI { 12482} (( segid "PROT" and resid 40 and name HB2 )) (( segid "PROT" and resid 43 and name HD1# )) 6 6 0 peak 12482 weight 0.1000E+01 volume 23.08790 ppm1 2.382 ppm2 0.860 ASSI { 12492} (( segid "PROT" and resid 43 and name HG )) (( segid "PROT" and resid 43 and name HD1# )) 6 6 0 peak 12492 weight 0.1000E+01 volume 104.07340 ppm1 1.498 ppm2 0.853 ASSI { 12502} (( segid "PROT" and resid 43 and name HB1 )) (( segid "PROT" and resid 43 and name HD1# )) 6 6 0 peak 12502 weight 0.1000E+01 volume 32.65640 ppm1 1.576 ppm2 0.853 ASSI { 12512} (( segid "PROT" and resid 43 and name HA )) (( segid "PROT" and resid 43 and name HD2# )) 6 6 0 peak 12512 weight 0.1000E+01 volume 18.03280 ppm1 4.021 ppm2 0.878 ASSI { 12522} (( segid "PROT" and resid 44 and name HD2# )) (( segid "PROT" and resid 44 and name HA )) 6 6 0 peak 12522 weight 0.1000E+01 volume 17.86280 ppm1 0.828 ppm2 4.188 ASSI { 12532} (( segid "PROT" and resid 44 and name HB2 )) (( segid "PROT" and resid 44 and name HA )) 6 6 0 peak 12532 weight 0.1000E+01 volume 7.86890 ppm1 1.360 ppm2 4.192 ASSI { 12542} (( segid "PROT" and resid 44 and name HB1 )) (( segid "PROT" and resid 44 and name HA )) 6 6 0 peak 12542 weight 0.1000E+01 volume 7.16820 ppm1 1.439 ppm2 4.192 ASSI { 12552} (( segid "PROT" and resid 44 and name HA )) (( segid "PROT" and resid 44 and name HD2# )) 6 6 0 peak 12552 weight 0.1000E+01 volume 32.66270 ppm1 4.194 ppm2 0.826 ASSI { 12562} (( segid "PROT" and resid 44 and name HG )) (( segid "PROT" and resid 44 and name HD2# )) 6 6 0 peak 12562 weight 0.1000E+01 volume 59.73500 ppm1 1.693 ppm2 0.821 ASSI { 12572} (( segid "PROT" and resid 44 and name HB1 )) (( segid "PROT" and resid 44 and name HD2# )) 6 6 0 peak 12572 weight 0.1000E+01 volume 9.84360 ppm1 1.459 ppm2 0.823 ASSI { 12582} (( segid "PROT" and resid 44 and name HA )) (( segid "PROT" and resid 44 and name HD1# )) 6 6 0 peak 12582 weight 0.1000E+01 volume 6.99710 ppm1 4.193 ppm2 0.744 ASSI { 12592} (( segid "PROT" and resid 39 and name HA )) (( segid "PROT" and resid 44 and name HD1# )) 6 6 0 peak 12592 weight 0.1000E+01 volume 19.99740 ppm1 3.208 ppm2 0.746 ASSI { 12602} (( segid "PROT" and resid 44 and name HB1 )) (( segid "PROT" and resid 44 and name HD1# )) 6 6 0 peak 12602 weight 0.1000E+01 volume 14.62430 ppm1 1.445 ppm2 0.744 ASSI { 12612} (( segid "PROT" and resid 44 and name HG )) (( segid "PROT" and resid 44 and name HD1# )) 6 6 0 peak 12612 weight 0.1000E+01 volume 24.32120 ppm1 1.695 ppm2 0.743 ASSI { 12622} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 44 and name HD1# )) 6 6 0 peak 12622 weight 0.1000E+01 volume 33.89110 ppm1 -0.371 ppm2 0.747 ASSI { 12632} (( segid "PROT" and resid 44 and name HA )) (( segid "PROT" and resid 44 and name HB1 )) 6 6 0 peak 12632 weight 0.1000E+01 volume 8.77650 ppm1 4.193 ppm2 1.419 ASSI { 12642} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 44 and name HB2 )) 6 6 0 peak 12642 weight 0.1000E+01 volume 1.33320 ppm1 3.619 ppm2 1.393 ASSI { 12652} (( segid "PROT" and resid 44 and name HG )) (( segid "PROT" and resid 44 and name HB1 )) 6 6 0 peak 12652 weight 0.1000E+01 volume 7.95910 ppm1 1.696 ppm2 1.391 ASSI { 12662} (( segid "PROT" and resid 44 and name HD1# )) (( segid "PROT" and resid 44 and name HB2 )) 6 6 0 peak 12662 weight 0.1000E+01 volume 12.87660 ppm1 0.749 ppm2 1.400 ASSI { 12672} (( segid "PROT" and resid 44 and name HD2# )) (( segid "PROT" and resid 44 and name HB1 )) 6 6 0 peak 12672 weight 0.1000E+01 volume 7.82000 ppm1 0.825 ppm2 1.405 ASSI { 12682} (( segid "PROT" and resid 44 and name HA )) (( segid "PROT" and resid 44 and name HG )) 6 6 0 peak 12682 weight 0.1000E+01 volume 17.80100 ppm1 4.182 ppm2 1.684 ASSI { 12692} (( segid "PROT" and resid 59 and name HB1 )) (( segid "PROT" and resid 36 and name HA )) 6 6 0 peak 12692 weight 0.1000E+01 volume 5.32400 ppm1 1.728 ppm2 3.945 ASSI { 12702} (( segid "PROT" and resid 36 and name HB2 )) (( segid "PROT" and resid 36 and name HA )) 6 6 0 peak 12702 weight 0.1000E+01 volume 3.39620 ppm1 1.901 ppm2 3.948 ASSI { 12712} (( segid "PROT" and resid 59 and name HB2 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12712 weight 0.1000E+01 volume 61.29840 ppm1 1.361 ppm2 0.230 ASSI { 12722} (( segid "PROT" and resid 59 and name HG )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12722 weight 0.1000E+01 volume 28.19830 ppm1 1.553 ppm2 0.228 ASSI { 12732} (( segid "PROT" and resid 59 and name HB1 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12732 weight 0.1000E+01 volume 12.55310 ppm1 1.769 ppm2 0.232 ASSI { 12742} (( segid "PROT" and resid 36 and name HG1 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12742 weight 0.1000E+01 volume 6.85440 ppm1 2.174 ppm2 0.230 ASSI { 12752} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12752 weight 0.1000E+01 volume 6.95000 ppm1 3.781 ppm2 0.234 ASSI { 12762} (( segid "PROT" and resid 35 and name HB1 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12762 weight 0.1000E+01 volume 6.14480 ppm1 3.837 ppm2 0.232 ASSI { 12772} (( segid "PROT" and resid 32 and name HB2 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12772 weight 0.1000E+01 volume 32.69610 ppm1 3.705 ppm2 0.230 ASSI { 12782} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12782 weight 0.1000E+01 volume 2.87240 ppm1 7.373 ppm2 0.230 ASSI { 12792} (( segid "PROT" and resid 26 and name HD1 )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12792 weight 0.1000E+01 volume 1.52220 ppm1 6.925 ppm2 0.582 ASSI { 12802} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12802 weight 0.1000E+01 volume 7.49220 ppm1 3.935 ppm2 0.578 ASSI { 12812} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12812 weight 0.1000E+01 volume 14.92300 ppm1 3.836 ppm2 0.580 ASSI { 12822} (( segid "PROT" and resid 59 and name HB2 )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12822 weight 0.1000E+01 volume 8.24830 ppm1 1.357 ppm2 0.580 ASSI { 12832} (( segid "PROT" and resid 59 and name HG )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12832 weight 0.1000E+01 volume 13.32490 ppm1 1.553 ppm2 0.584 ASSI { 12842} (( segid "PROT" and resid 59 and name HB1 )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12842 weight 0.1000E+01 volume 19.51880 ppm1 1.708 ppm2 0.582 ASSI { 12852} (( segid "PROT" and resid 22 and name HG )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12852 weight 0.1000E+01 volume 4.43150 ppm1 1.875 ppm2 0.591 ASSI { 12862} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12862 weight 0.1000E+01 volume 24.21850 ppm1 1.196 ppm2 0.580 ASSI { 12872} (( segid "PROT" and resid 22 and name HD1# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12872 weight 0.1000E+01 volume 39.29180 ppm1 1.096 ppm2 0.578 ASSI { 12882} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 12882 weight 0.1000E+01 volume 22.37790 ppm1 0.673 ppm2 0.577 ASSI { 12892} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 59 and name HB2 )) 6 6 0 peak 12892 weight 0.1000E+01 volume 1.64110 ppm1 3.947 ppm2 1.354 ASSI { 12902} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 59 and name HB2 )) 6 6 0 peak 12902 weight 0.1000E+01 volume 2.42040 ppm1 3.843 ppm2 1.354 ASSI { 12912} (( segid "PROT" and resid 59 and name HB1 )) (( segid "PROT" and resid 59 and name HB2 )) 6 6 0 peak 12912 weight 0.1000E+01 volume 3.13920 ppm1 1.721 ppm2 1.359 ASSI { 12922} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 59 and name HB2 )) 6 6 0 peak 12922 weight 0.1000E+01 volume 3.22510 ppm1 0.573 ppm2 1.360 ASSI { 12932} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 59 and name HB2 )) 6 6 0 peak 12932 weight 0.1000E+01 volume 1.85990 ppm1 6.604 ppm2 1.361 ASSI { 12942} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 59 and name HG )) 6 6 0 peak 12942 weight 0.1000E+01 volume 29.52920 ppm1 0.237 ppm2 1.552 ASSI { 12952} (( segid "PROT" and resid 59 and name HG )) (( segid "PROT" and resid 36 and name HA )) 6 6 0 peak 12952 weight 0.1000E+01 volume 1.22280 ppm1 1.560 ppm2 3.949 ASSI { 12962} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12962 weight 0.1000E+01 volume 6.25130 ppm1 0.668 ppm2 0.228 ASSI { 12972} (( segid "PROT" and resid 35 and name HB2 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 12972 weight 0.1000E+01 volume 17.53280 ppm1 2.636 ppm2 0.234 ASSI { 12982} (( segid "PROT" and resid 66 and name HB2 )) (( segid "PROT" and resid 66 and name HA )) 6 6 0 peak 12982 weight 0.1000E+01 volume 10.52490 ppm1 1.750 ppm2 4.354 ASSI { 12992} (( segid "PROT" and resid 66 and name HA )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 12992 weight 0.1000E+01 volume 16.98060 ppm1 4.356 ppm2 0.829 ASSI { 13002} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13002 weight 0.1000E+01 volume 29.19930 ppm1 3.669 ppm2 0.827 ASSI { 13012} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13012 weight 0.1000E+01 volume 3.11130 ppm1 4.198 ppm2 0.831 ASSI { 13022} (( segid "PROT" and resid 66 and name HB1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13022 weight 0.1000E+01 volume 17.61510 ppm1 1.930 ppm2 0.829 ASSI { 13032} (( segid "PROT" and resid 19 and name HE# )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13032 weight 0.1000E+01 volume 8.22800 ppm1 2.042 ppm2 0.832 ASSI { 13042} (( segid "PROT" and resid 15 and name HG1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13042 weight 0.1000E+01 volume 14.14770 ppm1 1.552 ppm2 0.829 ASSI { 13052} (( segid "PROT" and resid 18 and name HB1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13052 weight 0.1000E+01 volume 9.25940 ppm1 1.377 ppm2 0.831 ASSI { 13072} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13072 weight 0.1000E+01 volume 7.95760 ppm1 2.218 ppm2 0.734 ASSI { 13082} (( segid "PROT" and resid 19 and name HE# )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13082 weight 0.1000E+01 volume 8.87280 ppm1 2.041 ppm2 0.734 ASSI { 13092} (( segid "PROT" and resid 66 and name HB1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13092 weight 0.1000E+01 volume 36.63490 ppm1 1.934 ppm2 0.736 ASSI { 13102} (( segid "PROT" and resid 62 and name HG11 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13102 weight 0.1000E+01 volume 22.69490 ppm1 1.863 ppm2 0.732 ASSI { 13112} (( segid "PROT" and resid 66 and name HG )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13112 weight 0.1000E+01 volume 51.45860 ppm1 1.749 ppm2 0.736 ASSI { 13122} (( segid "PROT" and resid 15 and name HG1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13122 weight 0.1000E+01 volume 18.07210 ppm1 1.552 ppm2 0.736 ASSI { 13132} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13132 weight 0.1000E+01 volume 12.17520 ppm1 0.235 ppm2 0.740 ASSI { 13142} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13142 weight 0.1000E+01 volume 21.38880 ppm1 3.668 ppm2 0.736 ASSI { 13152} (( segid "PROT" and resid 18 and name HA )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13152 weight 0.1000E+01 volume 8.20130 ppm1 4.191 ppm2 0.736 ASSI { 13162} (( segid "PROT" and resid 66 and name HA )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13162 weight 0.1000E+01 volume 9.14160 ppm1 4.355 ppm2 0.734 ASSI { 13172} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13172 weight 0.1000E+01 volume 18.09550 ppm1 6.614 ppm2 0.738 ASSI { 13182} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13182 weight 0.1000E+01 volume 10.55090 ppm1 6.723 ppm2 0.735 ASSI { 13192} (( segid "PROT" and resid 71 and name HD1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 13192 weight 0.1000E+01 volume 6.90750 ppm1 6.840 ppm2 0.733 ASSI { 13202} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13202 weight 0.1000E+01 volume 12.18610 ppm1 6.739 ppm2 0.837 ASSI { 13212} (( segid "PROT" and resid 71 and name HD1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 13212 weight 0.1000E+01 volume 4.43960 ppm1 6.835 ppm2 0.828 ASSI { 13222} (( segid "PROT" and resid 65 and name HZ2 )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 13222 weight 0.1000E+01 volume 3.34750 ppm1 6.778 ppm2 1.938 ASSI { 13232} (( segid "PROT" and resid 71 and name HD1 )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 13232 weight 0.1000E+01 volume 0.75830 ppm1 6.855 ppm2 1.936 ASSI { 13242} (( segid "PROT" and resid 71 and name HD1 )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 13242 weight 0.1000E+01 volume 2.51370 ppm1 6.855 ppm2 1.758 ASSI { 13252} (( segid "PROT" and resid 66 and name HA )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 13252 weight 0.1000E+01 volume 9.26530 ppm1 4.354 ppm2 1.938 ASSI { 13262} (( segid "PROT" and resid 66 and name HA )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 13262 weight 0.1000E+01 volume 20.38860 ppm1 4.352 ppm2 1.760 ASSI { 13272} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 13272 weight 0.1000E+01 volume 6.25660 ppm1 3.689 ppm2 1.749 ASSI { 13282} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 13282 weight 0.1000E+01 volume 2.97100 ppm1 3.694 ppm2 1.933 ASSI { 13292} (( segid "PROT" and resid 66 and name HB1 )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 13292 weight 0.1000E+01 volume 22.98090 ppm1 1.937 ppm2 1.754 ASSI { 13302} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 13302 weight 0.1000E+01 volume 12.10490 ppm1 0.738 ppm2 1.754 ASSI { 13312} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 13312 weight 0.1000E+01 volume 7.92730 ppm1 0.838 ppm2 1.753 ASSI { 13322} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 66 and name HG )) 6 6 0 peak 13322 weight 0.1000E+01 volume 18.20710 ppm1 0.833 ppm2 1.729 ASSI { 13332} (( segid "PROT" and resid 66 and name HA )) (( segid "PROT" and resid 66 and name HG )) 6 6 0 peak 13332 weight 0.1000E+01 volume 4.49140 ppm1 4.352 ppm2 1.733 ASSI { 13342} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 66 and name HG )) 6 6 0 peak 13342 weight 0.1000E+01 volume 3.18940 ppm1 3.667 ppm2 1.734 ASSI { 13352} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 83 and name HA )) 6 6 0 peak 13352 weight 0.1000E+01 volume 4.68180 ppm1 0.888 ppm2 4.238 ASSI { 13362} (( segid "PROT" and resid 104 and name HG2 )) (( segid "PROT" and resid 104 and name HA )) 6 6 0 peak 13362 weight 0.1000E+01 volume 4.53360 ppm1 1.236 ppm2 4.246 ASSI { 13372} (( segid "PROT" and resid 104 and name HG1 )) (( segid "PROT" and resid 104 and name HA )) 6 6 0 peak 13372 weight 0.1000E+01 volume 4.40390 ppm1 1.479 ppm2 4.235 ASSI { 13382} (( segid "PROT" and resid 83 and name HB2 )) (( segid "PROT" and resid 83 and name HA )) 6 6 0 peak 13382 weight 0.1000E+01 volume 9.36610 ppm1 1.632 ppm2 4.233 ASSI { 13392} (( segid "PROT" and resid 104 and name HD1 )) (( segid "PROT" and resid 104 and name HA )) 6 6 0 peak 13392 weight 0.1000E+01 volume 5.87930 ppm1 1.799 ppm2 4.241 ASSI { 13402} (( segid "PROT" and resid 104 and name HB1 )) (( segid "PROT" and resid 104 and name HA )) 6 6 0 peak 13402 weight 0.1000E+01 volume 10.28060 ppm1 2.007 ppm2 4.241 ASSI { 13412} (( segid "PROT" and resid 83 and name HB1 )) (( segid "PROT" and resid 83 and name HA )) 6 6 0 peak 13412 weight 0.1000E+01 volume 8.69080 ppm1 2.202 ppm2 4.226 ASSI { 13422} (( segid "PROT" and resid 86 and name HB2 )) (( segid "PROT" and resid 83 and name HA )) 6 6 0 peak 13422 weight 0.1000E+01 volume 3.84250 ppm1 2.890 ppm2 4.235 ASSI { 13432} (( segid "PROT" and resid 7 and name HA )) (( segid "PROT" and resid 7 and name HD1 )) 6 6 0 peak 13432 weight 0.1000E+01 volume 15.80890 ppm1 4.238 ppm2 1.503 ASSI { 13442} (( segid "PROT" and resid 83 and name HA )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13442 weight 0.1000E+01 volume 8.81140 ppm1 4.232 ppm2 0.884 ASSI { 13452} (( segid "PROT" and resid 7 and name HA )) (( segid "PROT" and resid 7 and name HG1 )) 6 6 0 peak 13452 weight 0.1000E+01 volume 21.04980 ppm1 4.238 ppm2 1.095 ASSI { 13462} (( segid "PROT" and resid 83 and name HB1 )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13462 weight 0.1000E+01 volume 18.57380 ppm1 2.172 ppm2 0.882 ASSI { 13472} (( segid "PROT" and resid 57 and name HE# )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13472 weight 0.1000E+01 volume 37.29360 ppm1 1.989 ppm2 0.884 ASSI { 13482} (( segid "PROT" and resid 83 and name HB2 )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13482 weight 0.1000E+01 volume 15.89530 ppm1 1.644 ppm2 0.884 ASSI { 13492} (( segid "PROT" and resid 83 and name HG )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13492 weight 0.1000E+01 volume 56.47270 ppm1 1.411 ppm2 0.890 ASSI { 13502} (( segid "PROT" and resid 57 and name HB2 )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13502 weight 0.1000E+01 volume 11.71130 ppm1 1.248 ppm2 0.889 ASSI { 13512} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13512 weight 0.1000E+01 volume 21.60150 ppm1 1.107 ppm2 0.888 ASSI { 13522} (( segid "PROT" and resid 83 and name HA )) (( segid "PROT" and resid 83 and name HB1 )) 6 6 0 peak 13522 weight 0.1000E+01 volume 2.42090 ppm1 4.238 ppm2 2.174 ASSI { 13532} (( segid "PROT" and resid 83 and name HA )) (( segid "PROT" and resid 83 and name HB2 )) 6 6 0 peak 13532 weight 0.1000E+01 volume 2.94750 ppm1 4.232 ppm2 1.648 ASSI { 13542} (( segid "PROT" and resid 80 and name HA )) (( segid "PROT" and resid 83 and name HB2 )) 6 6 0 peak 13542 weight 0.1000E+01 volume 3.02110 ppm1 4.560 ppm2 1.648 ASSI { 13552} (( segid "PROT" and resid 80 and name HA )) (( segid "PROT" and resid 83 and name HB1 )) 6 6 0 peak 13552 weight 0.1000E+01 volume 2.98680 ppm1 4.553 ppm2 2.166 ASSI { 13562} (( segid "PROT" and resid 83 and name HB2 )) (( segid "PROT" and resid 83 and name HB1 )) 6 6 0 peak 13562 weight 0.1000E+01 volume 5.76560 ppm1 1.638 ppm2 2.164 ASSI { 13572} (( segid "PROT" and resid 83 and name HB1 )) (( segid "PROT" and resid 83 and name HB2 )) 6 6 0 peak 13572 weight 0.1000E+01 volume 9.44150 ppm1 2.171 ppm2 1.641 ASSI { 13582} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 83 and name HB1 )) 6 6 0 peak 13582 weight 0.1000E+01 volume 6.30210 ppm1 0.885 ppm2 2.169 ASSI { 13592} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 83 and name HB1 )) 6 6 0 peak 13592 weight 0.1000E+01 volume 13.45990 ppm1 1.098 ppm2 2.196 ASSI { 13602} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 83 and name HB2 )) 6 6 0 peak 13602 weight 0.1000E+01 volume 5.88030 ppm1 0.875 ppm2 1.648 ASSI { 13612} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 83 and name HB2 )) 6 6 0 peak 13612 weight 0.1000E+01 volume 7.60670 ppm1 1.106 ppm2 1.656 ASSI { 13622} (( segid "PROT" and resid 80 and name HA )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 13622 weight 0.1000E+01 volume 12.77430 ppm1 4.549 ppm2 0.882 ASSI { 13632} (( segid "PROT" and resid 80 and name HA )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 13632 weight 0.1000E+01 volume 6.21320 ppm1 4.549 ppm2 1.108 ASSI { 13642} (( segid "PROT" and resid 83 and name HB1 )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 13642 weight 0.1000E+01 volume 13.57640 ppm1 2.173 ppm2 1.106 ASSI { 13652} (( segid "PROT" and resid 22 and name HB1 )) (( segid "PROT" and resid 22 and name HB2 )) 6 6 0 peak 13652 weight 0.1000E+01 volume 9.63170 ppm1 2.213 ppm2 2.067 ASSI { 13662} (( segid "PROT" and resid 83 and name HG )) (( segid "PROT" and resid 83 and name HB1 )) 6 6 0 peak 13662 weight 0.1000E+01 volume 2.98580 ppm1 1.413 ppm2 2.172 ASSI { 13672} (( segid "PROT" and resid 90 and name HD1# )) (( segid "PROT" and resid 90 and name HA )) 6 6 0 peak 13672 weight 0.1000E+01 volume 19.59060 ppm1 0.985 ppm2 4.444 ASSI { 13682} (( segid "PROT" and resid 90 and name HG )) (( segid "PROT" and resid 90 and name HA )) 6 6 0 peak 13682 weight 0.1000E+01 volume 3.20900 ppm1 1.416 ppm2 4.451 ASSI { 13692} (( segid "PROT" and resid 90 and name HB2 )) (( segid "PROT" and resid 90 and name HA )) 6 6 0 peak 13692 weight 0.1000E+01 volume 7.40100 ppm1 1.829 ppm2 4.456 ASSI { 13702} (( segid "PROT" and resid 90 and name HB1 )) (( segid "PROT" and resid 90 and name HA )) 6 6 0 peak 13702 weight 0.1000E+01 volume 3.81080 ppm1 2.141 ppm2 4.454 ASSI { 13712} (( segid "PROT" and resid 90 and name HD2# )) (( segid "PROT" and resid 90 and name HB1 )) 6 6 0 peak 13712 weight 0.1000E+01 volume 31.19410 ppm1 0.989 ppm2 2.125 ASSI { 13722} (( segid "PROT" and resid 90 and name HG )) (( segid "PROT" and resid 90 and name HB1 )) 6 6 0 peak 13722 weight 0.1000E+01 volume 5.08570 ppm1 1.416 ppm2 2.125 ASSI { 13732} (( segid "PROT" and resid 90 and name HG )) (( segid "PROT" and resid 90 and name HB2 )) 6 6 0 peak 13732 weight 0.1000E+01 volume 8.30170 ppm1 1.421 ppm2 1.808 ASSI { 13742} (( segid "PROT" and resid 90 and name HB2 )) (( segid "PROT" and resid 90 and name HB1 )) 6 6 0 peak 13742 weight 0.1000E+01 volume 7.51960 ppm1 1.828 ppm2 2.125 ASSI { 13752} (( segid "PROT" and resid 90 and name HB1 )) (( segid "PROT" and resid 90 and name HB2 )) 6 6 0 peak 13752 weight 0.1000E+01 volume 12.63620 ppm1 2.140 ppm2 1.833 ASSI { 13762} (( segid "PROT" and resid 90 and name HA )) (( segid "PROT" and resid 90 and name HB1 )) 6 6 0 peak 13762 weight 0.1000E+01 volume 13.91590 ppm1 4.455 ppm2 2.136 ASSI { 13772} (( segid "PROT" and resid 90 and name HA )) (( segid "PROT" and resid 90 and name HB2 )) 6 6 0 peak 13772 weight 0.1000E+01 volume 25.93930 ppm1 4.446 ppm2 1.817 ASSI { 13782} (( segid "PROT" and resid 90 and name HB1 )) (( segid "PROT" and resid 90 and name HG )) 6 6 0 peak 13782 weight 0.1000E+01 volume 10.53010 ppm1 2.138 ppm2 1.413 ASSI { 13792} (( segid "PROT" and resid 90 and name HB2 )) (( segid "PROT" and resid 90 and name HD2# )) 6 6 0 peak 13792 weight 0.1000E+01 volume 23.91330 ppm1 1.827 ppm2 0.984 ASSI { 13802} (( segid "PROT" and resid 90 and name HG )) (( segid "PROT" and resid 90 and name HD2# )) 6 6 0 peak 13802 weight 0.1000E+01 volume 31.20740 ppm1 1.416 ppm2 0.983 ASSI { 13812} (( segid "PROT" and resid 90 and name HA )) (( segid "PROT" and resid 90 and name HD2# )) 6 6 0 peak 13812 weight 0.1000E+01 volume 23.85900 ppm1 4.455 ppm2 0.986 ASSI { 13822} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 13822 weight 0.1000E+01 volume 7.14400 ppm1 4.422 ppm2 1.085 ASSI { 13832} (( segid "PROT" and resid 87 and name HA )) (( segid "PROT" and resid 90 and name HD1# )) 6 6 0 peak 13832 weight 0.1000E+01 volume 19.23800 ppm1 4.456 ppm2 0.989 ASSI { 13842} (( segid "PROT" and resid 91 and name HA )) (( segid "PROT" and resid 90 and name HD1# )) 6 6 0 peak 13842 weight 0.1000E+01 volume 4.21100 ppm1 4.005 ppm2 0.988 ASSI { 13852} (( segid "PROT" and resid 101 and name HZ )) (( segid "PROT" and resid 97 and name HG1 )) 6 6 0 peak 13852 weight 0.1000E+01 volume 1.33780 ppm1 7.143 ppm2 1.016 ASSI { 13862} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 97 and name HG1 )) 6 6 0 peak 13862 weight 0.1000E+01 volume 1.64950 ppm1 7.313 ppm2 1.010 ASSI { 13872} (( segid "PROT" and resid 53 and name HA )) (( segid "PROT" and resid 90 and name HD1# )) 6 6 0 peak 13872 weight 0.1000E+01 volume 6.92640 ppm1 3.536 ppm2 0.987 ASSI { 13882} (( segid "PROT" and resid 97 and name HD1 )) (( segid "PROT" and resid 97 and name HG1 )) 6 6 0 peak 13882 weight 0.1000E+01 volume 16.05010 ppm1 3.011 ppm2 1.016 ASSI { 13892} (( segid "PROT" and resid 90 and name HB1 )) (( segid "PROT" and resid 90 and name HD1# )) 6 6 0 peak 13892 weight 0.1000E+01 volume 10.46480 ppm1 2.139 ppm2 0.987 ASSI { 13902} (( segid "PROT" and resid 90 and name HB2 )) (( segid "PROT" and resid 90 and name HD1# )) 6 6 0 peak 13902 weight 0.1000E+01 volume 12.57830 ppm1 1.828 ppm2 0.989 ASSI { 13912} (( segid "PROT" and resid 90 and name HG )) (( segid "PROT" and resid 90 and name HD1# )) 6 6 0 peak 13912 weight 0.1000E+01 volume 31.92120 ppm1 1.418 ppm2 0.985 ASSI { 13922} (( segid "PROT" and resid 97 and name HB2 )) (( segid "PROT" and resid 97 and name HG1 )) 6 6 0 peak 13922 weight 0.1000E+01 volume 8.78210 ppm1 1.344 ppm2 1.015 ASSI { 13932} (( segid "PROT" and resid 97 and name HB1 )) (( segid "PROT" and resid 97 and name HG1 )) 6 6 0 peak 13932 weight 0.1000E+01 volume 12.65540 ppm1 1.604 ppm2 1.018 ASSI { 13942} (( segid "PROT" and resid 97 and name HG2 )) (( segid "PROT" and resid 97 and name HG1 )) 6 6 0 peak 13942 weight 0.1000E+01 volume 22.16300 ppm1 0.687 ppm2 1.012 ASSI { 13952} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 13952 weight 0.1000E+01 volume 3.78420 ppm1 0.580 ppm2 1.083 ASSI { 13962} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 13962 weight 0.1000E+01 volume 17.67250 ppm1 0.891 ppm2 3.623 ASSI { 13972} (( segid "PROT" and resid 105 and name HB1 )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 13972 weight 0.1000E+01 volume 4.08720 ppm1 1.512 ppm2 3.627 ASSI { 13982} (( segid "PROT" and resid 28 and name HG2 )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 13982 weight 0.1000E+01 volume 3.42440 ppm1 2.057 ppm2 3.641 ASSI { 13992} (( segid "PROT" and resid 25 and name HA )) (( segid "PROT" and resid 105 and name HA )) 6 6 0 peak 13992 weight 0.1000E+01 volume 0.92270 ppm1 4.119 ppm2 3.634 ASSI { 14002} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 105 and name HG )) 6 6 0 peak 14002 weight 0.1000E+01 volume 11.01640 ppm1 0.392 ppm2 1.645 ASSI { 14012} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 105 and name HG )) 6 6 0 peak 14012 weight 0.1000E+01 volume 11.48250 ppm1 0.570 ppm2 1.641 ASSI { 14022} (( segid "PROT" and resid 105 and name HA )) (( segid "PROT" and resid 105 and name HG )) 6 6 0 peak 14022 weight 0.1000E+01 volume 4.09760 ppm1 3.633 ppm2 1.649 ASSI { 14032} (( segid "PROT" and resid 5 and name HA )) (( segid "PROT" and resid 5 and name HG1 )) 6 6 0 peak 14032 weight 0.1000E+01 volume 18.70990 ppm1 4.328 ppm2 1.600 ASSI { 14042} (( segid "PROT" and resid 35 and name HZ )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 14042 weight 0.1000E+01 volume 2.59230 ppm1 7.036 ppm2 0.388 ASSI { 14052} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 14052 weight 0.1000E+01 volume 2.95580 ppm1 7.088 ppm2 0.387 ASSI { 14062} (( segid "PROT" and resid 105 and name HB2 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 14062 weight 0.1000E+01 volume 13.58860 ppm1 1.112 ppm2 0.388 ASSI { 14072} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 14072 weight 0.1000E+01 volume 28.27450 ppm1 0.567 ppm2 0.392 ASSI { 14082} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 14082 weight 0.1000E+01 volume 20.91930 ppm1 0.896 ppm2 0.563 ASSI { 14092} (( segid "PROT" and resid 32 and name HA )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 14092 weight 0.1000E+01 volume 17.40770 ppm1 4.367 ppm2 0.563 ASSI { 14112} (( segid "PROT" and resid 43 and name HD2# )) (( segid "PROT" and resid 43 and name HG )) 6 6 0 peak 14112 weight 0.1000E+01 volume 77.89970 ppm1 0.840 ppm2 1.470 ASSI { 14122} (( segid "PROT" and resid 120 and name HB2 )) (( segid "PROT" and resid 120 and name HA )) 6 6 0 peak 14122 weight 0.1000E+01 volume 14.20140 ppm1 1.632 ppm2 4.429 ASSI { 14132} (( segid "PROT" and resid 120 and name HB1 )) (( segid "PROT" and resid 120 and name HA )) 6 6 0 peak 14132 weight 0.1000E+01 volume 25.01080 ppm1 1.775 ppm2 4.432 ASSI { 14142} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 120 and name HA )) 6 6 0 peak 14142 weight 0.1000E+01 volume 3.67100 ppm1 7.390 ppm2 4.430 ASSI { 14162} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 14162 weight 0.1000E+01 volume 6.82480 ppm1 7.392 ppm2 0.608 ASSI { 14172} (( segid "PROT" and resid 17 and name HA )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 14172 weight 0.1000E+01 volume 3.70360 ppm1 4.186 ppm2 0.614 ASSI { 14182} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 14182 weight 0.1000E+01 volume 15.10060 ppm1 1.346 ppm2 0.610 ASSI { 14192} (( segid "PROT" and resid 14 and name HG )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 14192 weight 0.1000E+01 volume 6.43050 ppm1 1.400 ppm2 0.610 ASSI { 14202} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 14202 weight 0.1000E+01 volume 6.78220 ppm1 0.258 ppm2 0.612 ASSI { 14212} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 14212 weight 0.1000E+01 volume 16.49740 ppm1 7.387 ppm2 0.663 ASSI { 14222} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 14222 weight 0.1000E+01 volume 6.01200 ppm1 0.267 ppm2 0.662 ASSI { 14232} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 14232 weight 0.1000E+01 volume 37.48560 ppm1 1.339 ppm2 0.657 ASSI { 14242} (( segid "PROT" and resid 22 and name HD1# )) (( segid "PROT" and resid 22 and name HA )) 6 6 0 peak 14242 weight 0.1000E+01 volume 20.29860 ppm1 1.097 ppm2 4.310 ASSI { 14252} (( segid "PROT" and resid 72 and name HB2 )) (( segid "PROT" and resid 72 and name HA )) 6 6 0 peak 14252 weight 0.1000E+01 volume 41.10180 ppm1 2.130 ppm2 4.294 ASSI { 14262} (( segid "PROT" and resid 85 and name HB1 )) (( segid "PROT" and resid 85 and name HA )) 6 6 0 peak 14262 weight 0.1000E+01 volume 1.93650 ppm1 2.492 ppm2 4.188 ASSI { 14272} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 22 and name HB2 )) 6 6 0 peak 14272 weight 0.1000E+01 volume 12.59660 ppm1 1.088 ppm2 2.065 ASSI { 14282} (( segid "PROT" and resid 22 and name HG )) (( segid "PROT" and resid 22 and name HB1 )) 6 6 0 peak 14282 weight 0.1000E+01 volume 4.86680 ppm1 1.871 ppm2 2.208 ASSI { 14292} (( segid "PROT" and resid 22 and name HG )) (( segid "PROT" and resid 22 and name HB2 )) 6 6 0 peak 14292 weight 0.1000E+01 volume 6.86150 ppm1 1.875 ppm2 2.067 ASSI { 14302} (( segid "PROT" and resid 22 and name HA )) (( segid "PROT" and resid 22 and name HB1 )) 6 6 0 peak 14302 weight 0.1000E+01 volume 3.28170 ppm1 4.313 ppm2 2.212 ASSI { 14312} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 22 and name HB1 )) 6 6 0 peak 14312 weight 0.1000E+01 volume 2.53090 ppm1 4.422 ppm2 2.212 ASSI { 14322} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 22 and name HB2 )) 6 6 0 peak 14322 weight 0.1000E+01 volume 5.60400 ppm1 4.422 ppm2 2.058 ASSI { 14332} (( segid "PROT" and resid 22 and name HA )) (( segid "PROT" and resid 22 and name HB2 )) 6 6 0 peak 14332 weight 0.1000E+01 volume 4.16150 ppm1 4.306 ppm2 2.065 ASSI { 14342} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 22 and name HB2 )) 6 6 0 peak 14342 weight 0.1000E+01 volume 3.02240 ppm1 6.616 ppm2 2.065 ASSI { 14352} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 22 and name HB1 )) 6 6 0 peak 14352 weight 0.1000E+01 volume 1.81490 ppm1 6.613 ppm2 2.206 ASSI { 14362} (( segid "PROT" and resid 70 and name HB2 )) (( segid "PROT" and resid 70 and name HB1 )) 6 6 0 peak 14362 weight 0.1000E+01 volume 9.23020 ppm1 1.084 ppm2 1.997 ASSI { 14372} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 22 and name HG )) 6 6 0 peak 14372 weight 0.1000E+01 volume 25.54810 ppm1 1.093 ppm2 1.868 ASSI { 14382} (( segid "PROT" and resid 22 and name HG )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14382 weight 0.1000E+01 volume 22.44220 ppm1 1.873 ppm2 1.095 ASSI { 14392} (( segid "PROT" and resid 22 and name HB2 )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14392 weight 0.1000E+01 volume 26.81400 ppm1 2.055 ppm2 1.099 ASSI { 14402} (( segid "PROT" and resid 22 and name HB1 )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14402 weight 0.1000E+01 volume 16.59690 ppm1 2.211 ppm2 1.096 ASSI { 14412} (( segid "PROT" and resid 7 and name HB1 )) (( segid "PROT" and resid 7 and name HG1 )) 6 6 0 peak 14412 weight 0.1000E+01 volume 44.95640 ppm1 1.600 ppm2 1.098 ASSI { 14422} (( segid "PROT" and resid 59 and name HB1 )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 14422 weight 0.1000E+01 volume 17.03770 ppm1 1.699 ppm2 1.096 ASSI { 14432} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14432 weight 0.1000E+01 volume 9.51610 ppm1 0.236 ppm2 1.099 ASSI { 14442} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14442 weight 0.1000E+01 volume 6.52100 ppm1 0.347 ppm2 1.096 ASSI { 14452} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14452 weight 0.1000E+01 volume 23.02220 ppm1 0.579 ppm2 1.099 ASSI { 14462} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14462 weight 0.1000E+01 volume 16.07560 ppm1 0.670 ppm2 1.099 ASSI { 14472} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14472 weight 0.1000E+01 volume 5.56840 ppm1 -0.259 ppm2 1.102 ASSI { 14482} (( segid "PROT" and resid 22 and name HB1 )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 14482 weight 0.1000E+01 volume 13.26270 ppm1 2.213 ppm2 1.089 ASSI { 14492} (( segid "PROT" and resid 22 and name HB2 )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14492 weight 0.1000E+01 volume 12.64640 ppm1 2.040 ppm2 1.087 ASSI { 14502} (( segid "PROT" and resid 22 and name HG )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14502 weight 0.1000E+01 volume 28.14660 ppm1 1.873 ppm2 1.090 ASSI { 14512} (( segid "PROT" and resid 22 and name HA )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 14512 weight 0.1000E+01 volume 5.14870 ppm1 4.313 ppm2 1.086 ASSI { 14522} (( segid "PROT" and resid 22 and name HA )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14522 weight 0.1000E+01 volume 16.90280 ppm1 4.314 ppm2 1.100 ASSI { 14532} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14532 weight 0.1000E+01 volume 5.79540 ppm1 3.839 ppm2 1.097 ASSI { 14542} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14542 weight 0.1000E+01 volume 33.99480 ppm1 6.608 ppm2 1.095 ASSI { 14552} (( segid "PROT" and resid 26 and name HD1 )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 14552 weight 0.1000E+01 volume 4.97880 ppm1 6.960 ppm2 1.099 ASSI { 14562} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 22 and name HG )) 6 6 0 peak 14562 weight 0.1000E+01 volume 4.50020 ppm1 6.606 ppm2 1.870 ASSI { 14572} (( segid "PROT" and resid 26 and name HD1 )) (( segid "PROT" and resid 22 and name HG )) 6 6 0 peak 14572 weight 0.1000E+01 volume 2.63790 ppm1 6.926 ppm2 1.869 ASSI { 14582} (( segid "PROT" and resid 22 and name HD1# )) (( segid "PROT" and resid 22 and name HB1 )) 6 6 0 peak 14582 weight 0.1000E+01 volume 18.75310 ppm1 1.095 ppm2 2.215 ASSI { 14592} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 22 and name HA )) 6 6 0 peak 14592 weight 0.1000E+01 volume 2.51730 ppm1 6.611 ppm2 4.312 ASSI { 14602} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 19 and name HA )) 6 6 0 peak 14602 weight 0.1000E+01 volume 6.33040 ppm1 0.737 ppm2 4.419 ASSI { 14612} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 19 and name HA )) 6 6 0 peak 14612 weight 0.1000E+01 volume 2.35600 ppm1 0.839 ppm2 4.424 ASSI { 14622} (( segid "PROT" and resid 19 and name HE# )) (( segid "PROT" and resid 19 and name HA )) 6 6 0 peak 14622 weight 0.1000E+01 volume 7.42950 ppm1 2.047 ppm2 4.416 ASSI { 14632} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 19 and name HB1 )) 6 6 0 peak 14632 weight 0.1000E+01 volume 2.54450 ppm1 0.736 ppm2 2.208 ASSI { 14642} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 19 and name HB1 )) 6 6 0 peak 14642 weight 0.1000E+01 volume 5.35970 ppm1 0.850 ppm2 2.203 ASSI { 14652} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 19 and name HB1 )) 6 6 0 peak 14652 weight 0.1000E+01 volume 42.13940 ppm1 3.634 ppm2 2.203 ASSI { 14662} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 19 and name HG1 )) 6 6 0 peak 14662 weight 0.1000E+01 volume 2.25380 ppm1 3.626 ppm2 2.660 ASSI { 14672} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 19 and name HG2 )) 6 6 0 peak 14672 weight 0.1000E+01 volume 2.97460 ppm1 3.615 ppm2 2.558 ASSI { 14682} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 19 and name HG2 )) 6 6 0 peak 14682 weight 0.1000E+01 volume 4.31320 ppm1 4.421 ppm2 2.556 ASSI { 14692} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 19 and name HG1 )) 6 6 0 peak 14692 weight 0.1000E+01 volume 34.08780 ppm1 2.224 ppm2 2.664 ASSI { 14702} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 19 and name HG2 )) 6 6 0 peak 14702 weight 0.1000E+01 volume 16.22540 ppm1 2.223 ppm2 2.544 ASSI { 14712} (( segid "PROT" and resid 15 and name HG2 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 14712 weight 0.1000E+01 volume 27.17340 ppm1 1.460 ppm2 2.014 ASSI { 14722} (( segid "PROT" and resid 15 and name HG1 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 14722 weight 0.1000E+01 volume 13.08590 ppm1 1.550 ppm2 2.013 ASSI { 14732} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 14732 weight 0.1000E+01 volume 6.08770 ppm1 3.681 ppm2 2.010 ASSI { 14742} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 14742 weight 0.1000E+01 volume 7.29250 ppm1 4.421 ppm2 2.015 ASSI { 14752} (( segid "PROT" and resid 19 and name HE# )) (( segid "PROT" and resid 19 and name HG1 )) 6 6 0 peak 14752 weight 0.1000E+01 volume 15.93820 ppm1 2.001 ppm2 2.652 ASSI { 14762} (( segid "PROT" and resid 57 and name HG1 )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 14762 weight 0.1000E+01 volume 14.41840 ppm1 3.004 ppm2 1.994 ASSI { 14772} (( segid "PROT" and resid 57 and name HA )) (( segid "PROT" and resid 57 and name HB2 )) 6 6 0 peak 14772 weight 0.1000E+01 volume 2.04950 ppm1 5.064 ppm2 1.262 ASSI { 14782} (( segid "PROT" and resid 57 and name HE# )) (( segid "PROT" and resid 57 and name HB2 )) 6 6 0 peak 14782 weight 0.1000E+01 volume 3.60210 ppm1 1.987 ppm2 1.262 ASSI { 14792} (( segid "PROT" and resid 60 and name HB2 )) (( segid "PROT" and resid 60 and name HB1 )) 6 6 0 peak 14792 weight 0.1000E+01 volume 7.76260 ppm1 3.975 ppm2 4.353 ASSI { 14802} (( segid "PROT" and resid 60 and name HB1 )) (( segid "PROT" and resid 60 and name HB2 )) 6 6 0 peak 14802 weight 0.1000E+01 volume 21.76000 ppm1 4.350 ppm2 3.974 ASSI { 14812} (( segid "PROT" and resid 60 and name HA )) (( segid "PROT" and resid 60 and name HB2 )) 6 6 0 peak 14812 weight 0.1000E+01 volume 15.69380 ppm1 4.238 ppm2 3.978 ASSI { 14822} (( segid "PROT" and resid 60 and name HB2 )) (( segid "PROT" and resid 60 and name HA )) 6 6 0 peak 14822 weight 0.1000E+01 volume 4.22090 ppm1 3.973 ppm2 4.241 ASSI { 14832} (( segid "PROT" and resid 60 and name HB1 )) (( segid "PROT" and resid 60 and name HA )) 6 6 0 peak 14832 weight 0.1000E+01 volume 15.17950 ppm1 4.351 ppm2 4.245 ASSI { 14842} (( segid "PROT" and resid 103 and name HB2 )) (( segid "PROT" and resid 103 and name HB1 )) 6 6 0 peak 14842 weight 0.1000E+01 volume 7.71120 ppm1 4.112 ppm2 4.243 ASSI { 14852} (( segid "PROT" and resid 96 and name HB2 )) (( segid "PROT" and resid 96 and name HB1 )) 6 6 0 peak 14852 weight 0.1000E+01 volume 9.43840 ppm1 3.998 ppm2 4.346 ASSI { 14862} (( segid "PROT" and resid 96 and name HA )) (( segid "PROT" and resid 96 and name HB2 )) 6 6 0 peak 14862 weight 0.1000E+01 volume 3.71540 ppm1 4.422 ppm2 3.995 ASSI { 14872} (( segid "PROT" and resid 96 and name HB1 )) (( segid "PROT" and resid 96 and name HB2 )) 6 6 0 peak 14872 weight 0.1000E+01 volume 5.40740 ppm1 4.346 ppm2 3.995 ASSI { 14882} (( segid "PROT" and resid 103 and name HA )) (( segid "PROT" and resid 103 and name HB2 )) 6 6 0 peak 14882 weight 0.1000E+01 volume 7.67060 ppm1 4.452 ppm2 4.124 ASSI { 14892} (( segid "PROT" and resid 103 and name HA )) (( segid "PROT" and resid 103 and name HB1 )) 6 6 0 peak 14892 weight 0.1000E+01 volume 3.36700 ppm1 4.451 ppm2 4.243 ASSI { 14902} (( segid "PROT" and resid 105 and name HB2 )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 14902 weight 0.1000E+01 volume 1.34280 ppm1 1.123 ppm2 3.244 ASSI { 14912} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 14912 weight 0.1000E+01 volume 2.18310 ppm1 6.056 ppm2 3.237 ASSI { 14922} (( segid "PROT" and resid 102 and name HA )) (( segid "PROT" and resid 102 and name HB1 )) 6 6 0 peak 14922 weight 0.1000E+01 volume 6.55040 ppm1 3.234 ppm2 3.038 ASSI { 14932} (( segid "PROT" and resid 102 and name HA )) (( segid "PROT" and resid 102 and name HB2 )) 6 6 0 peak 14932 weight 0.1000E+01 volume 5.30840 ppm1 3.242 ppm2 2.705 ASSI { 14942} (( segid "PROT" and resid 102 and name HB1 )) (( segid "PROT" and resid 102 and name HB2 )) 6 6 0 peak 14942 weight 0.1000E+01 volume 7.71140 ppm1 3.039 ppm2 2.708 ASSI { 14952} (( segid "PROT" and resid 99 and name HA )) (( segid "PROT" and resid 102 and name HB2 )) 6 6 0 peak 14952 weight 0.1000E+01 volume 1.92100 ppm1 3.782 ppm2 2.701 ASSI { 14962} (( segid "PROT" and resid 99 and name HA )) (( segid "PROT" and resid 102 and name HB1 )) 6 6 0 peak 14962 weight 0.1000E+01 volume 3.57630 ppm1 3.788 ppm2 3.040 ASSI { 14972} (( segid "PROT" and resid 35 and name HZ )) (( segid "PROT" and resid 102 and name HB1 )) 6 6 0 peak 14972 weight 0.1000E+01 volume 2.35610 ppm1 7.033 ppm2 3.035 ASSI { 14982} (( segid "PROT" and resid 35 and name HZ )) (( segid "PROT" and resid 102 and name HB2 )) 6 6 0 peak 14982 weight 0.1000E+01 volume 4.31560 ppm1 7.031 ppm2 2.704 ASSI { 14992} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 102 and name HB2 )) 6 6 0 peak 14992 weight 0.1000E+01 volume 1.35610 ppm1 7.349 ppm2 2.704 ASSI { 15002} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 102 and name HB1 )) 6 6 0 peak 15002 weight 0.1000E+01 volume 0.98260 ppm1 7.349 ppm2 3.033 ASSI { 15012} (( segid "PROT" and resid 88 and name HB# )) (( segid "PROT" and resid 102 and name HB1 )) 6 6 0 peak 15012 weight 0.1000E+01 volume 2.39980 ppm1 1.746 ppm2 3.036 ASSI { 15022} (( segid "PROT" and resid 88 and name HB# )) (( segid "PROT" and resid 102 and name HB2 )) 6 6 0 peak 15022 weight 0.1000E+01 volume 2.96130 ppm1 1.751 ppm2 2.708 ASSI { 15032} (( segid "PROT" and resid 30 and name HA )) (( segid "PROT" and resid 29 and name HA )) 6 6 0 peak 15032 weight 0.1000E+01 volume 6.94110 ppm1 5.039 ppm2 4.722 ASSI { 15042} (( segid "PROT" and resid 29 and name HB2 )) (( segid "PROT" and resid 29 and name HA )) 6 6 0 peak 15042 weight 0.1000E+01 volume 3.02170 ppm1 2.259 ppm2 4.721 ASSI { 15052} (( segid "PROT" and resid 33 and name HB1 )) (( segid "PROT" and resid 29 and name HA )) 6 6 0 peak 15052 weight 0.1000E+01 volume 1.59800 ppm1 2.118 ppm2 4.717 ASSI { 15062} (( segid "PROT" and resid 58 and name HA )) (( segid "PROT" and resid 58 and name HB2 )) 6 6 0 peak 15062 weight 0.1000E+01 volume 3.03220 ppm1 4.866 ppm2 2.301 ASSI { 15072} (( segid "PROT" and resid 58 and name HA )) (( segid "PROT" and resid 58 and name HB1 )) 6 6 0 peak 15072 weight 0.1000E+01 volume 7.56500 ppm1 4.863 ppm2 2.588 ASSI { 15082} (( segid "PROT" and resid 58 and name HB2 )) (( segid "PROT" and resid 58 and name HB1 )) 6 6 0 peak 15082 weight 0.1000E+01 volume 7.39880 ppm1 2.298 ppm2 2.596 ASSI { 15092} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 40 and name HB1 )) 6 6 0 peak 15092 weight 0.1000E+01 volume 4.32930 ppm1 5.084 ppm2 2.928 ASSI { 15102} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 40 and name HB2 )) 6 6 0 peak 15102 weight 0.1000E+01 volume 8.55460 ppm1 5.085 ppm2 2.389 ASSI { 15112} (( segid "PROT" and resid 29 and name HB2 )) (( segid "PROT" and resid 29 and name HB1 )) 6 6 0 peak 15112 weight 0.1000E+01 volume 18.62620 ppm1 2.255 ppm2 2.768 ASSI { 15122} (( segid "PROT" and resid 29 and name HB1 )) (( segid "PROT" and resid 29 and name HB2 )) 6 6 0 peak 15122 weight 0.1000E+01 volume 10.43960 ppm1 2.773 ppm2 2.256 ASSI { 15132} (( segid "PROT" and resid 41 and name HG2 )) (( segid "PROT" and resid 40 and name HA )) 6 6 0 peak 15132 weight 0.1000E+01 volume 1.93880 ppm1 1.091 ppm2 5.082 ASSI { 15142} (( segid "PROT" and resid 41 and name HG1 )) (( segid "PROT" and resid 40 and name HA )) 6 6 0 peak 15142 weight 0.1000E+01 volume 4.92750 ppm1 1.576 ppm2 5.084 ASSI { 15152} (( segid "PROT" and resid 40 and name HB1 )) (( segid "PROT" and resid 40 and name HA )) 6 6 0 peak 15152 weight 0.1000E+01 volume 10.04480 ppm1 2.932 ppm2 5.084 ASSI { 15162} (( segid "PROT" and resid 41 and name HD2 )) (( segid "PROT" and resid 40 and name HA )) 6 6 0 peak 15162 weight 0.1000E+01 volume 3.65430 ppm1 3.738 ppm2 5.085 ASSI { 15172} (( segid "PROT" and resid 40 and name HB2 )) (( segid "PROT" and resid 40 and name HB1 )) 6 6 0 peak 15172 weight 0.1000E+01 volume 22.28200 ppm1 2.386 ppm2 2.936 ASSI { 15182} (( segid "PROT" and resid 40 and name HB1 )) (( segid "PROT" and resid 40 and name HB2 )) 6 6 0 peak 15182 weight 0.1000E+01 volume 22.25250 ppm1 2.927 ppm2 2.387 ASSI { 15192} (( segid "PROT" and resid 65 and name HD1 )) (( segid "PROT" and resid 65 and name HE1 )) 6 6 0 peak 15192 weight 0.1000E+01 volume 12.11870 ppm1 1.556 ppm2 2.375 ASSI { 15202} (( segid "PROT" and resid 48 and name HB1 )) (( segid "PROT" and resid 48 and name HA )) 6 6 0 peak 15202 weight 0.1000E+01 volume 8.88270 ppm1 3.124 ppm2 4.606 ASSI { 15212} (( segid "PROT" and resid 48 and name HB1 )) (( segid "PROT" and resid 48 and name HB2 )) 6 6 0 peak 15212 weight 0.1000E+01 volume 7.90780 ppm1 3.122 ppm2 2.621 ASSI { 15222} (( segid "PROT" and resid 48 and name HA )) (( segid "PROT" and resid 48 and name HB1 )) 6 6 0 peak 15222 weight 0.1000E+01 volume 3.27770 ppm1 4.601 ppm2 3.115 ASSI { 15232} (( segid "PROT" and resid 48 and name HA )) (( segid "PROT" and resid 48 and name HB2 )) 6 6 0 peak 15232 weight 0.1000E+01 volume 5.94500 ppm1 4.597 ppm2 2.647 ASSI { 15242} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 57 and name HA )) 6 6 0 peak 15242 weight 0.1000E+01 volume 3.06900 ppm1 0.888 ppm2 5.067 ASSI { 15252} (( segid "PROT" and resid 65 and name HG2 )) (( segid "PROT" and resid 65 and name HE1 )) 6 6 0 peak 15252 weight 0.1000E+01 volume 6.86060 ppm1 0.738 ppm2 2.380 ASSI { 15262} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 67 and name HB1 )) 6 6 0 peak 15262 weight 0.1000E+01 volume 7.60150 ppm1 1.224 ppm2 2.831 ASSI { 15272} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 67 and name HB2 )) 6 6 0 peak 15272 weight 0.1000E+01 volume 4.60710 ppm1 1.224 ppm2 2.581 ASSI { 15282} (( segid "PROT" and resid 67 and name HB2 )) (( segid "PROT" and resid 67 and name HB1 )) 6 6 0 peak 15282 weight 0.1000E+01 volume 21.62540 ppm1 2.594 ppm2 2.851 ASSI { 15292} (( segid "PROT" and resid 67 and name HB1 )) (( segid "PROT" and resid 67 and name HB2 )) 6 6 0 peak 15292 weight 0.1000E+01 volume 11.17730 ppm1 2.843 ppm2 2.588 ASSI { 15302} (( segid "PROT" and resid 83 and name HB1 )) (( segid "PROT" and resid 80 and name HA )) 6 6 0 peak 15302 weight 0.1000E+01 volume 6.54870 ppm1 2.171 ppm2 4.556 ASSI { 15312} (( segid "PROT" and resid 83 and name HB2 )) (( segid "PROT" and resid 80 and name HA )) 6 6 0 peak 15312 weight 0.1000E+01 volume 5.23950 ppm1 1.632 ppm2 4.534 ASSI { 15322} (( segid "PROT" and resid 80 and name HB2 )) (( segid "PROT" and resid 80 and name HA )) 6 6 0 peak 15322 weight 0.1000E+01 volume 1.91200 ppm1 2.496 ppm2 4.551 ASSI { 15332} (( segid "PROT" and resid 76 and name HA )) (( segid "PROT" and resid 79 and name HB1 )) 6 6 0 peak 15332 weight 0.1000E+01 volume 2.75650 ppm1 3.887 ppm2 2.854 ASSI { 15342} (( segid "PROT" and resid 76 and name HA )) (( segid "PROT" and resid 79 and name HB2 )) 6 6 0 peak 15342 weight 0.1000E+01 volume 2.40010 ppm1 3.882 ppm2 2.698 ASSI { 15352} (( segid "PROT" and resid 80 and name HA )) (( segid "PROT" and resid 80 and name HB2 )) 6 6 0 peak 15352 weight 0.1000E+01 volume 2.13020 ppm1 4.552 ppm2 2.508 ASSI { 15362} (( segid "PROT" and resid 80 and name HB1 )) (( segid "PROT" and resid 80 and name HB2 )) 6 6 0 peak 15362 weight 0.1000E+01 volume 2.97310 ppm1 2.790 ppm2 2.502 ASSI { 15372} (( segid "PROT" and resid 117 and name HB1 )) (( segid "PROT" and resid 114 and name HA )) 6 6 0 peak 15372 weight 0.1000E+01 volume 2.13090 ppm1 2.208 ppm2 4.559 ASSI { 15382} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 114 and name HB1 )) 6 6 0 peak 15382 weight 0.1000E+01 volume 6.31080 ppm1 3.763 ppm2 2.840 ASSI { 15392} (( segid "PROT" and resid 115 and name HD1 )) (( segid "PROT" and resid 114 and name HB2 )) 6 6 0 peak 15392 weight 0.1000E+01 volume 8.71710 ppm1 3.764 ppm2 2.681 ASSI { 15402} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 114 and name HB1 )) 6 6 0 peak 15402 weight 0.1000E+01 volume 3.91120 ppm1 0.722 ppm2 2.833 ASSI { 15412} (( segid "PROT" and resid 69 and name HA2 )) (( segid "PROT" and resid 69 and name HA1 )) 6 6 0 peak 15412 weight 0.1000E+01 volume 16.21310 ppm1 3.909 ppm2 4.253 ASSI { 15422} (( segid "PROT" and resid 69 and name HA1 )) (( segid "PROT" and resid 69 and name HA2 )) 6 6 0 peak 15422 weight 0.1000E+01 volume 20.06750 ppm1 4.263 ppm2 3.909 ASSI { 15432} (( segid "PROT" and resid 121 and name HA2 )) (( segid "PROT" and resid 121 and name HA1 )) 6 6 0 peak 15432 weight 0.1000E+01 volume 50.09800 ppm1 3.791 ppm2 3.882 ASSI { 15442} (( segid "PROT" and resid 121 and name HA1 )) (( segid "PROT" and resid 121 and name HA2 )) 6 6 0 peak 15442 weight 0.1000E+01 volume 87.61800 ppm1 3.876 ppm2 3.791 ASSI { 15452} (( segid "PROT" and resid 37 and name HA )) (( segid "PROT" and resid 38 and name HD1 )) 6 6 0 peak 15452 weight 0.1000E+01 volume 3.96110 ppm1 4.921 ppm2 3.690 ASSI { 15462} (( segid "PROT" and resid 37 and name HA )) (( segid "PROT" and resid 38 and name HD2 )) 6 6 0 peak 15462 weight 0.1000E+01 volume 3.13150 ppm1 4.919 ppm2 3.454 ASSI { 15472} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 15472 weight 0.1000E+01 volume 3.35440 ppm1 3.696 ppm2 2.737 ASSI { 15482} (( segid "PROT" and resid 57 and name HE# )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 15482 weight 0.1000E+01 volume 2.11140 ppm1 1.988 ppm2 2.731 ASSI { 15492} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 86 and name HB2 )) 6 6 0 peak 15492 weight 0.1000E+01 volume 1.67630 ppm1 1.105 ppm2 2.904 ASSI { 15502} (( segid "PROT" and resid 86 and name HB2 )) (( segid "PROT" and resid 86 and name HB1 )) 6 6 0 peak 15502 weight 0.1000E+01 volume 21.97400 ppm1 2.889 ppm2 3.125 ASSI { 15512} (( segid "PROT" and resid 87 and name HB1 )) (( segid "PROT" and resid 87 and name HA )) 6 6 0 peak 15512 weight 0.1000E+01 volume 6.40700 ppm1 3.080 ppm2 4.452 ASSI { 15522} (( segid "PROT" and resid 90 and name HB1 )) (( segid "PROT" and resid 87 and name HA )) 6 6 0 peak 15522 weight 0.1000E+01 volume 4.43800 ppm1 2.143 ppm2 4.455 ASSI { 15532} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 87 and name HB1 )) 6 6 0 peak 15532 weight 0.1000E+01 volume 1.28270 ppm1 0.442 ppm2 3.078 ASSI { 15542} (( segid "PROT" and resid 92 and name HB1 )) (( segid "PROT" and resid 92 and name HA )) 6 6 0 peak 15542 weight 0.1000E+01 volume 1.26250 ppm1 3.089 ppm2 4.674 ASSI { 15552} (( segid "PROT" and resid 115 and name HB2 )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 15552 weight 0.1000E+01 volume 39.65180 ppm1 1.853 ppm2 2.038 ASSI { 15562} (( segid "PROT" and resid 112 and name HA )) (( segid "PROT" and resid 112 and name HG2 )) 6 6 0 peak 15562 weight 0.1000E+01 volume 5.18880 ppm1 4.125 ppm2 2.008 ASSI { 15572} (( segid "PROT" and resid 14 and name HB1 )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 15572 weight 0.1000E+01 volume 3.96620 ppm1 1.661 ppm2 4.234 ASSI { 15582} (( segid "PROT" and resid 11 and name HB2 )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 15582 weight 0.1000E+01 volume 23.02610 ppm1 2.039 ppm2 4.227 ASSI { 15592} (( segid "PROT" and resid 11 and name HG2 )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 15592 weight 0.1000E+01 volume 8.29210 ppm1 2.194 ppm2 4.225 ASSI { 15602} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 10 and name HA )) 6 6 0 peak 15602 weight 0.1000E+01 volume 4.22430 ppm1 3.900 ppm2 4.681 ASSI { 15612} (( segid "PROT" and resid 10 and name HG2 )) (( segid "PROT" and resid 10 and name HA )) 6 6 0 peak 15612 weight 0.1000E+01 volume 2.58850 ppm1 1.554 ppm2 4.673 ASSI { 15622} (( segid "PROT" and resid 10 and name HB2 )) (( segid "PROT" and resid 10 and name HA )) 6 6 0 peak 15622 weight 0.1000E+01 volume 4.47690 ppm1 1.663 ppm2 4.680 ASSI { 15632} (( segid "PROT" and resid 10 and name HB1 )) (( segid "PROT" and resid 10 and name HA )) 6 6 0 peak 15632 weight 0.1000E+01 volume 3.25960 ppm1 2.179 ppm2 4.680 ASSI { 15642} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 11 and name HB2 )) 6 6 0 peak 15642 weight 0.1000E+01 volume 11.53310 ppm1 3.907 ppm2 2.043 ASSI { 15652} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 11 and name HB2 )) 6 6 0 peak 15652 weight 0.1000E+01 volume 6.42610 ppm1 3.989 ppm2 2.036 ASSI { 15662} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 11 and name HB1 )) 6 6 0 peak 15662 weight 0.1000E+01 volume 4.76520 ppm1 3.904 ppm2 2.444 ASSI { 15672} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 11 and name HB1 )) 6 6 0 peak 15672 weight 0.1000E+01 volume 2.79060 ppm1 3.982 ppm2 2.452 ASSI { 15682} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 11 and name HB1 )) 6 6 0 peak 15682 weight 0.1000E+01 volume 11.06170 ppm1 4.233 ppm2 2.442 ASSI { 15692} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 11 and name HG1 )) 6 6 0 peak 15692 weight 0.1000E+01 volume 5.79130 ppm1 4.241 ppm2 2.268 ASSI { 15702} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 11 and name HG1 )) 6 6 0 peak 15702 weight 0.1000E+01 volume 9.37380 ppm1 3.991 ppm2 2.266 ASSI { 15712} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 11 and name HG1 )) 6 6 0 peak 15712 weight 0.1000E+01 volume 15.91190 ppm1 3.902 ppm2 2.275 ASSI { 15722} (( segid "PROT" and resid 11 and name HA )) (( segid "PROT" and resid 11 and name HG2 )) 6 6 0 peak 15722 weight 0.1000E+01 volume 17.17280 ppm1 4.242 ppm2 2.183 ASSI { 15732} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15732 weight 0.1000E+01 volume 1.62280 ppm1 3.613 ppm2 4.436 ASSI { 15742} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15742 weight 0.1000E+01 volume 1.68430 ppm1 3.333 ppm2 4.433 ASSI { 15752} (( segid "PROT" and resid 20 and name HB1 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15752 weight 0.1000E+01 volume 8.11630 ppm1 2.416 ppm2 4.437 ASSI { 15762} (( segid "PROT" and resid 23 and name HG1 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15762 weight 0.1000E+01 volume 3.17450 ppm1 2.321 ppm2 4.434 ASSI { 15772} (( segid "PROT" and resid 20 and name HG1 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15772 weight 0.1000E+01 volume 7.48580 ppm1 2.124 ppm2 4.433 ASSI { 15782} (( segid "PROT" and resid 23 and name HB1 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15782 weight 0.1000E+01 volume 8.43150 ppm1 2.043 ppm2 4.434 ASSI { 15792} (( segid "PROT" and resid 20 and name HG2 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15792 weight 0.1000E+01 volume 7.91500 ppm1 1.961 ppm2 4.436 ASSI { 15802} (( segid "PROT" and resid 20 and name HB2 )) (( segid "PROT" and resid 20 and name HA )) 6 6 0 peak 15802 weight 0.1000E+01 volume 6.08830 ppm1 1.753 ppm2 4.433 ASSI { 15812} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 20 and name HB1 )) 6 6 0 peak 15812 weight 0.1000E+01 volume 2.27580 ppm1 3.332 ppm2 2.408 ASSI { 15822} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 20 and name HB1 )) 6 6 0 peak 15822 weight 0.1000E+01 volume 0.92340 ppm1 3.621 ppm2 2.409 ASSI { 15832} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 20 and name HB1 )) 6 6 0 peak 15832 weight 0.1000E+01 volume 11.27290 ppm1 4.436 ppm2 2.403 ASSI { 15842} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 20 and name HB2 )) 6 6 0 peak 15842 weight 0.1000E+01 volume 1.84510 ppm1 3.329 ppm2 1.752 ASSI { 15852} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 20 and name HB2 )) 6 6 0 peak 15852 weight 0.1000E+01 volume 1.41400 ppm1 3.623 ppm2 1.761 ASSI { 15862} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 20 and name HB2 )) 6 6 0 peak 15862 weight 0.1000E+01 volume 11.93390 ppm1 4.436 ppm2 1.743 ASSI { 15872} (( segid "PROT" and resid 20 and name HB2 )) (( segid "PROT" and resid 20 and name HB1 )) 6 6 0 peak 15872 weight 0.1000E+01 volume 19.36270 ppm1 1.748 ppm2 2.412 ASSI { 15882} (( segid "PROT" and resid 20 and name HB1 )) (( segid "PROT" and resid 20 and name HB2 )) 6 6 0 peak 15882 weight 0.1000E+01 volume 15.17650 ppm1 2.408 ppm2 1.739 ASSI { 15892} (( segid "PROT" and resid 20 and name HG1 )) (( segid "PROT" and resid 20 and name HB1 )) 6 6 0 peak 15892 weight 0.1000E+01 volume 8.85570 ppm1 2.130 ppm2 2.414 ASSI { 15902} (( segid "PROT" and resid 20 and name HG2 )) (( segid "PROT" and resid 20 and name HB1 )) 6 6 0 peak 15902 weight 0.1000E+01 volume 23.42100 ppm1 1.945 ppm2 2.414 ASSI { 15912} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 20 and name HG2 )) 6 6 0 peak 15912 weight 0.1000E+01 volume 7.13800 ppm1 3.333 ppm2 1.959 ASSI { 15922} (( segid "PROT" and resid 20 and name HD1 )) (( segid "PROT" and resid 20 and name HG2 )) 6 6 0 peak 15922 weight 0.1000E+01 volume 8.33810 ppm1 3.615 ppm2 1.955 ASSI { 15932} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 20 and name HG2 )) 6 6 0 peak 15932 weight 0.1000E+01 volume 18.35270 ppm1 4.438 ppm2 1.969 ASSI { 15942} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 20 and name HG1 )) 6 6 0 peak 15942 weight 0.1000E+01 volume 8.20470 ppm1 3.333 ppm2 2.124 ASSI { 15952} (( segid "PROT" and resid 17 and name HA )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 15952 weight 0.1000E+01 volume 0.94520 ppm1 4.182 ppm2 3.610 ASSI { 15962} (( segid "PROT" and resid 20 and name HB1 )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 15962 weight 0.1000E+01 volume 3.74620 ppm1 2.413 ppm2 3.328 ASSI { 15972} (( segid "PROT" and resid 20 and name HB1 )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 15972 weight 0.1000E+01 volume 2.13390 ppm1 2.416 ppm2 3.623 ASSI { 15982} (( segid "PROT" and resid 20 and name HB2 )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 15982 weight 0.1000E+01 volume 3.17190 ppm1 1.754 ppm2 3.334 ASSI { 15992} (( segid "PROT" and resid 20 and name HB2 )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 15992 weight 0.1000E+01 volume 3.01580 ppm1 1.755 ppm2 3.609 ASSI { 16002} (( segid "PROT" and resid 20 and name HG2 )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 16002 weight 0.1000E+01 volume 8.32540 ppm1 1.951 ppm2 3.321 ASSI { 16012} (( segid "PROT" and resid 20 and name HG1 )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 16012 weight 0.1000E+01 volume 6.48060 ppm1 2.127 ppm2 3.329 ASSI { 16022} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 20 and name HD2 )) 6 6 0 peak 16022 weight 0.1000E+01 volume 5.39760 ppm1 2.218 ppm2 3.327 ASSI { 16032} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 16032 weight 0.1000E+01 volume 5.24990 ppm1 2.222 ppm2 3.621 ASSI { 16042} (( segid "PROT" and resid 20 and name HG1 )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 16042 weight 0.1000E+01 volume 3.94890 ppm1 2.129 ppm2 3.625 ASSI { 16052} (( segid "PROT" and resid 20 and name HG2 )) (( segid "PROT" and resid 20 and name HD1 )) 6 6 0 peak 16052 weight 0.1000E+01 volume 12.49390 ppm1 1.958 ppm2 3.629 ASSI { 16062} (( segid "PROT" and resid 20 and name HD2 )) (( segid "PROT" and resid 19 and name HB1 )) 6 6 0 peak 16062 weight 0.1000E+01 volume 7.46010 ppm1 3.339 ppm2 2.189 ASSI { 16072} (( segid "PROT" and resid 30 and name HA )) (( segid "PROT" and resid 30 and name HB1 )) 6 6 0 peak 16072 weight 0.1000E+01 volume 4.80020 ppm1 5.041 ppm2 2.107 ASSI { 16082} (( segid "PROT" and resid 30 and name HD1 )) (( segid "PROT" and resid 30 and name HB1 )) 6 6 0 peak 16082 weight 0.1000E+01 volume 5.84970 ppm1 3.353 ppm2 2.110 ASSI { 16092} (( segid "PROT" and resid 33 and name HD1# )) (( segid "PROT" and resid 30 and name HB1 )) 6 6 0 peak 16092 weight 0.1000E+01 volume 1.25240 ppm1 0.966 ppm2 2.103 ASSI { 16102} (( segid "PROT" and resid 30 and name HG2 )) (( segid "PROT" and resid 30 and name HB1 )) 6 6 0 peak 16102 weight 0.1000E+01 volume 3.72920 ppm1 1.087 ppm2 2.109 ASSI { 16112} (( segid "PROT" and resid 30 and name HD1 )) (( segid "PROT" and resid 30 and name HG1 )) 6 6 0 peak 16112 weight 0.1000E+01 volume 4.54450 ppm1 3.353 ppm2 1.935 ASSI { 16122} (( segid "PROT" and resid 30 and name HD1 )) (( segid "PROT" and resid 30 and name HG2 )) 6 6 0 peak 16122 weight 0.1000E+01 volume 4.48880 ppm1 3.359 ppm2 1.101 ASSI { 16132} (( segid "PROT" and resid 30 and name HG2 )) (( segid "PROT" and resid 30 and name HG1 )) 6 6 0 peak 16132 weight 0.1000E+01 volume 4.63600 ppm1 1.090 ppm2 1.921 ASSI { 16142} (( segid "PROT" and resid 30 and name HB1 )) (( segid "PROT" and resid 30 and name HG1 )) 6 6 0 peak 16142 weight 0.1000E+01 volume 2.41350 ppm1 2.118 ppm2 1.913 ASSI { 16152} (( segid "PROT" and resid 30 and name HG1 )) (( segid "PROT" and resid 30 and name HA )) 6 6 0 peak 16152 weight 0.1000E+01 volume 1.11330 ppm1 1.935 ppm2 5.035 ASSI { 16162} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 30 and name HA )) 6 6 0 peak 16162 weight 0.1000E+01 volume 0.77360 ppm1 0.828 ppm2 5.034 ASSI { 16172} (( segid "PROT" and resid 74 and name HG2 )) (( segid "PROT" and resid 74 and name HD2 )) 6 6 0 peak 16172 weight 0.1000E+01 volume 5.88790 ppm1 1.403 ppm2 2.752 ASSI { 16182} (( segid "PROT" and resid 74 and name HB1 )) (( segid "PROT" and resid 74 and name HD2 )) 6 6 0 peak 16182 weight 0.1000E+01 volume 9.21050 ppm1 1.782 ppm2 2.752 ASSI { 16202} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 74 and name HD2 )) 6 6 0 peak 16202 weight 0.1000E+01 volume 3.35460 ppm1 0.269 ppm2 2.754 ASSI { 16212} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 74 and name HD2 )) 6 6 0 peak 16212 weight 0.1000E+01 volume 1.64530 ppm1 0.354 ppm2 2.758 ASSI { 16222} (( segid "PROT" and resid 74 and name HD1 )) (( segid "PROT" and resid 74 and name HD2 )) 6 6 0 peak 16222 weight 0.1000E+01 volume 7.99660 ppm1 3.756 ppm2 2.760 ASSI { 16232} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 74 and name HD2 )) 6 6 0 peak 16232 weight 0.1000E+01 volume 5.61980 ppm1 4.617 ppm2 2.754 ASSI { 16242} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 74 and name HD1 )) 6 6 0 peak 16242 weight 0.1000E+01 volume 4.49700 ppm1 4.618 ppm2 3.752 ASSI { 16252} (( segid "PROT" and resid 115 and name HB2 )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 16252 weight 0.1000E+01 volume 6.37780 ppm1 1.862 ppm2 3.511 ASSI { 16262} (( segid "PROT" and resid 74 and name HB1 )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 16262 weight 0.1000E+01 volume 8.38330 ppm1 1.851 ppm2 3.759 ASSI { 16272} (( segid "PROT" and resid 74 and name HG2 )) (( segid "PROT" and resid 74 and name HD1 )) 6 6 0 peak 16272 weight 0.1000E+01 volume 2.44050 ppm1 1.409 ppm2 3.749 ASSI { 16282} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 74 and name HD1 )) 6 6 0 peak 16282 weight 0.1000E+01 volume 0.93320 ppm1 0.358 ppm2 3.753 ASSI { 16292} (( segid "PROT" and resid 30 and name HG2 )) (( segid "PROT" and resid 30 and name HD1 )) 6 6 0 peak 16292 weight 0.1000E+01 volume 6.45090 ppm1 1.093 ppm2 3.346 ASSI { 16302} (( segid "PROT" and resid 30 and name HG1 )) (( segid "PROT" and resid 30 and name HD1 )) 6 6 0 peak 16302 weight 0.1000E+01 volume 5.21410 ppm1 1.925 ppm2 3.342 ASSI { 16312} (( segid "PROT" and resid 30 and name HB1 )) (( segid "PROT" and resid 30 and name HD1 )) 6 6 0 peak 16312 weight 0.1000E+01 volume 4.12720 ppm1 2.118 ppm2 3.342 ASSI { 16322} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 36 and name HD1 )) 6 6 0 peak 16322 weight 0.1000E+01 volume 4.09370 ppm1 0.828 ppm2 3.198 ASSI { 16332} (( segid "PROT" and resid 33 and name HD2# )) (( segid "PROT" and resid 36 and name HD2 )) 6 6 0 peak 16332 weight 0.1000E+01 volume 6.73960 ppm1 0.824 ppm2 3.051 ASSI { 16342} (( segid "PROT" and resid 36 and name HG2 )) (( segid "PROT" and resid 36 and name HD2 )) 6 6 0 peak 16342 weight 0.1000E+01 volume 5.19840 ppm1 1.331 ppm2 3.043 ASSI { 16352} (( segid "PROT" and resid 36 and name HG2 )) (( segid "PROT" and resid 36 and name HD1 )) 6 6 0 peak 16352 weight 0.1000E+01 volume 7.52380 ppm1 1.326 ppm2 3.192 ASSI { 16362} (( segid "PROT" and resid 36 and name HG1 )) (( segid "PROT" and resid 36 and name HD2 )) 6 6 0 peak 16362 weight 0.1000E+01 volume 13.71250 ppm1 2.162 ppm2 3.045 ASSI { 16372} (( segid "PROT" and resid 36 and name HG1 )) (( segid "PROT" and resid 36 and name HD1 )) 6 6 0 peak 16372 weight 0.1000E+01 volume 10.47830 ppm1 2.163 ppm2 3.184 ASSI { 16382} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 36 and name HD2 )) 6 6 0 peak 16382 weight 0.1000E+01 volume 11.57690 ppm1 3.926 ppm2 3.047 ASSI { 16392} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 36 and name HD1 )) 6 6 0 peak 16392 weight 0.1000E+01 volume 7.55160 ppm1 3.929 ppm2 3.186 ASSI { 16402} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 36 and name HD1 )) 6 6 0 peak 16402 weight 0.1000E+01 volume 3.80130 ppm1 6.609 ppm2 3.196 ASSI { 16412} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 36 and name HD2 )) 6 6 0 peak 16412 weight 0.1000E+01 volume 2.14990 ppm1 6.609 ppm2 3.055 ASSI { 16422} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 56 and name HA )) 6 6 0 peak 16422 weight 0.1000E+01 volume 14.82330 ppm1 2.442 ppm2 4.137 ASSI { 16432} (( segid "PROT" and resid 38 and name HB1 )) (( segid "PROT" and resid 38 and name HA )) 6 6 0 peak 16432 weight 0.1000E+01 volume 9.90200 ppm1 2.287 ppm2 4.136 ASSI { 16442} (( segid "PROT" and resid 38 and name HB2 )) (( segid "PROT" and resid 38 and name HA )) 6 6 0 peak 16442 weight 0.1000E+01 volume 11.10740 ppm1 1.646 ppm2 4.138 ASSI { 16452} (( segid "PROT" and resid 56 and name HD2 )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 16452 weight 0.1000E+01 volume 1.35720 ppm1 3.444 ppm2 2.433 ASSI { 16462} (( segid "PROT" and resid 56 and name HA )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 16462 weight 0.1000E+01 volume 9.14060 ppm1 4.129 ppm2 2.438 ASSI { 16472} (( segid "PROT" and resid 50 and name HE1 )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 16472 weight 0.1000E+01 volume 6.23850 ppm1 7.399 ppm2 2.434 ASSI { 16482} (( segid "PROT" and resid 56 and name HB2 )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 16482 weight 0.1000E+01 volume 36.27780 ppm1 2.142 ppm2 2.438 ASSI { 16492} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 56 and name HB2 )) 6 6 0 peak 16492 weight 0.1000E+01 volume 2.62390 ppm1 0.607 ppm2 2.139 ASSI { 16502} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 16502 weight 0.1000E+01 volume 13.05560 ppm1 3.692 ppm2 2.136 ASSI { 16512} (( segid "PROT" and resid 56 and name HA )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 16512 weight 0.1000E+01 volume 10.23800 ppm1 4.126 ppm2 2.134 ASSI { 16522} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 16522 weight 0.1000E+01 volume 18.30460 ppm1 2.435 ppm2 2.150 ASSI { 16532} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 16532 weight 0.1000E+01 volume 8.16230 ppm1 2.435 ppm2 1.970 ASSI { 16542} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 16542 weight 0.1000E+01 volume 3.21790 ppm1 0.605 ppm2 2.128 ASSI { 16552} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 16552 weight 0.1000E+01 volume 7.56960 ppm1 0.612 ppm2 1.977 ASSI { 16562} (( segid "PROT" and resid 56 and name HA )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 16562 weight 0.1000E+01 volume 1.29370 ppm1 4.125 ppm2 3.696 ASSI { 16572} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 16572 weight 0.1000E+01 volume 2.82740 ppm1 2.440 ppm2 3.701 ASSI { 16582} (( segid "PROT" and resid 38 and name HD2 )) (( segid "PROT" and resid 37 and name HA )) 6 6 0 peak 16582 weight 0.1000E+01 volume 6.67710 ppm1 3.463 ppm2 4.918 ASSI { 16592} (( segid "PROT" and resid 38 and name HD1 )) (( segid "PROT" and resid 37 and name HA )) 6 6 0 peak 16592 weight 0.1000E+01 volume 10.47530 ppm1 3.692 ppm2 4.912 ASSI { 16602} (( segid "PROT" and resid 37 and name HB1 )) (( segid "PROT" and resid 37 and name HA )) 6 6 0 peak 16602 weight 0.1000E+01 volume 2.76060 ppm1 2.248 ppm2 4.922 ASSI { 16612} (( segid "PROT" and resid 58 and name HB2 )) (( segid "PROT" and resid 58 and name HA )) 6 6 0 peak 16612 weight 0.1000E+01 volume 3.26540 ppm1 2.294 ppm2 4.861 ASSI { 16622} (( segid "PROT" and resid 37 and name HG2 )) (( segid "PROT" and resid 37 and name HA )) 6 6 0 peak 16622 weight 0.1000E+01 volume 5.14380 ppm1 2.171 ppm2 4.921 ASSI { 16632} (( segid "PROT" and resid 38 and name HG1 )) (( segid "PROT" and resid 37 and name HA )) 6 6 0 peak 16632 weight 0.1000E+01 volume 2.11280 ppm1 1.955 ppm2 4.921 ASSI { 16642} (( segid "PROT" and resid 37 and name HB2 )) (( segid "PROT" and resid 37 and name HA )) 6 6 0 peak 16642 weight 0.1000E+01 volume 4.35230 ppm1 1.777 ppm2 4.916 ASSI { 16652} (( segid "PROT" and resid 74 and name HD1 )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 16652 weight 0.1000E+01 volume 2.38830 ppm1 3.762 ppm2 4.616 ASSI { 16662} (( segid "PROT" and resid 73 and name HB1 )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 16662 weight 0.1000E+01 volume 1.91720 ppm1 2.187 ppm2 4.613 ASSI { 16672} (( segid "PROT" and resid 74 and name HG1 )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 16672 weight 0.1000E+01 volume 2.45760 ppm1 1.790 ppm2 4.615 ASSI { 16682} (( segid "PROT" and resid 73 and name HB2 )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 16682 weight 0.1000E+01 volume 1.93650 ppm1 1.528 ppm2 4.616 ASSI { 16692} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 16692 weight 0.1000E+01 volume 1.31520 ppm1 0.353 ppm2 4.615 ASSI { 16702} (( segid "PROT" and resid 32 and name HB2 )) (( segid "PROT" and resid 32 and name HB1 )) 6 6 0 peak 16702 weight 0.1000E+01 volume 9.41770 ppm1 3.664 ppm2 4.389 ASSI { 16712} (( segid "PROT" and resid 32 and name HB1 )) (( segid "PROT" and resid 32 and name HB2 )) 6 6 0 peak 16712 weight 0.1000E+01 volume 17.04300 ppm1 4.375 ppm2 3.662 ASSI { 16722} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 74 and name HB1 )) 6 6 0 peak 16722 weight 0.1000E+01 volume 3.50330 ppm1 0.504 ppm2 1.787 ASSI { 16732} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 74 and name HB1 )) 6 6 0 peak 16732 weight 0.1000E+01 volume 5.18340 ppm1 0.611 ppm2 1.784 ASSI { 16742} (( segid "PROT" and resid 74 and name HG2 )) (( segid "PROT" and resid 74 and name HB1 )) 6 6 0 peak 16742 weight 0.1000E+01 volume 9.20440 ppm1 1.404 ppm2 1.813 ASSI { 16752} (( segid "PROT" and resid 74 and name HA )) (( segid "PROT" and resid 74 and name HB1 )) 6 6 0 peak 16752 weight 0.1000E+01 volume 17.12010 ppm1 3.774 ppm2 1.781 ASSI { 16762} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 74 and name HG1 )) 6 6 0 peak 16762 weight 0.1000E+01 volume 2.64450 ppm1 4.620 ppm2 1.794 ASSI { 16772} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 74 and name HG2 )) 6 6 0 peak 16772 weight 0.1000E+01 volume 1.07560 ppm1 4.627 ppm2 1.410 ASSI { 16782} (( segid "PROT" and resid 74 and name HG2 )) (( segid "PROT" and resid 74 and name HG1 )) 6 6 0 peak 16782 weight 0.1000E+01 volume 14.40480 ppm1 1.408 ppm2 1.782 ASSI { 16792} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 74 and name HG1 )) 6 6 0 peak 16792 weight 0.1000E+01 volume 2.72080 ppm1 0.356 ppm2 1.782 ASSI { 16802} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 74 and name HG1 )) 6 6 0 peak 16802 weight 0.1000E+01 volume 4.91690 ppm1 0.265 ppm2 1.781 ASSI { 16812} (( segid "PROT" and resid 118 and name HB1 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 16812 weight 0.1000E+01 volume 9.89130 ppm1 2.169 ppm2 4.268 ASSI { 16822} (( segid "PROT" and resid 115 and name HB2 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 16822 weight 0.1000E+01 volume 16.17580 ppm1 1.856 ppm2 4.263 ASSI { 16832} (( segid "PROT" and resid 115 and name HG1 )) (( segid "PROT" and resid 115 and name HB2 )) 6 6 0 peak 16832 weight 0.1000E+01 volume 59.42840 ppm1 2.044 ppm2 1.857 ASSI { 16842} (( segid "PROT" and resid 41 and name HB1 )) (( segid "PROT" and resid 41 and name HA )) 6 6 0 peak 16842 weight 0.1000E+01 volume 9.19640 ppm1 2.313 ppm2 3.617 ASSI { 16852} (( segid "PROT" and resid 41 and name HG1 )) (( segid "PROT" and resid 41 and name HA )) 6 6 0 peak 16852 weight 0.1000E+01 volume 5.84680 ppm1 1.581 ppm2 3.615 ASSI { 16862} (( segid "PROT" and resid 44 and name HD1# )) (( segid "PROT" and resid 41 and name HA )) 6 6 0 peak 16862 weight 0.1000E+01 volume 2.71840 ppm1 0.748 ppm2 3.617 ASSI { 16872} (( segid "PROT" and resid 84 and name HA )) (( segid "PROT" and resid 84 and name HG1 )) 6 6 0 peak 16872 weight 0.1000E+01 volume 2.41120 ppm1 3.650 ppm2 2.576 ASSI { 16882} (( segid "PROT" and resid 84 and name HA )) (( segid "PROT" and resid 84 and name HG2 )) 6 6 0 peak 16882 weight 0.1000E+01 volume 0.52020 ppm1 3.644 ppm2 1.822 ASSI { 16892} (( segid "PROT" and resid 84 and name HG2 )) (( segid "PROT" and resid 84 and name HG1 )) 6 6 0 peak 16892 weight 0.1000E+01 volume 5.18220 ppm1 1.833 ppm2 2.576 ASSI { 16902} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 84 and name HG1 )) 6 6 0 peak 16902 weight 0.1000E+01 volume 2.73720 ppm1 1.247 ppm2 2.576 ASSI { 16912} (( segid "PROT" and resid 46 and name HA )) (( segid "PROT" and resid 47 and name HD1 )) 6 6 0 peak 16912 weight 0.1000E+01 volume 4.77650 ppm1 4.878 ppm2 3.729 ASSI { 16922} (( segid "PROT" and resid 46 and name HA )) (( segid "PROT" and resid 47 and name HD2 )) 6 6 0 peak 16922 weight 0.1000E+01 volume 5.04890 ppm1 4.875 ppm2 3.279 ASSI { 16932} (( segid "PROT" and resid 47 and name HD2 )) (( segid "PROT" and resid 47 and name HD1 )) 6 6 0 peak 16932 weight 0.1000E+01 volume 9.71400 ppm1 3.277 ppm2 3.727 ASSI { 16942} (( segid "PROT" and resid 47 and name HD1 )) (( segid "PROT" and resid 47 and name HD2 )) 6 6 0 peak 16942 weight 0.1000E+01 volume 6.26980 ppm1 3.739 ppm2 3.278 ASSI { 16952} (( segid "PROT" and resid 47 and name HD1 )) (( segid "PROT" and resid 47 and name HG1 )) 6 6 0 peak 16952 weight 0.1000E+01 volume 7.39320 ppm1 3.721 ppm2 1.930 ASSI { 16962} (( segid "PROT" and resid 47 and name HD2 )) (( segid "PROT" and resid 47 and name HG1 )) 6 6 0 peak 16962 weight 0.1000E+01 volume 10.90380 ppm1 3.280 ppm2 1.928 ASSI { 16972} (( segid "PROT" and resid 47 and name HB1 )) (( segid "PROT" and resid 47 and name HG1 )) 6 6 0 peak 16972 weight 0.1000E+01 volume 20.93210 ppm1 2.211 ppm2 1.910 ASSI { 16982} (( segid "PROT" and resid 46 and name HA )) (( segid "PROT" and resid 47 and name HG1 )) 6 6 0 peak 16982 weight 0.1000E+01 volume 1.94800 ppm1 4.883 ppm2 1.926 ASSI { 16992} (( segid "PROT" and resid 47 and name HA )) (( segid "PROT" and resid 47 and name HG1 )) 6 6 0 peak 16992 weight 0.1000E+01 volume 1.97350 ppm1 4.062 ppm2 1.925 ASSI { 17002} (( segid "PROT" and resid 41 and name HG2 )) (( segid "PROT" and resid 41 and name HA )) 6 6 0 peak 17002 weight 0.1000E+01 volume 1.48170 ppm1 1.096 ppm2 3.617 ASSI { 17012} (( segid "PROT" and resid 41 and name HB2 )) (( segid "PROT" and resid 41 and name HA )) 6 6 0 peak 17012 weight 0.1000E+01 volume 3.91010 ppm1 1.728 ppm2 3.615 ASSI { 17022} (( segid "PROT" and resid 47 and name HA )) (( segid "PROT" and resid 47 and name HB1 )) 6 6 0 peak 17022 weight 0.1000E+01 volume 6.07040 ppm1 4.060 ppm2 2.198 ASSI { 17032} (( segid "PROT" and resid 47 and name HD2 )) (( segid "PROT" and resid 47 and name HA )) 6 6 0 peak 17032 weight 0.1000E+01 volume 1.05340 ppm1 3.279 ppm2 4.057 ASSI { 17042} (( segid "PROT" and resid 47 and name HD1 )) (( segid "PROT" and resid 47 and name HA )) 6 6 0 peak 17042 weight 0.1000E+01 volume 1.70100 ppm1 3.733 ppm2 4.051 ASSI { 17052} (( segid "PROT" and resid 47 and name HD2 )) (( segid "PROT" and resid 47 and name HB1 )) 6 6 0 peak 17052 weight 0.1000E+01 volume 1.21460 ppm1 3.273 ppm2 2.220 ASSI { 17062} (( segid "PROT" and resid 47 and name HD2 )) (( segid "PROT" and resid 47 and name HB2 )) 6 6 0 peak 17062 weight 0.1000E+01 volume 1.23610 ppm1 3.279 ppm2 2.029 ASSI { 17072} (( segid "PROT" and resid 74 and name HD1 )) (( segid "PROT" and resid 73 and name HB1 )) 6 6 0 peak 17072 weight 0.1000E+01 volume 5.72490 ppm1 3.750 ppm2 2.187 ASSI { 17082} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 56 and name HA )) 6 6 0 peak 17082 weight 0.1000E+01 volume 1.52390 ppm1 6.149 ppm2 4.131 ASSI { 17092} (( segid "PROT" and resid 41 and name HG2 )) (( segid "PROT" and resid 41 and name HD1 )) 6 6 0 peak 17092 weight 0.1000E+01 volume 3.89150 ppm1 1.093 ppm2 3.775 ASSI { 17102} (( segid "PROT" and resid 41 and name HB2 )) (( segid "PROT" and resid 41 and name HD1 )) 6 6 0 peak 17102 weight 0.1000E+01 volume 3.64640 ppm1 1.738 ppm2 3.776 ASSI { 17112} (( segid "PROT" and resid 41 and name HB1 )) (( segid "PROT" and resid 41 and name HD1 )) 6 6 0 peak 17112 weight 0.1000E+01 volume 1.80510 ppm1 2.376 ppm2 3.777 ASSI { 17122} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 17122 weight 0.1000E+01 volume 2.57710 ppm1 5.086 ppm2 1.571 ASSI { 17132} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17132 weight 0.1000E+01 volume 1.89500 ppm1 5.086 ppm2 1.092 ASSI { 17142} (( segid "PROT" and resid 50 and name HD1 )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17142 weight 0.1000E+01 volume 3.98000 ppm1 7.401 ppm2 1.094 ASSI { 17152} (( segid "PROT" and resid 50 and name HD1 )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 17152 weight 0.1000E+01 volume 4.74140 ppm1 7.405 ppm2 1.583 ASSI { 17162} (( segid "PROT" and resid 41 and name HD1 )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17162 weight 0.1000E+01 volume 4.16480 ppm1 3.794 ppm2 1.090 ASSI { 17172} (( segid "PROT" and resid 41 and name HD2 )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17172 weight 0.1000E+01 volume 5.28190 ppm1 3.738 ppm2 1.094 ASSI { 17182} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17182 weight 0.1000E+01 volume 5.31370 ppm1 3.607 ppm2 1.096 ASSI { 17192} (( segid "PROT" and resid 41 and name HD1 )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 17192 weight 0.1000E+01 volume 6.90500 ppm1 3.794 ppm2 1.573 ASSI { 17202} (( segid "PROT" and resid 41 and name HD2 )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 17202 weight 0.1000E+01 volume 1.89620 ppm1 3.732 ppm2 1.576 ASSI { 17212} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 17212 weight 0.1000E+01 volume 10.38410 ppm1 3.660 ppm2 1.567 ASSI { 17222} (( segid "PROT" and resid 41 and name HB2 )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17222 weight 0.1000E+01 volume 11.06060 ppm1 1.729 ppm2 1.100 ASSI { 17232} (( segid "PROT" and resid 41 and name HB1 )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17232 weight 0.1000E+01 volume 6.59890 ppm1 2.314 ppm2 1.090 ASSI { 17242} (( segid "PROT" and resid 41 and name HB1 )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 17242 weight 0.1000E+01 volume 9.82510 ppm1 2.317 ppm2 1.579 ASSI { 17252} (( segid "PROT" and resid 104 and name HB2 )) (( segid "PROT" and resid 104 and name HD2 )) 6 6 0 peak 17252 weight 0.1000E+01 volume 56.29830 ppm1 2.011 ppm2 1.640 ASSI { 17262} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 17262 weight 0.1000E+01 volume 5.45420 ppm1 -0.367 ppm2 1.094 ASSI { 17272} (( segid "PROT" and resid 37 and name HA )) (( segid "PROT" and resid 37 and name HG1 )) 6 6 0 peak 17272 weight 0.1000E+01 volume 4.06570 ppm1 4.922 ppm2 2.244 ASSI { 17282} (( segid "PROT" and resid 37 and name HA )) (( segid "PROT" and resid 37 and name HG2 )) 6 6 0 peak 17282 weight 0.1000E+01 volume 5.39540 ppm1 4.919 ppm2 2.129 ASSI { 17292} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 41 and name HB2 )) 6 6 0 peak 17292 weight 0.1000E+01 volume 1.37820 ppm1 -0.367 ppm2 1.730 ASSI { 17302} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 41 and name HB1 )) 6 6 0 peak 17302 weight 0.1000E+01 volume 1.23640 ppm1 -0.369 ppm2 2.310 ASSI { 17312} (( segid "PROT" and resid 41 and name HG2 )) (( segid "PROT" and resid 41 and name HB1 )) 6 6 0 peak 17312 weight 0.1000E+01 volume 3.83360 ppm1 1.094 ppm2 2.310 ASSI { 17322} (( segid "PROT" and resid 41 and name HG1 )) (( segid "PROT" and resid 41 and name HB1 )) 6 6 0 peak 17322 weight 0.1000E+01 volume 4.65300 ppm1 1.580 ppm2 2.316 ASSI { 17332} (( segid "PROT" and resid 41 and name HB2 )) (( segid "PROT" and resid 41 and name HB1 )) 6 6 0 peak 17332 weight 0.1000E+01 volume 11.12780 ppm1 1.730 ppm2 2.314 ASSI { 17342} (( segid "PROT" and resid 41 and name HB1 )) (( segid "PROT" and resid 41 and name HB2 )) 6 6 0 peak 17342 weight 0.1000E+01 volume 18.49560 ppm1 2.314 ppm2 1.736 ASSI { 17352} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 41 and name HB2 )) 6 6 0 peak 17352 weight 0.1000E+01 volume 5.05100 ppm1 3.615 ppm2 1.730 ASSI { 17362} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 41 and name HB1 )) 6 6 0 peak 17362 weight 0.1000E+01 volume 10.29990 ppm1 3.619 ppm2 2.314 ASSI { 17372} (( segid "PROT" and resid 41 and name HD1 )) (( segid "PROT" and resid 41 and name HB2 )) 6 6 0 peak 17372 weight 0.1000E+01 volume 2.06170 ppm1 3.790 ppm2 1.732 ASSI { 17382} (( segid "PROT" and resid 41 and name HD1 )) (( segid "PROT" and resid 41 and name HB1 )) 6 6 0 peak 17382 weight 0.1000E+01 volume 1.35260 ppm1 3.798 ppm2 2.308 ASSI { 17392} (( segid "PROT" and resid 47 and name HA )) (( segid "PROT" and resid 41 and name HB2 )) 6 6 0 peak 17392 weight 0.1000E+01 volume 4.77730 ppm1 4.057 ppm2 1.731 ASSI { 17402} (( segid "PROT" and resid 47 and name HA )) (( segid "PROT" and resid 41 and name HB1 )) 6 6 0 peak 17402 weight 0.1000E+01 volume 5.26670 ppm1 4.061 ppm2 2.318 ASSI { 17412} (( segid "PROT" and resid 41 and name HG2 )) (( segid "PROT" and resid 41 and name HB2 )) 6 6 0 peak 17412 weight 0.1000E+01 volume 5.60800 ppm1 1.094 ppm2 1.722 ASSI { 17422} (( segid "PROT" and resid 34 and name HB1 )) (( segid "PROT" and resid 34 and name HA )) 6 6 0 peak 17422 weight 0.1000E+01 volume 12.27610 ppm1 2.100 ppm2 4.354 ASSI { 17432} (( segid "PROT" and resid 34 and name HG1 )) (( segid "PROT" and resid 34 and name HA )) 6 6 0 peak 17432 weight 0.1000E+01 volume 6.16710 ppm1 1.966 ppm2 4.359 ASSI { 17442} (( segid "PROT" and resid 34 and name HB2 )) (( segid "PROT" and resid 34 and name HA )) 6 6 0 peak 17442 weight 0.1000E+01 volume 17.09060 ppm1 0.607 ppm2 4.356 ASSI { 17452} (( segid "PROT" and resid 36 and name HB2 )) (( segid "PROT" and resid 36 and name HD1 )) 6 6 0 peak 17452 weight 0.1000E+01 volume 8.90570 ppm1 1.895 ppm2 3.187 ASSI { 17462} (( segid "PROT" and resid 36 and name HB2 )) (( segid "PROT" and resid 36 and name HD2 )) 6 6 0 peak 17462 weight 0.1000E+01 volume 7.50990 ppm1 1.898 ppm2 3.055 ASSI { 17472} (( segid "PROT" and resid 27 and name HG1 )) (( segid "PROT" and resid 27 and name HD1 )) 6 6 0 peak 17472 weight 0.1000E+01 volume 56.64050 ppm1 1.692 ppm2 3.172 ASSI { 17482} (( segid "PROT" and resid 36 and name HD2 )) (( segid "PROT" and resid 36 and name HG2 )) 6 6 0 peak 17482 weight 0.1000E+01 volume 2.36150 ppm1 3.049 ppm2 1.325 ASSI { 17492} (( segid "PROT" and resid 36 and name HD1 )) (( segid "PROT" and resid 36 and name HG2 )) 6 6 0 peak 17492 weight 0.1000E+01 volume 2.16130 ppm1 3.203 ppm2 1.317 ASSI { 17502} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 36 and name HG2 )) 6 6 0 peak 17502 weight 0.1000E+01 volume 6.36130 ppm1 3.931 ppm2 1.313 ASSI { 17512} (( segid "PROT" and resid 36 and name HD2 )) (( segid "PROT" and resid 36 and name HG1 )) 6 6 0 peak 17512 weight 0.1000E+01 volume 0.80000 ppm1 3.053 ppm2 2.191 ASSI { 17522} (( segid "PROT" and resid 36 and name HD1 )) (( segid "PROT" and resid 36 and name HG1 )) 6 6 0 peak 17522 weight 0.1000E+01 volume 1.62010 ppm1 3.208 ppm2 2.193 ASSI { 17532} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 36 and name HG2 )) 6 6 0 peak 17532 weight 0.1000E+01 volume 2.30670 ppm1 6.607 ppm2 1.329 ASSI { 17542} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 36 and name HG1 )) 6 6 0 peak 17542 weight 0.1000E+01 volume 2.32450 ppm1 6.606 ppm2 2.189 ASSI { 17552} (( segid "PROT" and resid 36 and name HG2 )) (( segid "PROT" and resid 36 and name HG1 )) 6 6 0 peak 17552 weight 0.1000E+01 volume 5.87220 ppm1 1.326 ppm2 2.173 ASSI { 17562} (( segid "PROT" and resid 36 and name HG1 )) (( segid "PROT" and resid 36 and name HG2 )) 6 6 0 peak 17562 weight 0.1000E+01 volume 16.35440 ppm1 2.178 ppm2 1.332 ASSI { 17572} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 36 and name HG2 )) 6 6 0 peak 17572 weight 0.1000E+01 volume 2.40330 ppm1 0.236 ppm2 1.325 ASSI { 17582} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 36 and name HB1 )) 6 6 0 peak 17582 weight 0.1000E+01 volume 1.13810 ppm1 6.611 ppm2 2.140 ASSI { 17592} (( segid "PROT" and resid 64 and name HG2 )) (( segid "PROT" and resid 61 and name HA )) 6 6 0 peak 17592 weight 0.1000E+01 volume 2.37220 ppm1 1.504 ppm2 3.886 ASSI { 17602} (( segid "PROT" and resid 64 and name HB2 )) (( segid "PROT" and resid 61 and name HA )) 6 6 0 peak 17602 weight 0.1000E+01 volume 5.70760 ppm1 1.937 ppm2 3.883 ASSI { 17612} (( segid "PROT" and resid 64 and name HB1 )) (( segid "PROT" and resid 61 and name HA )) 6 6 0 peak 17612 weight 0.1000E+01 volume 13.44640 ppm1 2.000 ppm2 3.880 ASSI { 17632} (( segid "PROT" and resid 100 and name HB1 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17632 weight 0.1000E+01 volume 10.83470 ppm1 2.032 ppm2 3.649 ASSI { 17642} (( segid "PROT" and resid 100 and name HD1 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17642 weight 0.1000E+01 volume 2.57750 ppm1 1.711 ppm2 3.644 ASSI { 17652} (( segid "PROT" and resid 97 and name HB1 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17652 weight 0.1000E+01 volume 15.48820 ppm1 1.607 ppm2 3.639 ASSI { 17662} (( segid "PROT" and resid 99 and name HB1 )) (( segid "PROT" and resid 99 and name HA )) 6 6 0 peak 17662 weight 0.1000E+01 volume 4.50190 ppm1 3.408 ppm2 3.786 ASSI { 17672} (( segid "PROT" and resid 102 and name HB1 )) (( segid "PROT" and resid 99 and name HA )) 6 6 0 peak 17672 weight 0.1000E+01 volume 3.56590 ppm1 3.044 ppm2 3.786 ASSI { 17682} (( segid "PROT" and resid 99 and name HB2 )) (( segid "PROT" and resid 99 and name HA )) 6 6 0 peak 17682 weight 0.1000E+01 volume 5.89420 ppm1 2.601 ppm2 3.783 ASSI { 17692} (( segid "PROT" and resid 97 and name HB2 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17692 weight 0.1000E+01 volume 4.53180 ppm1 1.337 ppm2 3.649 ASSI { 17702} (( segid "PROT" and resid 97 and name HG1 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17702 weight 0.1000E+01 volume 9.80990 ppm1 1.012 ppm2 3.654 ASSI { 17712} (( segid "PROT" and resid 97 and name HG2 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17712 weight 0.1000E+01 volume 4.75380 ppm1 0.688 ppm2 3.644 ASSI { 17722} (( segid "PROT" and resid 100 and name HE1 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17722 weight 0.1000E+01 volume 1.00880 ppm1 2.923 ppm2 3.644 ASSI { 17732} (( segid "PROT" and resid 97 and name HD1 )) (( segid "PROT" and resid 97 and name HA )) 6 6 0 peak 17732 weight 0.1000E+01 volume 2.75120 ppm1 3.010 ppm2 3.646 ASSI { 17742} (( segid "PROT" and resid 38 and name HA )) (( segid "PROT" and resid 38 and name HB2 )) 6 6 0 peak 17742 weight 0.1000E+01 volume 7.73670 ppm1 4.138 ppm2 1.647 ASSI { 17752} (( segid "PROT" and resid 38 and name HB1 )) (( segid "PROT" and resid 38 and name HB2 )) 6 6 0 peak 17752 weight 0.1000E+01 volume 11.83520 ppm1 2.283 ppm2 1.646 ASSI { 17762} (( segid "PROT" and resid 38 and name HB2 )) (( segid "PROT" and resid 38 and name HG1 )) 6 6 0 peak 17762 weight 0.1000E+01 volume 21.90050 ppm1 1.645 ppm2 1.943 ASSI { 17772} (( segid "PROT" and resid 56 and name HA )) (( segid "PROT" and resid 56 and name HG2 )) 6 6 0 peak 17772 weight 0.1000E+01 volume 12.67570 ppm1 4.132 ppm2 1.989 ASSI { 17782} (( segid "PROT" and resid 37 and name HB2 )) (( segid "PROT" and resid 38 and name HD1 )) 6 6 0 peak 17782 weight 0.1000E+01 volume 3.18680 ppm1 1.781 ppm2 3.706 ASSI { 17792} (( segid "PROT" and resid 37 and name HB2 )) (( segid "PROT" and resid 38 and name HD2 )) 6 6 0 peak 17792 weight 0.1000E+01 volume 2.40110 ppm1 1.774 ppm2 3.466 ASSI { 17802} (( segid "PROT" and resid 37 and name HA )) (( segid "PROT" and resid 37 and name HB1 )) 6 6 0 peak 17802 weight 0.1000E+01 volume 5.85720 ppm1 4.924 ppm2 2.196 ASSI { 17812} (( segid "PROT" and resid 37 and name HA )) (( segid "PROT" and resid 37 and name HB2 )) 6 6 0 peak 17812 weight 0.1000E+01 volume 13.41060 ppm1 4.922 ppm2 1.784 ASSI { 17822} (( segid "PROT" and resid 37 and name HB2 )) (( segid "PROT" and resid 37 and name HG2 )) 6 6 0 peak 17822 weight 0.1000E+01 volume 31.76600 ppm1 1.778 ppm2 2.135 ASSI { 17832} (( segid "PROT" and resid 37 and name HB2 )) (( segid "PROT" and resid 37 and name HG1 )) 6 6 0 peak 17832 weight 0.1000E+01 volume 22.19600 ppm1 1.772 ppm2 2.256 ASSI { 17842} (( segid "PROT" and resid 38 and name HD1 )) (( segid "PROT" and resid 37 and name HB2 )) 6 6 0 peak 17842 weight 0.1000E+01 volume 2.26550 ppm1 3.691 ppm2 1.774 ASSI { 17852} (( segid "PROT" and resid 38 and name HD2 )) (( segid "PROT" and resid 37 and name HB2 )) 6 6 0 peak 17852 weight 0.1000E+01 volume 5.47430 ppm1 3.465 ppm2 1.774 ASSI { 17862} (( segid "PROT" and resid 37 and name HB2 )) (( segid "PROT" and resid 37 and name HB1 )) 6 6 0 peak 17862 weight 0.1000E+01 volume 27.24420 ppm1 1.772 ppm2 2.190 ASSI { 17872} (( segid "PROT" and resid 37 and name HB1 )) (( segid "PROT" and resid 37 and name HB2 )) 6 6 0 peak 17872 weight 0.1000E+01 volume 25.94510 ppm1 2.175 ppm2 1.764 ASSI { 17882} (( segid "PROT" and resid 38 and name HG1 )) (( segid "PROT" and resid 38 and name HB2 )) 6 6 0 peak 17882 weight 0.1000E+01 volume 12.75730 ppm1 1.953 ppm2 1.644 ASSI { 17892} (( segid "PROT" and resid 74 and name HD1 )) (( segid "PROT" and resid 73 and name HB2 )) 6 6 0 peak 17892 weight 0.1000E+01 volume 1.89420 ppm1 3.764 ppm2 1.526 ASSI { 17902} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 73 and name HB2 )) 6 6 0 peak 17902 weight 0.1000E+01 volume 2.45250 ppm1 4.617 ppm2 1.508 ASSI { 17912} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 73 and name HB1 )) 6 6 0 peak 17912 weight 0.1000E+01 volume 4.84880 ppm1 4.640 ppm2 2.170 ASSI { 17922} (( segid "PROT" and resid 32 and name HB2 )) (( segid "PROT" and resid 32 and name HA )) 6 6 0 peak 17922 weight 0.1000E+01 volume 7.95050 ppm1 3.662 ppm2 4.357 ASSI { 17932} (( segid "PROT" and resid 16 and name HB1 )) (( segid "PROT" and resid 16 and name HA )) 6 6 0 peak 17932 weight 0.1000E+01 volume 20.32360 ppm1 2.125 ppm2 3.924 ASSI { 17942} (( segid "PROT" and resid 16 and name HG1 )) (( segid "PROT" and resid 16 and name HA )) 6 6 0 peak 17942 weight 0.1000E+01 volume 6.63050 ppm1 2.486 ppm2 3.921 ASSI { 17962} (( segid "PROT" and resid 16 and name HA )) (( segid "PROT" and resid 16 and name HG2 )) 6 6 0 peak 17962 weight 0.1000E+01 volume 22.52520 ppm1 3.924 ppm2 2.393 ASSI { 17972} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 23 and name HG2 )) 6 6 0 peak 17972 weight 0.1000E+01 volume 5.79820 ppm1 4.438 ppm2 2.120 ASSI { 17982} (( segid "PROT" and resid 118 and name HA )) (( segid "PROT" and resid 118 and name HG1 )) 6 6 0 peak 17982 weight 0.1000E+01 volume 22.91060 ppm1 4.114 ppm2 2.509 ASSI { 17992} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 111 and name HG1 )) 6 6 0 peak 17992 weight 0.1000E+01 volume 2.92810 ppm1 3.642 ppm2 2.526 ASSI { 18002} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 111 and name HG2 )) 6 6 0 peak 18002 weight 0.1000E+01 volume 6.87960 ppm1 3.640 ppm2 2.429 ASSI { 18012} (( segid "PROT" and resid 28 and name HA )) (( segid "PROT" and resid 28 and name HB1 )) 6 6 0 peak 18012 weight 0.1000E+01 volume 11.48280 ppm1 4.120 ppm2 2.095 ASSI { 18022} (( segid "PROT" and resid 118 and name HG1 )) (( segid "PROT" and resid 118 and name HA )) 6 6 0 peak 18022 weight 0.1000E+01 volume 14.64350 ppm1 2.504 ppm2 4.115 ASSI { 18032} (( segid "PROT" and resid 118 and name HG1 )) (( segid "PROT" and resid 118 and name HB2 )) 6 6 0 peak 18032 weight 0.1000E+01 volume 62.44870 ppm1 2.498 ppm2 2.058 ASSI { 18042} (( segid "PROT" and resid 118 and name HG1 )) (( segid "PROT" and resid 118 and name HB1 )) 6 6 0 peak 18042 weight 0.1000E+01 volume 29.20580 ppm1 2.497 ppm2 2.148 ASSI { 18052} (( segid "PROT" and resid 118 and name HA )) (( segid "PROT" and resid 118 and name HB1 )) 6 6 0 peak 18052 weight 0.1000E+01 volume 63.81460 ppm1 4.114 ppm2 2.156 ASSI { 18062} (( segid "PROT" and resid 76 and name HG1 )) (( segid "PROT" and resid 76 and name HA )) 6 6 0 peak 18062 weight 0.1000E+01 volume 7.65310 ppm1 1.895 ppm2 3.882 ASSI { 18072} (( segid "PROT" and resid 76 and name HB1 )) (( segid "PROT" and resid 76 and name HA )) 6 6 0 peak 18072 weight 0.1000E+01 volume 6.05180 ppm1 2.222 ppm2 3.901 ASSI { 18082} (( segid "PROT" and resid 79 and name HB1 )) (( segid "PROT" and resid 76 and name HA )) 6 6 0 peak 18082 weight 0.1000E+01 volume 4.59970 ppm1 2.853 ppm2 3.878 ASSI { 18092} (( segid "PROT" and resid 75 and name HE3 )) (( segid "PROT" and resid 76 and name HA )) 6 6 0 peak 18092 weight 0.1000E+01 volume 0.88170 ppm1 7.545 ppm2 3.883 ASSI { 18102} (( segid "PROT" and resid 76 and name HA )) (( segid "PROT" and resid 76 and name HG1 )) 6 6 0 peak 18102 weight 0.1000E+01 volume 2.69660 ppm1 3.885 ppm2 1.891 ASSI { 18112} (( segid "PROT" and resid 76 and name HA )) (( segid "PROT" and resid 76 and name HG2 )) 6 6 0 peak 18112 weight 0.1000E+01 volume 1.37420 ppm1 3.881 ppm2 1.367 ASSI { 18122} (( segid "PROT" and resid 76 and name HG1 )) (( segid "PROT" and resid 76 and name HG2 )) 6 6 0 peak 18122 weight 0.1000E+01 volume 5.89910 ppm1 1.894 ppm2 1.349 ASSI { 18132} (( segid "PROT" and resid 76 and name HA )) (( segid "PROT" and resid 76 and name HB1 )) 6 6 0 peak 18132 weight 0.1000E+01 volume 3.27690 ppm1 3.884 ppm2 2.199 ASSI { 18142} (( segid "PROT" and resid 76 and name HA )) (( segid "PROT" and resid 76 and name HB2 )) 6 6 0 peak 18142 weight 0.1000E+01 volume 7.47180 ppm1 3.881 ppm2 2.038 ASSI { 18152} (( segid "PROT" and resid 70 and name HB1 )) (( segid "PROT" and resid 70 and name HA )) 6 6 0 peak 18152 weight 0.1000E+01 volume 15.03970 ppm1 1.995 ppm2 3.985 ASSI { 18162} (( segid "PROT" and resid 70 and name HG2 )) (( segid "PROT" and resid 70 and name HA )) 6 6 0 peak 18162 weight 0.1000E+01 volume 19.48060 ppm1 2.204 ppm2 3.975 ASSI { 18172} (( segid "PROT" and resid 70 and name HG1 )) (( segid "PROT" and resid 70 and name HA )) 6 6 0 peak 18172 weight 0.1000E+01 volume 9.95580 ppm1 2.264 ppm2 3.978 ASSI { 18182} (( segid "PROT" and resid 110 and name HA )) (( segid "PROT" and resid 110 and name HB1 )) 6 6 0 peak 18182 weight 0.1000E+01 volume 15.23060 ppm1 4.002 ppm2 2.362 ASSI { 18192} (( segid "PROT" and resid 110 and name HA )) (( segid "PROT" and resid 110 and name HB2 )) 6 6 0 peak 18192 weight 0.1000E+01 volume 10.56080 ppm1 4.003 ppm2 2.152 ASSI { 18202} (( segid "PROT" and resid 110 and name HG2 )) (( segid "PROT" and resid 110 and name HA )) 6 6 0 peak 18202 weight 0.1000E+01 volume 18.70540 ppm1 2.514 ppm2 4.009 ASSI { 18212} (( segid "PROT" and resid 110 and name HB1 )) (( segid "PROT" and resid 110 and name HA )) 6 6 0 peak 18212 weight 0.1000E+01 volume 19.47350 ppm1 2.369 ppm2 4.005 ASSI { 18222} (( segid "PROT" and resid 110 and name HB2 )) (( segid "PROT" and resid 110 and name HA )) 6 6 0 peak 18222 weight 0.1000E+01 volume 27.77700 ppm1 2.162 ppm2 4.002 ASSI { 18232} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 110 and name HA )) 6 6 0 peak 18232 weight 0.1000E+01 volume 22.34960 ppm1 0.720 ppm2 4.000 ASSI { 18242} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 110 and name HG1 )) 6 6 0 peak 18242 weight 0.1000E+01 volume 3.68780 ppm1 4.125 ppm2 2.818 ASSI { 18252} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 18252 weight 0.1000E+01 volume 6.35860 ppm1 4.130 ppm2 2.508 ASSI { 18262} (( segid "PROT" and resid 110 and name HB1 )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 18262 weight 0.1000E+01 volume 43.18070 ppm1 2.370 ppm2 2.515 ASSI { 18272} (( segid "PROT" and resid 110 and name HB2 )) (( segid "PROT" and resid 110 and name HG2 )) 6 6 0 peak 18272 weight 0.1000E+01 volume 22.88310 ppm1 2.167 ppm2 2.517 ASSI { 18282} (( segid "PROT" and resid 82 and name HZ2 )) (( segid "PROT" and resid 110 and name HB1 )) 6 6 0 peak 18282 weight 0.1000E+01 volume 2.41110 ppm1 7.722 ppm2 2.366 ASSI { 18292} (( segid "PROT" and resid 110 and name HG1 )) (( segid "PROT" and resid 110 and name HB1 )) 6 6 0 peak 18292 weight 0.1000E+01 volume 11.20860 ppm1 2.818 ppm2 2.370 ASSI { 18302} (( segid "PROT" and resid 110 and name HG1 )) (( segid "PROT" and resid 110 and name HB2 )) 6 6 0 peak 18302 weight 0.1000E+01 volume 21.48710 ppm1 2.822 ppm2 2.165 ASSI { 18312} (( segid "PROT" and resid 110 and name HG2 )) (( segid "PROT" and resid 110 and name HB1 )) 6 6 0 peak 18312 weight 0.1000E+01 volume 18.80720 ppm1 2.521 ppm2 2.369 ASSI { 18322} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 110 and name HB1 )) 6 6 0 peak 18322 weight 0.1000E+01 volume 2.07810 ppm1 0.719 ppm2 2.365 ASSI { 18332} (( segid "PROT" and resid 23 and name HG1 )) (( segid "PROT" and resid 23 and name HA )) 6 6 0 peak 18332 weight 0.1000E+01 volume 6.05250 ppm1 2.304 ppm2 4.012 ASSI { 18342} (( segid "PROT" and resid 23 and name HG2 )) (( segid "PROT" and resid 23 and name HA )) 6 6 0 peak 18342 weight 0.1000E+01 volume 32.29440 ppm1 2.129 ppm2 4.005 ASSI { 18352} (( segid "PROT" and resid 74 and name HD2 )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 18352 weight 0.1000E+01 volume 2.67010 ppm1 2.753 ppm2 4.613 ASSI { 18362} (( segid "PROT" and resid 75 and name HD1 )) (( segid "PROT" and resid 73 and name HB2 )) 6 6 0 peak 18362 weight 0.1000E+01 volume 0.60740 ppm1 7.470 ppm2 1.529 ASSI { 18372} (( segid "PROT" and resid 73 and name HG1 )) (( segid "PROT" and resid 73 and name HB2 )) 6 6 0 peak 18372 weight 0.1000E+01 volume 3.57450 ppm1 2.438 ppm2 1.519 ASSI { 18382} (( segid "PROT" and resid 73 and name HB2 )) (( segid "PROT" and resid 73 and name HB1 )) 6 6 0 peak 18382 weight 0.1000E+01 volume 15.81760 ppm1 1.545 ppm2 2.177 ASSI { 18392} (( segid "PROT" and resid 73 and name HA )) (( segid "PROT" and resid 73 and name HG2 )) 6 6 0 peak 18392 weight 0.1000E+01 volume 1.35290 ppm1 4.610 ppm2 2.246 ASSI { 18402} (( segid "PROT" and resid 74 and name HD1 )) (( segid "PROT" and resid 73 and name HG1 )) 6 6 0 peak 18402 weight 0.1000E+01 volume 2.30910 ppm1 3.756 ppm2 2.434 ASSI { 18412} (( segid "PROT" and resid 73 and name HG2 )) (( segid "PROT" and resid 73 and name HG1 )) 6 6 0 peak 18412 weight 0.1000E+01 volume 35.38500 ppm1 2.250 ppm2 2.437 ASSI { 18422} (( segid "PROT" and resid 73 and name HG1 )) (( segid "PROT" and resid 73 and name HG2 )) 6 6 0 peak 18422 weight 0.1000E+01 volume 15.89860 ppm1 2.436 ppm2 2.251 ASSI { 18432} (( segid "PROT" and resid 73 and name HB2 )) (( segid "PROT" and resid 73 and name HG1 )) 6 6 0 peak 18432 weight 0.1000E+01 volume 4.76360 ppm1 1.524 ppm2 2.436 ASSI { 18442} (( segid "PROT" and resid 73 and name HB2 )) (( segid "PROT" and resid 73 and name HG2 )) 6 6 0 peak 18442 weight 0.1000E+01 volume 5.65880 ppm1 1.523 ppm2 2.253 ASSI { 18452} (( segid "PROT" and resid 23 and name HA )) (( segid "PROT" and resid 23 and name HG2 )) 6 6 0 peak 18452 weight 0.1000E+01 volume 13.77800 ppm1 4.024 ppm2 2.122 ASSI { 18462} (( segid "PROT" and resid 23 and name HA )) (( segid "PROT" and resid 23 and name HG1 )) 6 6 0 peak 18462 weight 0.1000E+01 volume 9.30000 ppm1 4.021 ppm2 2.313 ASSI { 18472} (( segid "PROT" and resid 23 and name HB2 )) (( segid "PROT" and resid 23 and name HG1 )) 6 6 0 peak 18472 weight 0.1000E+01 volume 10.60880 ppm1 1.985 ppm2 2.318 ASSI { 18482} (( segid "PROT" and resid 23 and name HB2 )) (( segid "PROT" and resid 23 and name HG2 )) 6 6 0 peak 18482 weight 0.1000E+01 volume 15.57740 ppm1 1.982 ppm2 2.117 ASSI { 18492} (( segid "PROT" and resid 23 and name HA )) (( segid "PROT" and resid 23 and name HB1 )) 6 6 0 peak 18492 weight 0.1000E+01 volume 24.64220 ppm1 4.023 ppm2 1.998 ASSI { 18502} (( segid "PROT" and resid 20 and name HA )) (( segid "PROT" and resid 23 and name HB1 )) 6 6 0 peak 18502 weight 0.1000E+01 volume 10.43200 ppm1 4.440 ppm2 2.006 ASSI { 18512} (( segid "PROT" and resid 23 and name HG1 )) (( segid "PROT" and resid 23 and name HB1 )) 6 6 0 peak 18512 weight 0.1000E+01 volume 33.83010 ppm1 2.319 ppm2 2.017 ASSI { 18522} (( segid "PROT" and resid 23 and name HB2 )) (( segid "PROT" and resid 23 and name HA )) 6 6 0 peak 18522 weight 0.1000E+01 volume 8.44580 ppm1 1.976 ppm2 4.026 ASSI { 18532} (( segid "PROT" and resid 23 and name HB1 )) (( segid "PROT" and resid 23 and name HA )) 6 6 0 peak 18532 weight 0.1000E+01 volume 15.77600 ppm1 2.043 ppm2 4.027 ASSI { 18542} (( segid "PROT" and resid 107 and name HA )) (( segid "PROT" and resid 107 and name HB1 )) 6 6 0 peak 18542 weight 0.1000E+01 volume 24.40720 ppm1 4.135 ppm2 2.197 ASSI { 18552} (( segid "PROT" and resid 107 and name HG1 )) (( segid "PROT" and resid 107 and name HG2 )) 6 6 0 peak 18552 weight 0.1000E+01 volume 59.18730 ppm1 2.488 ppm2 2.199 ASSI { 18562} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 107 and name HG2 )) 6 6 0 peak 18562 weight 0.1000E+01 volume 4.83650 ppm1 4.243 ppm2 2.196 ASSI { 18572} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 107 and name HG1 )) 6 6 0 peak 18572 weight 0.1000E+01 volume 4.60870 ppm1 4.234 ppm2 2.492 ASSI { 18582} (( segid "PROT" and resid 117 and name HB2 )) (( segid "PROT" and resid 117 and name HB1 )) 6 6 0 peak 18582 weight 0.1000E+01 volume 38.65680 ppm1 1.977 ppm2 2.199 ASSI { 18592} (( segid "PROT" and resid 13 and name HA )) (( segid "PROT" and resid 13 and name HB1 )) 6 6 0 peak 18592 weight 0.1000E+01 volume 31.46840 ppm1 4.136 ppm2 2.399 ASSI { 18602} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 107 and name HB1 )) 6 6 0 peak 18602 weight 0.1000E+01 volume 8.60760 ppm1 4.244 ppm2 2.232 ASSI { 18612} (( segid "PROT" and resid 112 and name HG2 )) (( segid "PROT" and resid 112 and name HG1 )) 6 6 0 peak 18612 weight 0.1000E+01 volume 32.32680 ppm1 2.014 ppm2 2.479 ASSI { 18622} (( segid "PROT" and resid 112 and name HG1 )) (( segid "PROT" and resid 112 and name HG2 )) 6 6 0 peak 18622 weight 0.1000E+01 volume 19.92380 ppm1 2.498 ppm2 2.016 ASSI { 18632} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 112 and name HG2 )) 6 6 0 peak 18632 weight 0.1000E+01 volume 8.60110 ppm1 1.761 ppm2 2.016 ASSI { 18642} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 112 and name HG1 )) 6 6 0 peak 18642 weight 0.1000E+01 volume 4.65940 ppm1 1.763 ppm2 2.494 ASSI { 18652} (( segid "PROT" and resid 24 and name HB# )) (( segid "PROT" and resid 112 and name HG2 )) 6 6 0 peak 18652 weight 0.1000E+01 volume 7.68660 ppm1 1.418 ppm2 2.005 ASSI { 18662} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 112 and name HG2 )) 6 6 0 peak 18662 weight 0.1000E+01 volume 3.06530 ppm1 1.302 ppm2 2.008 ASSI { 18672} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 112 and name HG2 )) 6 6 0 peak 18672 weight 0.1000E+01 volume 5.54340 ppm1 0.870 ppm2 2.013 ASSI { 18682} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 112 and name HG1 )) 6 6 0 peak 18682 weight 0.1000E+01 volume 1.54780 ppm1 1.304 ppm2 2.483 ASSI { 18692} (( segid "PROT" and resid 112 and name HB1 )) (( segid "PROT" and resid 112 and name HB2 )) 6 6 0 peak 18692 weight 0.1000E+01 volume 42.77030 ppm1 2.014 ppm2 1.747 ASSI { 18702} (( segid "PROT" and resid 112 and name HG1 )) (( segid "PROT" and resid 112 and name HB2 )) 6 6 0 peak 18702 weight 0.1000E+01 volume 4.64700 ppm1 2.497 ppm2 1.772 ASSI { 18712} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 112 and name HB1 )) 6 6 0 peak 18712 weight 0.1000E+01 volume 38.02610 ppm1 1.763 ppm2 1.999 ASSI { 18722} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 112 and name HB1 )) 6 6 0 peak 18722 weight 0.1000E+01 volume 7.48700 ppm1 1.303 ppm2 2.011 ASSI { 18732} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 112 and name HB2 )) 6 6 0 peak 18732 weight 0.1000E+01 volume 4.72970 ppm1 1.306 ppm2 1.772 ASSI { 18742} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 112 and name HA )) 6 6 0 peak 18742 weight 0.1000E+01 volume 15.94810 ppm1 1.762 ppm2 4.116 ASSI { 18752} (( segid "PROT" and resid 63 and name HB1 )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 18752 weight 0.1000E+01 volume 17.33710 ppm1 1.995 ppm2 3.687 ASSI { 18762} (( segid "PROT" and resid 84 and name HB1 )) (( segid "PROT" and resid 84 and name HB2 )) 6 6 0 peak 18762 weight 0.1000E+01 volume 5.78850 ppm1 2.208 ppm2 1.216 ASSI { 18772} (( segid "PROT" and resid 84 and name HB2 )) (( segid "PROT" and resid 84 and name HB1 )) 6 6 0 peak 18772 weight 0.1000E+01 volume 5.95820 ppm1 1.228 ppm2 2.201 ASSI { 18782} (( segid "PROT" and resid 84 and name HA )) (( segid "PROT" and resid 84 and name HB2 )) 6 6 0 peak 18782 weight 0.1000E+01 volume 2.53630 ppm1 3.649 ppm2 1.219 ASSI { 18792} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 63 and name HG1 )) 6 6 0 peak 18792 weight 0.1000E+01 volume 3.79060 ppm1 3.695 ppm2 1.461 ASSI { 18802} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 63 and name HG2 )) 6 6 0 peak 18802 weight 0.1000E+01 volume 9.99310 ppm1 3.692 ppm2 1.177 ASSI { 18812} (( segid "PROT" and resid 28 and name HB2 )) (( segid "PROT" and resid 28 and name HA )) 6 6 0 peak 18812 weight 0.1000E+01 volume 21.93440 ppm1 2.061 ppm2 4.126 ASSI { 18822} (( segid "PROT" and resid 28 and name HB1 )) (( segid "PROT" and resid 28 and name HA )) 6 6 0 peak 18822 weight 0.1000E+01 volume 13.91690 ppm1 2.121 ppm2 4.128 ASSI { 18832} (( segid "PROT" and resid 15 and name HA )) (( segid "PROT" and resid 15 and name HB1 )) 6 6 0 peak 18832 weight 0.1000E+01 volume 15.69210 ppm1 3.666 ppm2 1.858 ASSI { 18842} (( segid "PROT" and resid 97 and name HA )) (( segid "PROT" and resid 97 and name HB2 )) 6 6 0 peak 18842 weight 0.1000E+01 volume 17.56810 ppm1 3.647 ppm2 1.335 ASSI { 18852} (( segid "PROT" and resid 18 and name HB2 )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 18852 weight 0.1000E+01 volume 1.01650 ppm1 0.345 ppm2 3.662 ASSI { 18862} (( segid "PROT" and resid 15 and name HB1 )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 18862 weight 0.1000E+01 volume 39.79490 ppm1 1.860 ppm2 3.665 ASSI { 18872} (( segid "PROT" and resid 63 and name HG1 )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 18872 weight 0.1000E+01 volume 13.38910 ppm1 1.459 ppm2 3.687 ASSI { 18882} (( segid "PROT" and resid 15 and name HD1 )) (( segid "PROT" and resid 15 and name HB1 )) 6 6 0 peak 18882 weight 0.1000E+01 volume 9.12490 ppm1 3.280 ppm2 1.857 ASSI { 18892} (( segid "PROT" and resid 15 and name HD1 )) (( segid "PROT" and resid 15 and name HG2 )) 6 6 0 peak 18892 weight 0.1000E+01 volume 20.24720 ppm1 3.280 ppm2 1.461 ASSI { 18902} (( segid "PROT" and resid 15 and name HD1 )) (( segid "PROT" and resid 15 and name HG1 )) 6 6 0 peak 18902 weight 0.1000E+01 volume 17.89480 ppm1 3.280 ppm2 1.543 ASSI { 18912} (( segid "PROT" and resid 15 and name HA )) (( segid "PROT" and resid 15 and name HG2 )) 6 6 0 peak 18912 weight 0.1000E+01 volume 18.91130 ppm1 3.664 ppm2 1.460 ASSI { 18922} (( segid "PROT" and resid 15 and name HA )) (( segid "PROT" and resid 15 and name HG1 )) 6 6 0 peak 18922 weight 0.1000E+01 volume 10.01960 ppm1 3.664 ppm2 1.546 ASSI { 18932} (( segid "PROT" and resid 15 and name HB1 )) (( segid "PROT" and resid 15 and name HG1 )) 6 6 0 peak 18932 weight 0.1000E+01 volume 40.77670 ppm1 1.860 ppm2 1.550 ASSI { 18942} (( segid "PROT" and resid 15 and name HB1 )) (( segid "PROT" and resid 15 and name HG2 )) 6 6 0 peak 18942 weight 0.1000E+01 volume 16.76290 ppm1 1.863 ppm2 1.460 ASSI { 18952} (( segid "PROT" and resid 12 and name HA )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 18952 weight 0.1000E+01 volume 9.02350 ppm1 4.158 ppm2 3.264 ASSI { 18962} (( segid "PROT" and resid 15 and name HB1 )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 18962 weight 0.1000E+01 volume 45.11490 ppm1 1.859 ppm2 3.276 ASSI { 18972} (( segid "PROT" and resid 15 and name HG1 )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 18972 weight 0.1000E+01 volume 22.75140 ppm1 1.545 ppm2 3.274 ASSI { 18982} (( segid "PROT" and resid 15 and name HG2 )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 18982 weight 0.1000E+01 volume 15.40510 ppm1 1.457 ppm2 3.275 ASSI { 18992} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 18992 weight 0.1000E+01 volume 7.13050 ppm1 7.313 ppm2 3.011 ASSI { 19002} (( segid "PROT" and resid 101 and name HZ )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19002 weight 0.1000E+01 volume 15.12720 ppm1 7.152 ppm2 3.011 ASSI { 19012} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19012 weight 0.1000E+01 volume 6.11210 ppm1 7.104 ppm2 3.011 ASSI { 19022} (( segid "PROT" and resid 15 and name HG2 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 19022 weight 0.1000E+01 volume 18.91580 ppm1 1.454 ppm2 0.740 ASSI { 19032} (( segid "PROT" and resid 27 and name HG1 )) (( segid "PROT" and resid 27 and name HA )) 6 6 0 peak 19032 weight 0.1000E+01 volume 24.34940 ppm1 1.694 ppm2 4.007 ASSI { 19042} (( segid "PROT" and resid 27 and name HB2 )) (( segid "PROT" and resid 27 and name HA )) 6 6 0 peak 19042 weight 0.1000E+01 volume 28.18120 ppm1 1.813 ppm2 4.013 ASSI { 19052} (( segid "PROT" and resid 27 and name HB1 )) (( segid "PROT" and resid 27 and name HA )) 6 6 0 peak 19052 weight 0.1000E+01 volume 17.27930 ppm1 1.890 ppm2 4.015 ASSI { 19062} (( segid "PROT" and resid 27 and name HA )) (( segid "PROT" and resid 27 and name HB2 )) 6 6 0 peak 19062 weight 0.1000E+01 volume 16.71460 ppm1 4.016 ppm2 1.832 ASSI { 19072} (( segid "PROT" and resid 27 and name HD2 )) (( segid "PROT" and resid 27 and name HG1 )) 6 6 0 peak 19072 weight 0.1000E+01 volume 37.19580 ppm1 3.122 ppm2 1.687 ASSI { 19082} (( segid "PROT" and resid 27 and name HD1 )) (( segid "PROT" and resid 27 and name HG1 )) 6 6 0 peak 19082 weight 0.1000E+01 volume 30.21230 ppm1 3.188 ppm2 1.689 ASSI { 19092} (( segid "PROT" and resid 27 and name HA )) (( segid "PROT" and resid 27 and name HG1 )) 6 6 0 peak 19092 weight 0.1000E+01 volume 19.11000 ppm1 4.014 ppm2 1.687 ASSI { 19102} (( segid "PROT" and resid 27 and name HB1 )) (( segid "PROT" and resid 27 and name HG1 )) 6 6 0 peak 19102 weight 0.1000E+01 volume 48.96980 ppm1 1.891 ppm2 1.697 ASSI { 19112} (( segid "PROT" and resid 27 and name HB1 )) (( segid "PROT" and resid 27 and name HD1 )) 6 6 0 peak 19112 weight 0.1000E+01 volume 18.92860 ppm1 1.896 ppm2 3.174 ASSI { 19122} (( segid "PROT" and resid 27 and name HA )) (( segid "PROT" and resid 27 and name HD1 )) 6 6 0 peak 19122 weight 0.1000E+01 volume 5.75110 ppm1 4.012 ppm2 3.174 ASSI { 19132} (( segid "PROT" and resid 93 and name HD1 )) (( segid "PROT" and resid 93 and name HA )) 6 6 0 peak 19132 weight 0.1000E+01 volume 23.95520 ppm1 3.164 ppm2 4.307 ASSI { 19142} (( segid "PROT" and resid 5 and name HA )) (( segid "PROT" and resid 5 and name HB1 )) 6 6 0 peak 19142 weight 0.1000E+01 volume 17.52070 ppm1 4.328 ppm2 1.841 ASSI { 19152} (( segid "PROT" and resid 5 and name HA )) (( segid "PROT" and resid 5 and name HB2 )) 6 6 0 peak 19152 weight 0.1000E+01 volume 2.66380 ppm1 4.329 ppm2 1.746 ASSI { 19162} (( segid "PROT" and resid 5 and name HB1 )) (( segid "PROT" and resid 5 and name HG1 )) 6 6 0 peak 19162 weight 0.1000E+01 volume 61.73300 ppm1 1.831 ppm2 1.610 ASSI { 19172} (( segid "PROT" and resid 5 and name HB2 )) (( segid "PROT" and resid 5 and name HG1 )) 6 6 0 peak 19172 weight 0.1000E+01 volume 180.54860 ppm1 1.750 ppm2 1.603 ASSI { 19182} (( segid "PROT" and resid 5 and name HD1 )) (( segid "PROT" and resid 5 and name HG1 )) 6 6 0 peak 19182 weight 0.1000E+01 volume 38.67830 ppm1 3.151 ppm2 1.595 ASSI { 19192} (( segid "PROT" and resid 97 and name HD1 )) (( segid "PROT" and resid 97 and name HB1 )) 6 6 0 peak 19192 weight 0.1000E+01 volume 12.84340 ppm1 3.013 ppm2 1.604 ASSI { 19202} (( segid "PROT" and resid 97 and name HD1 )) (( segid "PROT" and resid 97 and name HB2 )) 6 6 0 peak 19202 weight 0.1000E+01 volume 16.53150 ppm1 3.009 ppm2 1.340 ASSI { 19212} (( segid "PROT" and resid 97 and name HB2 )) (( segid "PROT" and resid 97 and name HB1 )) 6 6 0 peak 19212 weight 0.1000E+01 volume 32.02810 ppm1 1.333 ppm2 1.601 ASSI { 19222} (( segid "PROT" and resid 97 and name HB1 )) (( segid "PROT" and resid 97 and name HB2 )) 6 6 0 peak 19222 weight 0.1000E+01 volume 52.92210 ppm1 1.601 ppm2 1.337 ASSI { 19232} (( segid "PROT" and resid 97 and name HG1 )) (( segid "PROT" and resid 97 and name HB1 )) 6 6 0 peak 19232 weight 0.1000E+01 volume 10.20630 ppm1 1.016 ppm2 1.601 ASSI { 19242} (( segid "PROT" and resid 97 and name HG1 )) (( segid "PROT" and resid 97 and name HB2 )) 6 6 0 peak 19242 weight 0.1000E+01 volume 11.80110 ppm1 1.019 ppm2 1.337 ASSI { 19252} (( segid "PROT" and resid 97 and name HG2 )) (( segid "PROT" and resid 97 and name HB1 )) 6 6 0 peak 19252 weight 0.1000E+01 volume 9.21680 ppm1 0.684 ppm2 1.606 ASSI { 19262} (( segid "PROT" and resid 97 and name HG2 )) (( segid "PROT" and resid 97 and name HB2 )) 6 6 0 peak 19262 weight 0.1000E+01 volume 8.69080 ppm1 0.687 ppm2 1.333 ASSI { 19272} (( segid "PROT" and resid 97 and name HG2 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19272 weight 0.1000E+01 volume 20.79910 ppm1 0.686 ppm2 3.008 ASSI { 19282} (( segid "PROT" and resid 97 and name HG1 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19282 weight 0.1000E+01 volume 22.34870 ppm1 1.018 ppm2 3.008 ASSI { 19292} (( segid "PROT" and resid 97 and name HB2 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19292 weight 0.1000E+01 volume 21.50680 ppm1 1.337 ppm2 3.009 ASSI { 19302} (( segid "PROT" and resid 97 and name HB1 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19302 weight 0.1000E+01 volume 15.71710 ppm1 1.607 ppm2 3.013 ASSI { 19312} (( segid "PROT" and resid 97 and name HA )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19312 weight 0.1000E+01 volume 9.60590 ppm1 3.651 ppm2 3.003 ASSI { 19322} (( segid "PROT" and resid 97 and name HD1 )) (( segid "PROT" and resid 97 and name HG2 )) 6 6 0 peak 19322 weight 0.1000E+01 volume 19.99280 ppm1 3.010 ppm2 0.686 ASSI { 19332} (( segid "PROT" and resid 97 and name HA )) (( segid "PROT" and resid 97 and name HG2 )) 6 6 0 peak 19332 weight 0.1000E+01 volume 5.59620 ppm1 3.648 ppm2 0.686 ASSI { 19342} (( segid "PROT" and resid 97 and name HB2 )) (( segid "PROT" and resid 97 and name HG2 )) 6 6 0 peak 19342 weight 0.1000E+01 volume 16.31510 ppm1 1.339 ppm2 0.680 ASSI { 19352} (( segid "PROT" and resid 97 and name HB1 )) (( segid "PROT" and resid 97 and name HG2 )) 6 6 0 peak 19352 weight 0.1000E+01 volume 13.64330 ppm1 1.605 ppm2 0.675 ASSI { 19362} (( segid "PROT" and resid 97 and name HG1 )) (( segid "PROT" and resid 97 and name HG2 )) 6 6 0 peak 19362 weight 0.1000E+01 volume 19.26930 ppm1 1.015 ppm2 0.683 ASSI { 19372} (( segid "PROT" and resid 100 and name HA )) (( segid "PROT" and resid 100 and name HB1 )) 6 6 0 peak 19372 weight 0.1000E+01 volume 27.96120 ppm1 4.320 ppm2 2.030 ASSI { 19382} (( segid "PROT" and resid 100 and name HB1 )) (( segid "PROT" and resid 100 and name HG2 )) 6 6 0 peak 19382 weight 0.1000E+01 volume 28.29160 ppm1 2.032 ppm2 1.634 ASSI { 19392} (( segid "PROT" and resid 100 and name HE1 )) (( segid "PROT" and resid 100 and name HD1 )) 6 6 0 peak 19392 weight 0.1000E+01 volume 9.50660 ppm1 2.927 ppm2 1.725 ASSI { 19402} (( segid "PROT" and resid 100 and name HE1 )) (( segid "PROT" and resid 100 and name HD2 )) 6 6 0 peak 19402 weight 0.1000E+01 volume 16.69320 ppm1 2.927 ppm2 1.646 ASSI { 19412} (( segid "PROT" and resid 100 and name HA )) (( segid "PROT" and resid 100 and name HD1 )) 6 6 0 peak 19412 weight 0.1000E+01 volume 4.59180 ppm1 4.321 ppm2 1.703 ASSI { 19422} (( segid "PROT" and resid 100 and name HA )) (( segid "PROT" and resid 100 and name HE1 )) 6 6 0 peak 19422 weight 0.1000E+01 volume 12.13940 ppm1 4.267 ppm2 2.920 ASSI { 19432} (( segid "PROT" and resid 97 and name HG1 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19432 weight 0.1000E+01 volume 19.60730 ppm1 1.707 ppm2 2.924 ASSI { 19442} (( segid "PROT" and resid 104 and name HB1 )) (( segid "PROT" and resid 104 and name HE1 )) 6 6 0 peak 19442 weight 0.1000E+01 volume 33.52820 ppm1 1.996 ppm2 2.802 ASSI { 19452} (( segid "PROT" and resid 97 and name HG2 )) (( segid "PROT" and resid 97 and name HD1 )) 6 6 0 peak 19452 weight 0.1000E+01 volume 74.97550 ppm1 1.626 ppm2 2.921 ASSI { 19462} (( segid "PROT" and resid 99 and name HE1 )) (( segid "PROT" and resid 94 and name HE1 )) 6 6 0 peak 19462 weight 0.1000E+01 volume 1.88170 ppm1 7.025 ppm2 2.889 ASSI { 19472} (( segid "PROT" and resid 99 and name HD1 )) (( segid "PROT" and resid 94 and name HE1 )) 6 6 0 peak 19472 weight 0.1000E+01 volume 6.10850 ppm1 7.129 ppm2 2.890 ASSI { 19482} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 100 and name HE1 )) 6 6 0 peak 19482 weight 0.1000E+01 volume 5.81870 ppm1 7.332 ppm2 2.900 ASSI { 19492} (( segid "PROT" and resid 65 and name HD1 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 19492 weight 0.1000E+01 volume 1.99550 ppm1 1.549 ppm2 3.409 ASSI { 19502} (( segid "PROT" and resid 65 and name HB1 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 19502 weight 0.1000E+01 volume 16.58270 ppm1 1.973 ppm2 3.411 ASSI { 19512} (( segid "PROT" and resid 65 and name HG1 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 19512 weight 0.1000E+01 volume 8.20010 ppm1 1.863 ppm2 3.418 ASSI { 19522} (( segid "PROT" and resid 70 and name HG2 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 19522 weight 0.1000E+01 volume 5.06380 ppm1 2.210 ppm2 3.412 ASSI { 19532} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 70 and name HB1 )) 6 6 0 peak 19532 weight 0.1000E+01 volume 4.60140 ppm1 3.413 ppm2 1.993 ASSI { 19542} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 70 and name HB2 )) 6 6 0 peak 19542 weight 0.1000E+01 volume 4.71440 ppm1 3.415 ppm2 1.077 ASSI { 19552} (( segid "PROT" and resid 70 and name HA )) (( segid "PROT" and resid 70 and name HB2 )) 6 6 0 peak 19552 weight 0.1000E+01 volume 4.11810 ppm1 3.984 ppm2 1.093 ASSI { 19562} (( segid "PROT" and resid 70 and name HA )) (( segid "PROT" and resid 70 and name HB1 )) 6 6 0 peak 19562 weight 0.1000E+01 volume 38.04040 ppm1 3.989 ppm2 2.007 ASSI { 19572} (( segid "PROT" and resid 70 and name HB1 )) (( segid "PROT" and resid 70 and name HB2 )) 6 6 0 peak 19572 weight 0.1000E+01 volume 8.45660 ppm1 1.988 ppm2 1.085 ASSI { 19582} (( segid "PROT" and resid 70 and name HG2 )) (( segid "PROT" and resid 70 and name HB2 )) 6 6 0 peak 19582 weight 0.1000E+01 volume 5.21710 ppm1 2.208 ppm2 1.081 ASSI { 19592} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 65 and name HG1 )) 6 6 0 peak 19592 weight 0.1000E+01 volume 2.70530 ppm1 3.411 ppm2 1.863 ASSI { 19602} (( segid "PROT" and resid 40 and name HB1 )) (( segid "PROT" and resid 44 and name HD1# )) 6 6 0 peak 19602 weight 0.1000E+01 volume 6.50890 ppm1 2.958 ppm2 0.746 ASSI { 19612} (( segid "PROT" and resid 65 and name HG2 )) (( segid "PROT" and resid 65 and name HG1 )) 6 6 0 peak 19612 weight 0.1000E+01 volume 3.03160 ppm1 0.746 ppm2 1.861 ASSI { 19622} (( segid "PROT" and resid 70 and name HB2 )) (( segid "PROT" and resid 65 and name HG1 )) 6 6 0 peak 19622 weight 0.1000E+01 volume 3.27500 ppm1 1.132 ppm2 1.858 ASSI { 19632} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 65 and name HB2 )) 6 6 0 peak 19632 weight 0.1000E+01 volume 2.04820 ppm1 3.407 ppm2 0.565 ASSI { 19642} (( segid "PROT" and resid 65 and name HB1 )) (( segid "PROT" and resid 65 and name HB2 )) 6 6 0 peak 19642 weight 0.1000E+01 volume 8.00290 ppm1 1.964 ppm2 0.575 ASSI { 19652} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 70 and name HG1 )) 6 6 0 peak 19652 weight 0.1000E+01 volume 16.14130 ppm1 3.414 ppm2 2.246 ASSI { 19662} (( segid "PROT" and resid 70 and name HB1 )) (( segid "PROT" and resid 70 and name HG1 )) 6 6 0 peak 19662 weight 0.1000E+01 volume 19.68940 ppm1 1.994 ppm2 2.234 ASSI { 19672} (( segid "PROT" and resid 70 and name HB2 )) (( segid "PROT" and resid 70 and name HG1 )) 6 6 0 peak 19672 weight 0.1000E+01 volume 27.45310 ppm1 1.088 ppm2 2.231 ASSI { 19682} (( segid "PROT" and resid 65 and name HG2 )) (( segid "PROT" and resid 70 and name HG1 )) 6 6 0 peak 19682 weight 0.1000E+01 volume 6.20560 ppm1 0.737 ppm2 2.244 ASSI { 19692} (( segid "PROT" and resid 70 and name HA )) (( segid "PROT" and resid 70 and name HG2 )) 6 6 0 peak 19692 weight 0.1000E+01 volume 20.88980 ppm1 3.985 ppm2 2.210 ASSI { 19702} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 104 and name HB1 )) 6 6 0 peak 19702 weight 0.1000E+01 volume 20.26260 ppm1 4.242 ppm2 2.023 ASSI { 19712} (( segid "PROT" and resid 101 and name HA )) (( segid "PROT" and resid 104 and name HB1 )) 6 6 0 peak 19712 weight 0.1000E+01 volume 3.44200 ppm1 4.498 ppm2 2.035 ASSI { 19722} (( segid "PROT" and resid 104 and name HG2 )) (( segid "PROT" and resid 104 and name HB1 )) 6 6 0 peak 19722 weight 0.1000E+01 volume 19.09130 ppm1 1.240 ppm2 2.030 ASSI { 19732} (( segid "PROT" and resid 104 and name HG1 )) (( segid "PROT" and resid 104 and name HB1 )) 6 6 0 peak 19732 weight 0.1000E+01 volume 14.41510 ppm1 1.478 ppm2 2.039 ASSI { 19742} (( segid "PROT" and resid 34 and name HA )) (( segid "PROT" and resid 34 and name HB2 )) 6 6 0 peak 19742 weight 0.1000E+01 volume 10.28520 ppm1 4.357 ppm2 0.603 ASSI { 19752} (( segid "PROT" and resid 34 and name HA )) (( segid "PROT" and resid 34 and name HB1 )) 6 6 0 peak 19752 weight 0.1000E+01 volume 4.94240 ppm1 4.357 ppm2 2.101 ASSI { 19762} (( segid "PROT" and resid 34 and name HD1 )) (( segid "PROT" and resid 34 and name HB2 )) 6 6 0 peak 19762 weight 0.1000E+01 volume 1.70600 ppm1 3.837 ppm2 0.613 ASSI { 19772} (( segid "PROT" and resid 34 and name HG2 )) (( segid "PROT" and resid 34 and name HB2 )) 6 6 0 peak 19772 weight 0.1000E+01 volume 2.48510 ppm1 1.788 ppm2 0.590 ASSI { 19782} (( segid "PROT" and resid 34 and name HG1 )) (( segid "PROT" and resid 34 and name HB2 )) 6 6 0 peak 19782 weight 0.1000E+01 volume 4.28960 ppm1 1.965 ppm2 0.603 ASSI { 19792} (( segid "PROT" and resid 34 and name HB1 )) (( segid "PROT" and resid 34 and name HB2 )) 6 6 0 peak 19792 weight 0.1000E+01 volume 9.43860 ppm1 2.097 ppm2 0.610 ASSI { 19802} (( segid "PROT" and resid 34 and name HB2 )) (( segid "PROT" and resid 34 and name HB1 )) 6 6 0 peak 19802 weight 0.1000E+01 volume 10.22790 ppm1 0.605 ppm2 2.101 ASSI { 19812} (( segid "PROT" and resid 19 and name HB1 )) (( segid "PROT" and resid 15 and name HA )) 6 6 0 peak 19812 weight 0.1000E+01 volume 3.08670 ppm1 2.212 ppm2 3.666 ASSI { 19822} (( segid "PROT" and resid 28 and name HG2 )) (( segid "PROT" and resid 28 and name HG1 )) 6 6 0 peak 19822 weight 0.1000E+01 volume 21.15060 ppm1 2.042 ppm2 2.800 ASSI { 19832} (( segid "PROT" and resid 57 and name HE# )) (( segid "PROT" and resid 57 and name HG1 )) 6 6 0 peak 19832 weight 0.1000E+01 volume 5.25720 ppm1 1.989 ppm2 2.992 ASSI { 19842} (( segid "PROT" and resid 57 and name HB1 )) (( segid "PROT" and resid 57 and name HG1 )) 6 6 0 peak 19842 weight 0.1000E+01 volume 2.66970 ppm1 2.178 ppm2 2.994 ASSI { 19852} (( segid "PROT" and resid 57 and name HB2 )) (( segid "PROT" and resid 57 and name HG1 )) 6 6 0 peak 19852 weight 0.1000E+01 volume 3.20840 ppm1 1.253 ppm2 2.995 ASSI { 19862} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 57 and name HG1 )) 6 6 0 peak 19862 weight 0.1000E+01 volume 1.59590 ppm1 0.892 ppm2 3.011 ASSI { 19872} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 117 and name HG1 )) 6 6 0 peak 19872 weight 0.1000E+01 volume 1.84360 ppm1 0.885 ppm2 2.586 ASSI { 19882} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 117 and name HG2 )) 6 6 0 peak 19882 weight 0.1000E+01 volume 3.63690 ppm1 0.886 ppm2 2.511 ASSI { 19892} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 117 and name HG2 )) 6 6 0 peak 19892 weight 0.1000E+01 volume 7.80890 ppm1 0.725 ppm2 2.511 ASSI { 19902} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 117 and name HG1 )) 6 6 0 peak 19902 weight 0.1000E+01 volume 3.88130 ppm1 0.728 ppm2 2.590 ASSI { 19912} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 117 and name HG1 )) 6 6 0 peak 19912 weight 0.1000E+01 volume 2.90680 ppm1 1.113 ppm2 2.588 ASSI { 19922} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 117 and name HG2 )) 6 6 0 peak 19922 weight 0.1000E+01 volume 7.71720 ppm1 1.113 ppm2 2.515 ASSI { 19932} (( segid "PROT" and resid 113 and name HG11 )) (( segid "PROT" and resid 117 and name HG2 )) 6 6 0 peak 19932 weight 0.1000E+01 volume 1.88010 ppm1 1.217 ppm2 2.513 ASSI { 19942} (( segid "PROT" and resid 113 and name HG11 )) (( segid "PROT" and resid 117 and name HG1 )) 6 6 0 peak 19942 weight 0.1000E+01 volume 2.01510 ppm1 1.218 ppm2 2.592 ASSI { 19952} (( segid "PROT" and resid 117 and name HE# )) (( segid "PROT" and resid 117 and name HG2 )) 6 6 0 peak 19952 weight 0.1000E+01 volume 4.23830 ppm1 1.466 ppm2 2.509 ASSI { 19962} (( segid "PROT" and resid 117 and name HE# )) (( segid "PROT" and resid 117 and name HG1 )) 6 6 0 peak 19962 weight 0.1000E+01 volume 3.11460 ppm1 1.466 ppm2 2.594 ASSI { 19972} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 117 and name HG2 )) 6 6 0 peak 19972 weight 0.1000E+01 volume 2.15370 ppm1 4.309 ppm2 2.515 ASSI { 19982} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 117 and name HG1 )) 6 6 0 peak 19982 weight 0.1000E+01 volume 2.49440 ppm1 4.307 ppm2 2.602 ASSI { 19992} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 19992 weight 0.1000E+01 volume 3.51300 ppm1 0.235 ppm2 3.831 ASSI { 20002} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 20002 weight 0.1000E+01 volume 11.50100 ppm1 0.346 ppm2 3.831 ASSI { 20012} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 20012 weight 0.1000E+01 volume 10.71720 ppm1 0.581 ppm2 3.831 ASSI { 20022} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 20022 weight 0.1000E+01 volume 6.66280 ppm1 1.098 ppm2 3.834 ASSI { 20032} (( segid "PROT" and resid 59 and name HG )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 20032 weight 0.1000E+01 volume 1.76370 ppm1 1.550 ppm2 3.844 ASSI { 20042} (( segid "PROT" and resid 59 and name HB1 )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 20042 weight 0.1000E+01 volume 6.61690 ppm1 1.703 ppm2 3.836 ASSI { 20052} (( segid "PROT" and resid 59 and name HB2 )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 20052 weight 0.1000E+01 volume 5.02290 ppm1 1.351 ppm2 3.855 ASSI { 20062} (( segid "PROT" and resid 12 and name HB1 )) (( segid "PROT" and resid 12 and name HA )) 6 6 0 peak 20062 weight 0.1000E+01 volume 35.55720 ppm1 2.010 ppm2 4.148 ASSI { 20072} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 20072 weight 0.1000E+01 volume 4.23910 ppm1 7.328 ppm2 2.350 ASSI { 20082} (( segid "PROT" and resid 13 and name HB2 )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 20082 weight 0.1000E+01 volume 134.18800 ppm1 2.199 ppm2 2.340 ASSI { 20092} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 28 and name HG2 )) 6 6 0 peak 20092 weight 0.1000E+01 volume 2.67780 ppm1 0.961 ppm2 2.034 ASSI { 20102} (( segid "PROT" and resid 104 and name HE1 )) (( segid "PROT" and resid 104 and name HD2 )) 6 6 0 peak 20102 weight 0.1000E+01 volume 15.96820 ppm1 2.828 ppm2 1.629 ASSI { 20112} (( segid "PROT" and resid 104 and name HE1 )) (( segid "PROT" and resid 104 and name HD1 )) 6 6 0 peak 20112 weight 0.1000E+01 volume 17.47490 ppm1 2.828 ppm2 1.799 ASSI { 20122} (( segid "PROT" and resid 28 and name HG1 )) (( segid "PROT" and resid 28 and name HA )) 6 6 0 peak 20122 weight 0.1000E+01 volume 8.71440 ppm1 2.809 ppm2 4.113 ASSI { 20132} (( segid "PROT" and resid 72 and name HB1 )) (( segid "PROT" and resid 72 and name HG1 )) 6 6 0 peak 20132 weight 0.1000E+01 volume 111.20710 ppm1 2.259 ppm2 2.427 ASSI { 20142} (( segid "PROT" and resid 72 and name HB2 )) (( segid "PROT" and resid 72 and name HG1 )) 6 6 0 peak 20142 weight 0.1000E+01 volume 43.31850 ppm1 2.126 ppm2 2.432 ASSI { 20152} (( segid "PROT" and resid 68 and name HB )) (( segid "PROT" and resid 70 and name HG1 )) 6 6 0 peak 20152 weight 0.1000E+01 volume 3.81010 ppm1 4.515 ppm2 2.247 ASSI { 20162} (( segid "PROT" and resid 42 and name HA )) (( segid "PROT" and resid 42 and name HG1 )) 6 6 0 peak 20162 weight 0.1000E+01 volume 19.08650 ppm1 4.017 ppm2 2.361 ASSI { 20172} (( segid "PROT" and resid 65 and name HB2 )) (( segid "PROT" and resid 70 and name HG1 )) 6 6 0 peak 20172 weight 0.1000E+01 volume 4.52310 ppm1 0.561 ppm2 2.240 ASSI { 20182} (( segid "PROT" and resid 70 and name HB2 )) (( segid "PROT" and resid 70 and name HA )) 6 6 0 peak 20182 weight 0.1000E+01 volume 19.77020 ppm1 1.082 ppm2 3.982 ASSI { 20192} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 70 and name HA )) 6 6 0 peak 20192 weight 0.1000E+01 volume 1.99250 ppm1 3.410 ppm2 3.988 ASSI { 20202} (( segid "PROT" and resid 42 and name HG1 )) (( segid "PROT" and resid 42 and name HA )) 6 6 0 peak 20202 weight 0.1000E+01 volume 10.95790 ppm1 2.356 ppm2 4.025 ASSI { 20212} (( segid "PROT" and resid 42 and name HB1 )) (( segid "PROT" and resid 42 and name HA )) 6 6 0 peak 20212 weight 0.1000E+01 volume 25.72450 ppm1 2.112 ppm2 4.022 ASSI { 20222} (( segid "PROT" and resid 42 and name HB1 )) (( segid "PROT" and resid 42 and name HG1 )) 6 6 0 peak 20222 weight 0.1000E+01 volume 103.84960 ppm1 2.110 ppm2 2.363 ASSI { 20232} (( segid "PROT" and resid 42 and name HA )) (( segid "PROT" and resid 42 and name HB1 )) 6 6 0 peak 20232 weight 0.1000E+01 volume 31.75430 ppm1 4.017 ppm2 2.110 ASSI { 20242} (( segid "PROT" and resid 42 and name HG1 )) (( segid "PROT" and resid 42 and name HB1 )) 6 6 0 peak 20242 weight 0.1000E+01 volume 39.78620 ppm1 2.353 ppm2 2.108 ASSI { 20252} (( segid "PROT" and resid 28 and name HG1 )) (( segid "PROT" and resid 28 and name HB1 )) 6 6 0 peak 20252 weight 0.1000E+01 volume 9.97690 ppm1 2.800 ppm2 2.094 ASSI { 20262} (( segid "PROT" and resid 105 and name HG )) (( segid "PROT" and resid 28 and name HB1 )) 6 6 0 peak 20262 weight 0.1000E+01 volume 2.86560 ppm1 1.644 ppm2 2.099 ASSI { 20272} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 28 and name HB1 )) 6 6 0 peak 20272 weight 0.1000E+01 volume 7.68450 ppm1 0.564 ppm2 2.088 ASSI { 20282} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 28 and name HB1 )) 6 6 0 peak 20282 weight 0.1000E+01 volume 2.46940 ppm1 0.393 ppm2 2.099 ASSI { 20292} (( segid "PROT" and resid 23 and name HG1 )) (( segid "PROT" and resid 23 and name HG2 )) 6 6 0 peak 20292 weight 0.1000E+01 volume 40.81340 ppm1 2.310 ppm2 2.113 ASSI { 20302} (( segid "PROT" and resid 111 and name HA )) (( segid "PROT" and resid 111 and name HB2 )) 6 6 0 peak 20302 weight 0.1000E+01 volume 33.45970 ppm1 4.112 ppm2 2.184 ASSI { 20312} (( segid "PROT" and resid 111 and name HA )) (( segid "PROT" and resid 111 and name HB1 )) 6 6 0 peak 20312 weight 0.1000E+01 volume 12.27780 ppm1 4.114 ppm2 2.268 ASSI { 20322} (( segid "PROT" and resid 111 and name HG1 )) (( segid "PROT" and resid 111 and name HB2 )) 6 6 0 peak 20322 weight 0.1000E+01 volume 21.40060 ppm1 2.521 ppm2 2.178 ASSI { 20332} (( segid "PROT" and resid 111 and name HG2 )) (( segid "PROT" and resid 111 and name HB2 )) 6 6 0 peak 20332 weight 0.1000E+01 volume 31.34030 ppm1 2.429 ppm2 2.173 ASSI { 20342} (( segid "PROT" and resid 111 and name HG2 )) (( segid "PROT" and resid 111 and name HB1 )) 6 6 0 peak 20342 weight 0.1000E+01 volume 34.56130 ppm1 2.435 ppm2 2.277 ASSI { 20352} (( segid "PROT" and resid 111 and name HG1 )) (( segid "PROT" and resid 111 and name HB1 )) 6 6 0 peak 20352 weight 0.1000E+01 volume 16.26040 ppm1 2.526 ppm2 2.270 ASSI { 20362} (( segid "PROT" and resid 115 and name HA )) (( segid "PROT" and resid 118 and name HG2 )) 6 6 0 peak 20362 weight 0.1000E+01 volume 6.24320 ppm1 4.267 ppm2 2.402 ASSI { 20372} (( segid "PROT" and resid 115 and name HA )) (( segid "PROT" and resid 118 and name HG1 )) 6 6 0 peak 20372 weight 0.1000E+01 volume 5.22500 ppm1 4.266 ppm2 2.504 ASSI { 20382} (( segid "PROT" and resid 111 and name HA )) (( segid "PROT" and resid 111 and name HG1 )) 6 6 0 peak 20382 weight 0.1000E+01 volume 12.21940 ppm1 4.113 ppm2 2.500 ASSI { 20392} (( segid "PROT" and resid 111 and name HA )) (( segid "PROT" and resid 111 and name HG2 )) 6 6 0 peak 20392 weight 0.1000E+01 volume 16.30980 ppm1 4.111 ppm2 2.416 ASSI { 20402} (( segid "PROT" and resid 111 and name HB2 )) (( segid "PROT" and resid 111 and name HG1 )) 6 6 0 peak 20402 weight 0.1000E+01 volume 35.56980 ppm1 2.163 ppm2 2.501 ASSI { 20412} (( segid "PROT" and resid 111 and name HB1 )) (( segid "PROT" and resid 111 and name HG2 )) 6 6 0 peak 20412 weight 0.1000E+01 volume 23.75150 ppm1 2.281 ppm2 2.433 ASSI { 20422} (( segid "PROT" and resid 57 and name HB2 )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 20422 weight 0.1000E+01 volume 23.54430 ppm1 1.242 ppm2 1.988 ASSI { 20432} (( segid "PROT" and resid 57 and name HB1 )) (( segid "PROT" and resid 57 and name HE# )) 6 6 0 peak 20432 weight 0.1000E+01 volume 20.48710 ppm1 2.171 ppm2 1.980 ASSI { 20442} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 57 and name HG1 )) 6 6 0 peak 20442 weight 0.1000E+01 volume 1.69410 ppm1 0.344 ppm2 2.993 ASSI { 20452} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 57 and name HB2 )) 6 6 0 peak 20452 weight 0.1000E+01 volume 0.90870 ppm1 0.889 ppm2 1.250 ASSI { 20462} (( segid "PROT" and resid 7 and name HG2 )) (( segid "PROT" and resid 7 and name HA )) 6 6 0 peak 20462 weight 0.1000E+01 volume 19.01050 ppm1 0.967 ppm2 4.236 ASSI { 20472} (( segid "PROT" and resid 7 and name HG1 )) (( segid "PROT" and resid 7 and name HA )) 6 6 0 peak 20472 weight 0.1000E+01 volume 10.59990 ppm1 1.098 ppm2 4.239 ASSI { 20482} (( segid "PROT" and resid 84 and name HB1 )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 20482 weight 0.1000E+01 volume 10.59760 ppm1 2.208 ppm2 1.221 ASSI { 20492} (( segid "PROT" and resid 81 and name HA )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 20492 weight 0.1000E+01 volume 9.28400 ppm1 2.480 ppm2 1.222 ASSI { 20502} (( segid "PROT" and resid 84 and name HG2 )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 20502 weight 0.1000E+01 volume 12.26600 ppm1 1.836 ppm2 1.223 ASSI { 20512} (( segid "PROT" and resid 59 and name HG )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 20512 weight 0.1000E+01 volume 6.47640 ppm1 1.552 ppm2 1.224 ASSI { 20522} (( segid "PROT" and resid 81 and name HB )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 20522 weight 0.1000E+01 volume 2.10330 ppm1 0.895 ppm2 1.221 ASSI { 20532} (( segid "PROT" and resid 59 and name HA )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 20532 weight 0.1000E+01 volume 2.57430 ppm1 3.844 ppm2 1.221 ASSI { 20542} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 20542 weight 0.1000E+01 volume 1.66760 ppm1 -1.498 ppm2 1.162 ASSI { 20552} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 20552 weight 0.1000E+01 volume 2.98280 ppm1 -0.258 ppm2 0.580 ASSI { 20562} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 108 and name HB )) 6 6 0 peak 20562 weight 0.1000E+01 volume 1.29630 ppm1 0.564 ppm2 2.157 ASSI { 20572} (( segid "PROT" and resid 46 and name HB )) (( segid "PROT" and resid 46 and name HG11 )) 6 6 0 peak 20572 weight 0.1000E+01 volume 1.80720 ppm1 2.331 ppm2 1.649 ASSI { 20582} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 46 and name HB )) 6 6 0 peak 20582 weight 0.1000E+01 volume 0.76780 ppm1 6.710 ppm2 2.265 ASSI { 20592} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 32 and name HA )) 6 6 0 peak 20592 weight 0.1000E+01 volume 1.52170 ppm1 0.237 ppm2 4.379 ASSI { 20602} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 32 and name HB2 )) 6 6 0 peak 20602 weight 0.1000E+01 volume 2.15420 ppm1 0.233 ppm2 3.672 ASSI { 20612} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 32 and name HB1 )) 6 6 0 peak 20612 weight 0.1000E+01 volume 1.61270 ppm1 0.396 ppm2 4.381 ASSI { 20622} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 32 and name HB1 )) 6 6 0 peak 20622 weight 0.1000E+01 volume 3.47940 ppm1 0.571 ppm2 4.377 ASSI { 20632} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 32 and name HB2 )) 6 6 0 peak 20632 weight 0.1000E+01 volume 2.66420 ppm1 0.567 ppm2 3.654 ASSI { 20642} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 20642 weight 0.1000E+01 volume 9.88950 ppm1 0.893 ppm2 4.023 ASSI { 20652} (( segid "PROT" and resid 90 and name HD1# )) (( segid "PROT" and resid 91 and name HA )) 6 6 0 peak 20652 weight 0.1000E+01 volume 22.45160 ppm1 0.991 ppm2 4.001 ASSI { 20662} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 32 and name HA )) 6 6 0 peak 20662 weight 0.1000E+01 volume 0.99290 ppm1 7.421 ppm2 4.350 ASSI { 20672} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 119 and name HB2 )) 6 6 0 peak 20672 weight 0.1000E+01 volume 2.48160 ppm1 0.659 ppm2 4.002 ASSI { 20682} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 119 and name HB2 )) 6 6 0 peak 20682 weight 0.1000E+01 volume 2.20140 ppm1 0.775 ppm2 4.011 ASSI { 20692} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 119 and name HB2 )) 6 6 0 peak 20692 weight 0.1000E+01 volume 2.50770 ppm1 1.035 ppm2 4.000 ASSI { 20702} (( segid "PROT" and resid 54 and name HG2 )) (( segid "PROT" and resid 54 and name HB1 )) 6 6 0 peak 20702 weight 0.1000E+01 volume 6.36210 ppm1 1.362 ppm2 1.806 ASSI { 20712} (( segid "PROT" and resid 54 and name HG2 )) (( segid "PROT" and resid 54 and name HB2 )) 6 6 0 peak 20712 weight 0.1000E+01 volume 14.28280 ppm1 1.360 ppm2 1.652 ASSI { 20722} (( segid "PROT" and resid 54 and name HG1 )) (( segid "PROT" and resid 54 and name HB2 )) 6 6 0 peak 20722 weight 0.1000E+01 volume 26.53060 ppm1 1.449 ppm2 1.655 ASSI { 20732} (( segid "PROT" and resid 54 and name HG1 )) (( segid "PROT" and resid 54 and name HB1 )) 6 6 0 peak 20732 weight 0.1000E+01 volume 14.46060 ppm1 1.449 ppm2 1.807 ASSI { 20742} (( segid "PROT" and resid 54 and name HB2 )) (( segid "PROT" and resid 54 and name HB1 )) 6 6 0 peak 20742 weight 0.1000E+01 volume 23.27630 ppm1 1.645 ppm2 1.811 ASSI { 20752} (( segid "PROT" and resid 54 and name HB1 )) (( segid "PROT" and resid 54 and name HB2 )) 6 6 0 peak 20752 weight 0.1000E+01 volume 30.01020 ppm1 1.809 ppm2 1.660 ASSI { 20762} (( segid "PROT" and resid 94 and name HG2 )) (( segid "PROT" and resid 94 and name HB2 )) 6 6 0 peak 20762 weight 0.1000E+01 volume 38.12920 ppm1 1.059 ppm2 1.384 ASSI { 20772} (( segid "PROT" and resid 94 and name HG1 )) (( segid "PROT" and resid 94 and name HB2 )) 6 6 0 peak 20772 weight 0.1000E+01 volume 24.37460 ppm1 1.173 ppm2 1.388 ASSI { 20782} (( segid "PROT" and resid 54 and name HA )) (( segid "PROT" and resid 54 and name HB1 )) 6 6 0 peak 20782 weight 0.1000E+01 volume 13.84010 ppm1 4.266 ppm2 1.819 ASSI { 20792} (( segid "PROT" and resid 54 and name HA )) (( segid "PROT" and resid 54 and name HB2 )) 6 6 0 peak 20792 weight 0.1000E+01 volume 25.48550 ppm1 4.264 ppm2 1.651 ASSI { 20802} (( segid "PROT" and resid 54 and name HD1 )) (( segid "PROT" and resid 54 and name HA )) 6 6 0 peak 20802 weight 0.1000E+01 volume 24.44370 ppm1 1.600 ppm2 4.243 ASSI { 20812} (( segid "PROT" and resid 54 and name HG1 )) (( segid "PROT" and resid 54 and name HA )) 6 6 0 peak 20812 weight 0.1000E+01 volume 19.56580 ppm1 1.451 ppm2 4.258 ASSI { 20822} (( segid "PROT" and resid 54 and name HA )) (( segid "PROT" and resid 54 and name HG1 )) 6 6 0 peak 20822 weight 0.1000E+01 volume 13.51840 ppm1 4.269 ppm2 1.452 ASSI { 20832} (( segid "PROT" and resid 54 and name HA )) (( segid "PROT" and resid 54 and name HG2 )) 6 6 0 peak 20832 weight 0.1000E+01 volume 34.34090 ppm1 4.267 ppm2 1.343 ASSI { 20842} (( segid "PROT" and resid 54 and name HB1 )) (( segid "PROT" and resid 54 and name HG1 )) 6 6 0 peak 20842 weight 0.1000E+01 volume 22.61940 ppm1 1.810 ppm2 1.456 ASSI { 20852} (( segid "PROT" and resid 54 and name HB1 )) (( segid "PROT" and resid 54 and name HG2 )) 6 6 0 peak 20852 weight 0.1000E+01 volume 21.78840 ppm1 1.813 ppm2 1.349 ASSI { 20862} (( segid "PROT" and resid 104 and name HE1 )) (( segid "PROT" and resid 104 and name HG1 )) 6 6 0 peak 20862 weight 0.1000E+01 volume 15.16030 ppm1 2.827 ppm2 1.477 ASSI { 20872} (( segid "PROT" and resid 104 and name HE1 )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 20872 weight 0.1000E+01 volume 19.28750 ppm1 2.827 ppm2 1.237 ASSI { 20882} (( segid "PROT" and resid 104 and name HB2 )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 20882 weight 0.1000E+01 volume 7.73220 ppm1 2.008 ppm2 1.234 ASSI { 20892} (( segid "PROT" and resid 104 and name HB2 )) (( segid "PROT" and resid 104 and name HG1 )) 6 6 0 peak 20892 weight 0.1000E+01 volume 3.90350 ppm1 2.007 ppm2 1.479 ASSI { 20922} (( segid "PROT" and resid 104 and name HG2 )) (( segid "PROT" and resid 104 and name HG1 )) 6 6 0 peak 20922 weight 0.1000E+01 volume 31.79190 ppm1 1.237 ppm2 1.478 ASSI { 20932} (( segid "PROT" and resid 104 and name HG1 )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 20932 weight 0.1000E+01 volume 49.49480 ppm1 1.476 ppm2 1.234 ASSI { 20942} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 20942 weight 0.1000E+01 volume 16.57860 ppm1 4.255 ppm2 1.237 ASSI { 20952} (( segid "PROT" and resid 54 and name HE1 )) (( segid "PROT" and resid 54 and name HG2 )) 6 6 0 peak 20952 weight 0.1000E+01 volume 36.48490 ppm1 2.927 ppm2 1.348 ASSI { 20962} (( segid "PROT" and resid 54 and name HE1 )) (( segid "PROT" and resid 54 and name HD1 )) 6 6 0 peak 20962 weight 0.1000E+01 volume 24.85590 ppm1 2.905 ppm2 1.565 ASSI { 20972} (( segid "PROT" and resid 54 and name HG1 )) (( segid "PROT" and resid 54 and name HD1 )) 6 6 0 peak 20972 weight 0.1000E+01 volume 220.16789 ppm1 1.449 ppm2 1.565 ASSI { 20982} (( segid "PROT" and resid 54 and name HG2 )) (( segid "PROT" and resid 54 and name HD1 )) 6 6 0 peak 20982 weight 0.1000E+01 volume 54.71470 ppm1 1.360 ppm2 1.557 ASSI { 20992} (( segid "PROT" and resid 54 and name HA )) (( segid "PROT" and resid 54 and name HD1 )) 6 6 0 peak 20992 weight 0.1000E+01 volume 31.14120 ppm1 4.263 ppm2 1.584 ASSI { 21002} (( segid "PROT" and resid 54 and name HG2 )) (( segid "PROT" and resid 54 and name HE1 )) 6 6 0 peak 21002 weight 0.1000E+01 volume 3.12540 ppm1 1.357 ppm2 2.925 ASSI { 21012} (( segid "PROT" and resid 54 and name HG1 )) (( segid "PROT" and resid 54 and name HE1 )) 6 6 0 peak 21012 weight 0.1000E+01 volume 11.88990 ppm1 1.452 ppm2 2.928 ASSI { 21022} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 65 and name HD2 )) 6 6 0 peak 21022 weight 0.1000E+01 volume 1.64700 ppm1 3.415 ppm2 1.348 ASSI { 21032} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 65 and name HE1 )) 6 6 0 peak 21032 weight 0.1000E+01 volume 2.62250 ppm1 3.417 ppm2 2.384 ASSI { 21042} (( segid "PROT" and resid 65 and name HB1 )) (( segid "PROT" and resid 65 and name HE1 )) 6 6 0 peak 21042 weight 0.1000E+01 volume 16.29060 ppm1 1.983 ppm2 2.377 ASSI { 21052} (( segid "PROT" and resid 65 and name HG1 )) (( segid "PROT" and resid 65 and name HE1 )) 6 6 0 peak 21052 weight 0.1000E+01 volume 11.64060 ppm1 1.870 ppm2 2.370 ASSI { 21062} (( segid "PROT" and resid 65 and name HE1 )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 21062 weight 0.1000E+01 volume 1.26720 ppm1 2.349 ppm2 3.416 ASSI { 21072} (( segid "PROT" and resid 65 and name HE1 )) (( segid "PROT" and resid 65 and name HD1 )) 6 6 0 peak 21072 weight 0.1000E+01 volume 2.08960 ppm1 2.396 ppm2 1.543 ASSI { 21082} (( segid "PROT" and resid 65 and name HE1 )) (( segid "PROT" and resid 65 and name HD2 )) 6 6 0 peak 21082 weight 0.1000E+01 volume 4.69970 ppm1 2.393 ppm2 1.343 ASSI { 21092} (( segid "PROT" and resid 65 and name HD1 )) (( segid "PROT" and resid 65 and name HG1 )) 6 6 0 peak 21092 weight 0.1000E+01 volume 4.69980 ppm1 1.561 ppm2 1.857 ASSI { 21102} (( segid "PROT" and resid 7 and name HE1 )) (( segid "PROT" and resid 7 and name HD1 )) 6 6 0 peak 21102 weight 0.1000E+01 volume 31.35630 ppm1 2.680 ppm2 1.507 ASSI { 21112} (( segid "PROT" and resid 94 and name HE1 )) (( segid "PROT" and resid 94 and name HG2 )) 6 6 0 peak 21112 weight 0.1000E+01 volume 26.91530 ppm1 2.883 ppm2 1.053 ASSI { 21122} (( segid "PROT" and resid 94 and name HE1 )) (( segid "PROT" and resid 94 and name HG1 )) 6 6 0 peak 21122 weight 0.1000E+01 volume 16.87280 ppm1 2.888 ppm2 1.170 ASSI { 21132} (( segid "PROT" and resid 63 and name HE1 )) (( segid "PROT" and resid 63 and name HG2 )) 6 6 0 peak 21132 weight 0.1000E+01 volume 7.78470 ppm1 2.800 ppm2 1.188 ASSI { 21142} (( segid "PROT" and resid 63 and name HE1 )) (( segid "PROT" and resid 63 and name HG1 )) 6 6 0 peak 21142 weight 0.1000E+01 volume 14.84500 ppm1 2.801 ppm2 1.459 ASSI { 21152} (( segid "PROT" and resid 100 and name HE1 )) (( segid "PROT" and resid 100 and name HG2 )) 6 6 0 peak 21152 weight 0.1000E+01 volume 6.86000 ppm1 2.929 ppm2 1.602 ASSI { 21162} (( segid "PROT" and resid 100 and name HE1 )) (( segid "PROT" and resid 100 and name HG1 )) 6 6 0 peak 21162 weight 0.1000E+01 volume 19.89920 ppm1 2.926 ppm2 1.707 ASSI { 21172} (( segid "PROT" and resid 10 and name HE1 )) (( segid "PROT" and resid 10 and name HG2 )) 6 6 0 peak 21172 weight 0.1000E+01 volume 13.44190 ppm1 3.011 ppm2 1.551 ASSI { 21182} (( segid "PROT" and resid 10 and name HE1 )) (( segid "PROT" and resid 10 and name HG1 )) 6 6 0 peak 21182 weight 0.1000E+01 volume 6.71870 ppm1 3.011 ppm2 1.649 ASSI { 21192} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 104 and name HD1 )) 6 6 0 peak 21192 weight 0.1000E+01 volume 29.91790 ppm1 4.244 ppm2 1.796 ASSI { 21202} (( segid "PROT" and resid 94 and name HA )) (( segid "PROT" and resid 94 and name HG1 )) 6 6 0 peak 21202 weight 0.1000E+01 volume 4.96300 ppm1 2.178 ppm2 1.168 ASSI { 21212} (( segid "PROT" and resid 94 and name HA )) (( segid "PROT" and resid 94 and name HG2 )) 6 6 0 peak 21212 weight 0.1000E+01 volume 9.57620 ppm1 2.178 ppm2 1.055 ASSI { 21222} (( segid "PROT" and resid 63 and name HG2 )) (( segid "PROT" and resid 63 and name HB1 )) 6 6 0 peak 21222 weight 0.1000E+01 volume 4.37580 ppm1 1.195 ppm2 1.982 ASSI { 21232} (( segid "PROT" and resid 61 and name HG2# )) (( segid "PROT" and resid 63 and name HB1 )) 6 6 0 peak 21232 weight 0.1000E+01 volume 11.67730 ppm1 1.093 ppm2 1.993 ASSI { 21242} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 63 and name HB1 )) 6 6 0 peak 21242 weight 0.1000E+01 volume 1.11760 ppm1 6.608 ppm2 2.001 ASSI { 21252} (( segid "PROT" and resid 63 and name HB1 )) (( segid "PROT" and resid 63 and name HG2 )) 6 6 0 peak 21252 weight 0.1000E+01 volume 14.17180 ppm1 1.993 ppm2 1.194 ASSI { 21262} (( segid "PROT" and resid 63 and name HG2 )) (( segid "PROT" and resid 63 and name HG1 )) 6 6 0 peak 21262 weight 0.1000E+01 volume 16.66970 ppm1 1.188 ppm2 1.469 ASSI { 21272} (( segid "PROT" and resid 63 and name HB1 )) (( segid "PROT" and resid 63 and name HG1 )) 6 6 0 peak 21272 weight 0.1000E+01 volume 15.74350 ppm1 1.995 ppm2 1.461 ASSI { 21282} (( segid "PROT" and resid 22 and name HD1# )) (( segid "PROT" and resid 63 and name HG1 )) 6 6 0 peak 21282 weight 0.1000E+01 volume 11.56050 ppm1 1.093 ppm2 1.469 ASSI { 21292} (( segid "PROT" and resid 63 and name HE1 )) (( segid "PROT" and resid 63 and name HD1 )) 6 6 0 peak 21292 weight 0.1000E+01 volume 33.01240 ppm1 2.797 ppm2 1.469 ASSI { 21302} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 63 and name HD1 )) 6 6 0 peak 21302 weight 0.1000E+01 volume 10.91600 ppm1 3.693 ppm2 1.471 ASSI { 21312} (( segid "PROT" and resid 65 and name HD1 )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 21312 weight 0.1000E+01 volume 18.31860 ppm1 1.552 ppm2 1.142 ASSI { 21322} (( segid "PROT" and resid 65 and name HG1 )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 21322 weight 0.1000E+01 volume 20.56410 ppm1 1.881 ppm2 1.137 ASSI { 21332} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 10 and name HB2 )) 6 6 0 peak 21332 weight 0.1000E+01 volume 2.51530 ppm1 3.898 ppm2 1.672 ASSI { 21342} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 10 and name HB2 )) 6 6 0 peak 21342 weight 0.1000E+01 volume 2.10790 ppm1 3.996 ppm2 1.687 ASSI { 21352} (( segid "PROT" and resid 10 and name HB2 )) (( segid "PROT" and resid 10 and name HB1 )) 6 6 0 peak 21352 weight 0.1000E+01 volume 46.87550 ppm1 1.664 ppm2 2.160 ASSI { 21362} (( segid "PROT" and resid 10 and name HB1 )) (( segid "PROT" and resid 10 and name HB2 )) 6 6 0 peak 21362 weight 0.1000E+01 volume 22.64720 ppm1 2.167 ppm2 1.671 ASSI { 21372} (( segid "PROT" and resid 10 and name HA )) (( segid "PROT" and resid 10 and name HB2 )) 6 6 0 peak 21372 weight 0.1000E+01 volume 7.27630 ppm1 4.682 ppm2 1.663 ASSI { 21382} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 10 and name HG1 )) 6 6 0 peak 21382 weight 0.1000E+01 volume 2.80650 ppm1 3.900 ppm2 1.653 ASSI { 21392} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 10 and name HG1 )) 6 6 0 peak 21392 weight 0.1000E+01 volume 2.93550 ppm1 3.984 ppm2 1.655 ASSI { 21402} (( segid "PROT" and resid 11 and name HD1 )) (( segid "PROT" and resid 10 and name HG2 )) 6 6 0 peak 21402 weight 0.1000E+01 volume 3.49560 ppm1 3.990 ppm2 1.537 ASSI { 21412} (( segid "PROT" and resid 11 and name HD2 )) (( segid "PROT" and resid 10 and name HG2 )) 6 6 0 peak 21412 weight 0.1000E+01 volume 3.38300 ppm1 3.903 ppm2 1.549 ASSI { 21422} (( segid "PROT" and resid 10 and name HB1 )) (( segid "PROT" and resid 10 and name HG1 )) 6 6 0 peak 21422 weight 0.1000E+01 volume 8.89430 ppm1 2.165 ppm2 1.655 ASSI { 21432} (( segid "PROT" and resid 10 and name HB1 )) (( segid "PROT" and resid 10 and name HG2 )) 6 6 0 peak 21432 weight 0.1000E+01 volume 11.05460 ppm1 2.166 ppm2 1.546 ASSI { 21442} (( segid "PROT" and resid 10 and name HA )) (( segid "PROT" and resid 10 and name HD1 )) 6 6 0 peak 21442 weight 0.1000E+01 volume 12.45810 ppm1 4.679 ppm2 1.761 ASSI { 21452} (( segid "PROT" and resid 10 and name HB1 )) (( segid "PROT" and resid 10 and name HE1 )) 6 6 0 peak 21452 weight 0.1000E+01 volume 9.34000 ppm1 2.168 ppm2 3.000 ASSI { 21462} (( segid "PROT" and resid 10 and name HD1 )) (( segid "PROT" and resid 10 and name HE1 )) 6 6 0 peak 21462 weight 0.1000E+01 volume 23.34620 ppm1 1.770 ppm2 3.000 ASSI { 21472} (( segid "PROT" and resid 10 and name HG1 )) (( segid "PROT" and resid 10 and name HE1 )) 6 6 0 peak 21472 weight 0.1000E+01 volume 57.75720 ppm1 1.693 ppm2 3.002 ASSI { 21482} (( segid "PROT" and resid 6 and name HG2 )) (( segid "PROT" and resid 6 and name HD1 )) 6 6 0 peak 21482 weight 0.1000E+01 volume 29.09000 ppm1 1.300 ppm2 1.645 ASSI { 21492} (( segid "PROT" and resid 6 and name HG1 )) (( segid "PROT" and resid 6 and name HD1 )) 6 6 0 peak 21492 weight 0.1000E+01 volume 44.03220 ppm1 1.392 ppm2 1.644 ASSI { 21502} (( segid "PROT" and resid 6 and name HA )) (( segid "PROT" and resid 6 and name HD1 )) 6 6 0 peak 21502 weight 0.1000E+01 volume 6.36980 ppm1 4.274 ppm2 1.650 ASSI { 21512} (( segid "PROT" and resid 6 and name HA )) (( segid "PROT" and resid 6 and name HG1 )) 6 6 0 peak 21512 weight 0.1000E+01 volume 10.63830 ppm1 4.272 ppm2 1.388 ASSI { 21522} (( segid "PROT" and resid 6 and name HA )) (( segid "PROT" and resid 6 and name HG2 )) 6 6 0 peak 21522 weight 0.1000E+01 volume 6.56490 ppm1 4.272 ppm2 1.302 ASSI { 21532} (( segid "PROT" and resid 6 and name HG2 )) (( segid "PROT" and resid 6 and name HE1 )) 6 6 0 peak 21532 weight 0.1000E+01 volume 14.09550 ppm1 1.296 ppm2 2.921 ASSI { 21542} (( segid "PROT" and resid 6 and name HG2 )) (( segid "PROT" and resid 6 and name HA )) 6 6 0 peak 21542 weight 0.1000E+01 volume 16.91250 ppm1 1.301 ppm2 4.273 ASSI { 21552} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 7 and name HD1 )) 6 6 0 peak 21552 weight 0.1000E+01 volume 9.69630 ppm1 7.388 ppm2 1.505 ASSI { 21562} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 63 and name HD1 )) 6 6 0 peak 21562 weight 0.1000E+01 volume 4.53750 ppm1 6.609 ppm2 1.469 ASSI { 21572} (( segid "PROT" and resid 7 and name HG2 )) (( segid "PROT" and resid 7 and name HD1 )) 6 6 0 peak 21572 weight 0.1000E+01 volume 15.61500 ppm1 0.964 ppm2 1.498 ASSI { 21582} (( segid "PROT" and resid 7 and name HA )) (( segid "PROT" and resid 7 and name HG2 )) 6 6 0 peak 21582 weight 0.1000E+01 volume 14.62150 ppm1 4.238 ppm2 0.961 ASSI { 21592} (( segid "PROT" and resid 7 and name HD1 )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 21592 weight 0.1000E+01 volume 35.33140 ppm1 1.511 ppm2 2.675 ASSI { 21602} (( segid "PROT" and resid 7 and name HB1 )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 21602 weight 0.1000E+01 volume 10.85290 ppm1 1.608 ppm2 2.680 ASSI { 21612} (( segid "PROT" and resid 7 and name HG1 )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 21612 weight 0.1000E+01 volume 19.67660 ppm1 1.095 ppm2 2.682 ASSI { 21622} (( segid "PROT" and resid 7 and name HG2 )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 21622 weight 0.1000E+01 volume 24.81490 ppm1 0.967 ppm2 2.673 ASSI { 21632} (( segid "PROT" and resid 7 and name HA )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 21632 weight 0.1000E+01 volume 4.63970 ppm1 4.238 ppm2 2.684 ASSI { 21642} (( segid "PROT" and resid 9 and name HA )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 21642 weight 0.1000E+01 volume 5.72450 ppm1 4.651 ppm2 2.680 ASSI { 21652} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 21652 weight 0.1000E+01 volume 9.17220 ppm1 7.392 ppm2 2.680 ASSI { 21662} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 7 and name HG2 )) 6 6 0 peak 21662 weight 0.1000E+01 volume 2.20720 ppm1 7.384 ppm2 0.963 ASSI { 21672} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 7 and name HA )) 6 6 0 peak 21672 weight 0.1000E+01 volume 3.47630 ppm1 7.395 ppm2 4.243 ASSI { 21682} (( segid "PROT" and resid 94 and name HE1 )) (( segid "PROT" and resid 94 and name HD1 )) 6 6 0 peak 21682 weight 0.1000E+01 volume 51.77930 ppm1 2.883 ppm2 1.507 ASSI { 21692} (( segid "PROT" and resid 93 and name HA )) (( segid "PROT" and resid 93 and name HB2 )) 6 6 0 peak 21692 weight 0.1000E+01 volume 9.60730 ppm1 4.310 ppm2 1.714 ASSI { 21702} (( segid "PROT" and resid 99 and name HD1 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 21702 weight 0.1000E+01 volume 5.03290 ppm1 7.125 ppm2 2.179 ASSI { 21712} (( segid "PROT" and resid 99 and name HB1 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 21712 weight 0.1000E+01 volume 1.74920 ppm1 3.408 ppm2 2.175 ASSI { 21722} (( segid "PROT" and resid 31 and name HG2 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 21722 weight 0.1000E+01 volume 4.56830 ppm1 1.582 ppm2 2.589 ASSI { 21732} (( segid "PROT" and resid 31 and name HG1 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 21732 weight 0.1000E+01 volume 2.89160 ppm1 2.304 ppm2 2.589 ASSI { 21742} (( segid "PROT" and resid 28 and name HB2 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 21742 weight 0.1000E+01 volume 2.05660 ppm1 2.053 ppm2 2.591 ASSI { 21752} (( segid "PROT" and resid 101 and name HB1 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 21752 weight 0.1000E+01 volume 2.47500 ppm1 3.921 ppm2 2.587 ASSI { 21762} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 21762 weight 0.1000E+01 volume 2.93570 ppm1 7.100 ppm2 2.581 ASSI { 21772} (( segid "PROT" and resid 94 and name HG2 )) (( segid "PROT" and resid 94 and name HD1 )) 6 6 0 peak 21772 weight 0.1000E+01 volume 99.27350 ppm1 1.088 ppm2 1.495 ASSI { 21782} (( segid "PROT" and resid 94 and name HG1 )) (( segid "PROT" and resid 94 and name HD1 )) 6 6 0 peak 21782 weight 0.1000E+01 volume 81.66110 ppm1 1.174 ppm2 1.489 ASSI { 21792} (( segid "PROT" and resid 94 and name HA )) (( segid "PROT" and resid 94 and name HD1 )) 6 6 0 peak 21792 weight 0.1000E+01 volume 12.65290 ppm1 2.175 ppm2 1.504 ASSI { 21802} (( segid "PROT" and resid 94 and name HB2 )) (( segid "PROT" and resid 94 and name HG2 )) 6 6 0 peak 21802 weight 0.1000E+01 volume 23.37480 ppm1 1.369 ppm2 1.057 ASSI { 21812} (( segid "PROT" and resid 94 and name HB1 )) (( segid "PROT" and resid 94 and name HG2 )) 6 6 0 peak 21812 weight 0.1000E+01 volume 34.68000 ppm1 1.436 ppm2 1.063 ASSI { 21822} (( segid "PROT" and resid 94 and name HB2 )) (( segid "PROT" and resid 94 and name HG1 )) 6 6 0 peak 21822 weight 0.1000E+01 volume 32.99570 ppm1 1.371 ppm2 1.176 ASSI { 21832} (( segid "PROT" and resid 63 and name HG1 )) (( segid "PROT" and resid 63 and name HG2 )) 6 6 0 peak 21832 weight 0.1000E+01 volume 101.89410 ppm1 1.471 ppm2 1.186 ASSI { 21842} (( segid "PROT" and resid 94 and name HD1 )) (( segid "PROT" and resid 94 and name HG2 )) 6 6 0 peak 21842 weight 0.1000E+01 volume 25.87990 ppm1 1.502 ppm2 1.063 ASSI { 21852} (( segid "PROT" and resid 94 and name HG2 )) (( segid "PROT" and resid 94 and name HE1 )) 6 6 0 peak 21852 weight 0.1000E+01 volume 44.46470 ppm1 1.060 ppm2 2.878 ASSI { 21862} (( segid "PROT" and resid 94 and name HG1 )) (( segid "PROT" and resid 94 and name HE1 )) 6 6 0 peak 21862 weight 0.1000E+01 volume 41.76160 ppm1 1.170 ppm2 2.879 ASSI { 21872} (( segid "PROT" and resid 89 and name HB2 )) (( segid "PROT" and resid 89 and name HA )) 6 6 0 peak 21872 weight 0.1000E+01 volume 0.58110 ppm1 3.121 ppm2 4.815 ASSI { 21882} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 64 and name HD1 )) 6 6 0 peak 21882 weight 0.1000E+01 volume 5.95670 ppm1 4.170 ppm2 3.204 ASSI { 21892} (( segid "PROT" and resid 93 and name HA )) (( segid "PROT" and resid 93 and name HD1 )) 6 6 0 peak 21892 weight 0.1000E+01 volume 8.19650 ppm1 4.309 ppm2 3.172 ASSI { 21902} (( segid "PROT" and resid 6 and name HB1 )) (( segid "PROT" and resid 6 and name HA )) 6 6 0 peak 21902 weight 0.1000E+01 volume 62.48950 ppm1 1.781 ppm2 4.275 ASSI { 21912} (( segid "PROT" and resid 92 and name HA )) (( segid "PROT" and resid 92 and name HB2 )) 6 6 0 peak 21912 weight 0.1000E+01 volume 5.64800 ppm1 4.651 ppm2 2.859 ASSI { 21922} (( segid "PROT" and resid 93 and name HD1 )) (( segid "PROT" and resid 93 and name HB2 )) 6 6 0 peak 21922 weight 0.1000E+01 volume 11.64070 ppm1 3.167 ppm2 1.722 ASSI { 21932} (( segid "PROT" and resid 93 and name HD1 )) (( segid "PROT" and resid 93 and name HB1 )) 6 6 0 peak 21932 weight 0.1000E+01 volume 13.97840 ppm1 3.171 ppm2 1.896 ASSI { 21942} (( segid "PROT" and resid 93 and name HD1 )) (( segid "PROT" and resid 93 and name HG1 )) 6 6 0 peak 21942 weight 0.1000E+01 volume 39.80640 ppm1 3.178 ppm2 1.725 ASSI { 21952} (( segid "PROT" and resid 93 and name HA )) (( segid "PROT" and resid 93 and name HG1 )) 6 6 0 peak 21952 weight 0.1000E+01 volume 11.98250 ppm1 4.304 ppm2 1.741 ASSI { 21962} (( segid "PROT" and resid 93 and name HG1 )) (( segid "PROT" and resid 93 and name HD1 )) 6 6 0 peak 21962 weight 0.1000E+01 volume 57.03720 ppm1 1.738 ppm2 3.169 ASSI { 21972} (( segid "PROT" and resid 5 and name HB1 )) (( segid "PROT" and resid 5 and name HA )) 6 6 0 peak 21972 weight 0.1000E+01 volume 20.36760 ppm1 1.832 ppm2 4.314 ASSI { 21982} (( segid "PROT" and resid 94 and name HE1 )) (( segid "PROT" and resid 95 and name HA )) 6 6 0 peak 21982 weight 0.1000E+01 volume 13.07080 ppm1 2.921 ppm2 4.102 ASSI { 21992} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 100 and name HG1 )) 6 6 0 peak 21992 weight 0.1000E+01 volume 2.58550 ppm1 7.126 ppm2 1.709 ASSI { 22002} (( segid "PROT" and resid 100 and name HA )) (( segid "PROT" and resid 100 and name HG2 )) 6 6 0 peak 22002 weight 0.1000E+01 volume 15.28410 ppm1 4.323 ppm2 1.594 ASSI { 22012} (( segid "PROT" and resid 100 and name HA )) (( segid "PROT" and resid 100 and name HG1 )) 6 6 0 peak 22012 weight 0.1000E+01 volume 3.33820 ppm1 4.323 ppm2 1.705 ASSI { 22022} (( segid "PROT" and resid 100 and name HB1 )) (( segid "PROT" and resid 100 and name HG1 )) 6 6 0 peak 22022 weight 0.1000E+01 volume 22.48510 ppm1 2.036 ppm2 1.698 ASSI { 22032} (( segid "PROT" and resid 100 and name HB1 )) (( segid "PROT" and resid 100 and name HG2 )) 6 6 0 peak 22032 weight 0.1000E+01 volume 29.73720 ppm1 2.037 ppm2 1.602 ASSI { 22042} (( segid "PROT" and resid 100 and name HE1 )) (( segid "PROT" and resid 100 and name HB1 )) 6 6 0 peak 22042 weight 0.1000E+01 volume 4.66540 ppm1 2.921 ppm2 2.032 ASSI { 22052} (( segid "PROT" and resid 99 and name HD1 )) (( segid "PROT" and resid 99 and name HA )) 6 6 0 peak 22052 weight 0.1000E+01 volume 3.50450 ppm1 7.128 ppm2 3.783 ASSI { 22062} (( segid "PROT" and resid 13 and name HA )) (( segid "PROT" and resid 13 and name HB2 )) 6 6 0 peak 22062 weight 0.1000E+01 volume 67.98270 ppm1 4.131 ppm2 2.216 ASSI { 22072} (( segid "PROT" and resid 114 and name HA )) (( segid "PROT" and resid 117 and name HB1 )) 6 6 0 peak 22072 weight 0.1000E+01 volume 3.79580 ppm1 4.552 ppm2 2.212 ASSI { 22082} (( segid "PROT" and resid 114 and name HA )) (( segid "PROT" and resid 117 and name HB2 )) 6 6 0 peak 22082 weight 0.1000E+01 volume 1.40010 ppm1 4.554 ppm2 1.982 ASSI { 22092} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 59 and name HA )) 6 6 0 peak 22092 weight 0.1000E+01 volume 3.55600 ppm1 1.190 ppm2 3.827 ASSI { 22102} (( segid "PROT" and resid 64 and name HG1 )) (( segid "PROT" and resid 64 and name HA )) 6 6 0 peak 22102 weight 0.1000E+01 volume 8.39300 ppm1 1.669 ppm2 4.165 ASSI { 22112} (( segid "PROT" and resid 34 and name HG2 )) (( segid "PROT" and resid 34 and name HA )) 6 6 0 peak 22112 weight 0.1000E+01 volume 2.24370 ppm1 1.792 ppm2 4.359 ASSI { 22122} (( segid "PROT" and resid 34 and name HD1 )) (( segid "PROT" and resid 34 and name HA )) 6 6 0 peak 22122 weight 0.1000E+01 volume 2.16670 ppm1 3.825 ppm2 4.359 ASSI { 22132} (( segid "PROT" and resid 34 and name HA )) (( segid "PROT" and resid 34 and name HD1 )) 6 6 0 peak 22132 weight 0.1000E+01 volume 1.72360 ppm1 4.362 ppm2 3.832 ASSI { 22142} (( segid "PROT" and resid 36 and name HN )) (( segid "PROT" and resid 34 and name HD1 )) 6 6 0 peak 22142 weight 0.1000E+01 volume 1.56410 ppm1 7.095 ppm2 3.804 ASSI { 22152} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 34 and name HD1 )) 6 6 0 peak 22152 weight 0.1000E+01 volume 3.00390 ppm1 7.384 ppm2 3.800 ASSI { 22162} (( segid "PROT" and resid 33 and name HB2 )) (( segid "PROT" and resid 34 and name HD1 )) 6 6 0 peak 22162 weight 0.1000E+01 volume 3.71080 ppm1 1.588 ppm2 3.809 ASSI { 22172} (( segid "PROT" and resid 34 and name HG2 )) (( segid "PROT" and resid 34 and name HD1 )) 6 6 0 peak 22172 weight 0.1000E+01 volume 5.83610 ppm1 1.789 ppm2 3.808 ASSI { 22182} (( segid "PROT" and resid 34 and name HB2 )) (( segid "PROT" and resid 34 and name HD1 )) 6 6 0 peak 22182 weight 0.1000E+01 volume 3.30250 ppm1 0.612 ppm2 3.805 ASSI { 22192} (( segid "PROT" and resid 34 and name HD1 )) (( segid "PROT" and resid 34 and name HG1 )) 6 6 0 peak 22192 weight 0.1000E+01 volume 8.12990 ppm1 3.820 ppm2 1.957 ASSI { 22202} (( segid "PROT" and resid 34 and name HD1 )) (( segid "PROT" and resid 34 and name HG2 )) 6 6 0 peak 22202 weight 0.1000E+01 volume 11.27750 ppm1 3.794 ppm2 1.785 ASSI { 22212} (( segid "PROT" and resid 34 and name HA )) (( segid "PROT" and resid 34 and name HG2 )) 6 6 0 peak 22212 weight 0.1000E+01 volume 5.62310 ppm1 4.356 ppm2 1.758 ASSI { 22222} (( segid "PROT" and resid 34 and name HA )) (( segid "PROT" and resid 34 and name HG1 )) 6 6 0 peak 22222 weight 0.1000E+01 volume 3.77730 ppm1 4.356 ppm2 1.957 ASSI { 22232} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 104 and name HD1 )) 6 6 0 peak 22232 weight 0.1000E+01 volume 1.64370 ppm1 7.095 ppm2 1.790 ASSI { 22242} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 34 and name HG1 )) 6 6 0 peak 22242 weight 0.1000E+01 volume 2.33290 ppm1 7.100 ppm2 1.957 ASSI { 22252} (( segid "PROT" and resid 24 and name HA )) (( segid "PROT" and resid 27 and name HG1 )) 6 6 0 peak 22252 weight 0.1000E+01 volume 23.25480 ppm1 3.949 ppm2 1.693 ASSI { 22262} (( segid "PROT" and resid 58 and name HB1 )) (( segid "PROT" and resid 58 and name HB2 )) 6 6 0 peak 22262 weight 0.1000E+01 volume 11.95920 ppm1 2.592 ppm2 2.303 ASSI { 22272} (( segid "PROT" and resid 57 and name HA )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 22272 weight 0.1000E+01 volume 5.17110 ppm1 5.064 ppm2 0.882 ASSI { 22282} (( segid "PROT" and resid 64 and name HB1 )) (( segid "PROT" and resid 64 and name HD1 )) 6 6 0 peak 22282 weight 0.1000E+01 volume 31.00780 ppm1 2.004 ppm2 3.200 ASSI { 22292} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 64 and name HD1 )) 6 6 0 peak 22292 weight 0.1000E+01 volume 9.00770 ppm1 1.224 ppm2 3.204 ASSI { 22302} (( segid "PROT" and resid 64 and name HG2 )) (( segid "PROT" and resid 64 and name HD1 )) 6 6 0 peak 22302 weight 0.1000E+01 volume 59.69240 ppm1 1.500 ppm2 3.207 ASSI { 22312} (( segid "PROT" and resid 64 and name HD1 )) (( segid "PROT" and resid 64 and name HB1 )) 6 6 0 peak 22312 weight 0.1000E+01 volume 7.64960 ppm1 3.205 ppm2 1.984 ASSI { 22322} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 64 and name HB1 )) 6 6 0 peak 22322 weight 0.1000E+01 volume 29.40350 ppm1 4.161 ppm2 1.988 ASSI { 22332} (( segid "PROT" and resid 64 and name HG2 )) (( segid "PROT" and resid 64 and name HB1 )) 6 6 0 peak 22332 weight 0.1000E+01 volume 17.58660 ppm1 1.501 ppm2 1.978 ASSI { 22342} (( segid "PROT" and resid 64 and name HD1 )) (( segid "PROT" and resid 64 and name HG2 )) 6 6 0 peak 22342 weight 0.1000E+01 volume 11.55700 ppm1 3.222 ppm2 1.498 ASSI { 22352} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 64 and name HG2 )) 6 6 0 peak 22352 weight 0.1000E+01 volume 14.55090 ppm1 4.169 ppm2 1.498 ASSI { 22362} (( segid "PROT" and resid 64 and name HG2 )) (( segid "PROT" and resid 64 and name HG1 )) 6 6 0 peak 22362 weight 0.1000E+01 volume 93.20730 ppm1 1.506 ppm2 1.667 ASSI { 22372} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 64 and name HG1 )) 6 6 0 peak 22372 weight 0.1000E+01 volume 13.70330 ppm1 1.222 ppm2 1.667 ASSI { 22382} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 64 and name HG1 )) 6 6 0 peak 22382 weight 0.1000E+01 volume 16.76770 ppm1 4.174 ppm2 1.678 ASSI { 22392} (( segid "PROT" and resid 78 and name HG1# )) (( segid "PROT" and resid 75 and name HA )) 6 6 0 peak 22392 weight 0.1000E+01 volume 6.50620 ppm1 1.254 ppm2 4.198 ASSI { 22402} (( segid "PROT" and resid 78 and name HG2# )) (( segid "PROT" and resid 75 and name HA )) 6 6 0 peak 22402 weight 0.1000E+01 volume 7.56160 ppm1 1.114 ppm2 4.204 ASSI { 22412} (( segid "PROT" and resid 55 and name HB1 )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 22412 weight 0.1000E+01 volume 14.31280 ppm1 2.738 ppm2 0.888 ASSI { 22422} (( segid "PROT" and resid 57 and name HG1 )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 22422 weight 0.1000E+01 volume 6.78130 ppm1 3.003 ppm2 0.888 ASSI { 22432} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 22432 weight 0.1000E+01 volume 54.56370 ppm1 0.883 ppm2 1.096 ASSI { 22442} (( segid "PROT" and resid 55 and name HB1 )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 22442 weight 0.1000E+01 volume 28.46650 ppm1 2.738 ppm2 1.097 ASSI { 22452} (( segid "PROT" and resid 86 and name HB1 )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 22452 weight 0.1000E+01 volume 4.10430 ppm1 3.117 ppm2 1.108 ASSI { 22462} (( segid "PROT" and resid 86 and name HB2 )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 22462 weight 0.1000E+01 volume 2.63560 ppm1 2.887 ppm2 1.108 ASSI { 22472} (( segid "PROT" and resid 74 and name HD1 )) (( segid "PROT" and resid 74 and name HG2 )) 6 6 0 peak 22472 weight 0.1000E+01 volume 11.76670 ppm1 3.773 ppm2 1.411 ASSI { 22482} (( segid "PROT" and resid 83 and name HB1 )) (( segid "PROT" and resid 83 and name HG )) 6 6 0 peak 22482 weight 0.1000E+01 volume 9.98540 ppm1 2.160 ppm2 1.410 ASSI { 22492} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 74 and name HG1 )) 6 6 0 peak 22492 weight 0.1000E+01 volume 11.70730 ppm1 0.607 ppm2 1.793 ASSI { 22502} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 74 and name HG2 )) 6 6 0 peak 22502 weight 0.1000E+01 volume 7.65740 ppm1 0.611 ppm2 1.407 ASSI { 22512} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 74 and name HG2 )) 6 6 0 peak 22512 weight 0.1000E+01 volume 8.80880 ppm1 0.266 ppm2 1.408 ASSI { 22522} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 74 and name HG2 )) 6 6 0 peak 22522 weight 0.1000E+01 volume 3.36470 ppm1 0.354 ppm2 1.410 ASSI { 22532} (( segid "PROT" and resid 57 and name HA )) (( segid "PROT" and resid 61 and name HB )) 6 6 0 peak 22532 weight 0.1000E+01 volume 2.00300 ppm1 5.069 ppm2 4.228 ASSI { 22542} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 117 and name HA )) 6 6 0 peak 22542 weight 0.1000E+01 volume 3.06580 ppm1 0.772 ppm2 4.307 ASSI { 22552} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 22 and name HA )) 6 6 0 peak 22552 weight 0.1000E+01 volume 1.67940 ppm1 0.889 ppm2 4.307 ASSI { 22562} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 117 and name HA )) 6 6 0 peak 22562 weight 0.1000E+01 volume 3.25940 ppm1 0.607 ppm2 4.299 ASSI { 22572} (( segid "PROT" and resid 117 and name HB2 )) (( segid "PROT" and resid 117 and name HA )) 6 6 0 peak 22572 weight 0.1000E+01 volume 9.40620 ppm1 1.975 ppm2 4.301 ASSI { 22582} (( segid "PROT" and resid 117 and name HB2 )) (( segid "PROT" and resid 114 and name HA )) 6 6 0 peak 22582 weight 0.1000E+01 volume 2.41060 ppm1 1.988 ppm2 4.549 ASSI { 22592} (( segid "PROT" and resid 84 and name HG1 )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 22592 weight 0.1000E+01 volume 15.37610 ppm1 2.580 ppm2 1.217 ASSI { 22602} (( segid "PROT" and resid 94 and name HA )) (( segid "PROT" and resid 94 and name HB1 )) 6 6 0 peak 22602 weight 0.1000E+01 volume 47.26770 ppm1 2.174 ppm2 1.401 ASSI { 22612} (( segid "PROT" and resid 84 and name HB1 )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 22612 weight 0.1000E+01 volume 2.77600 ppm1 2.210 ppm2 2.474 ASSI { 22622} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 84 and name HG2 )) 6 6 0 peak 22622 weight 0.1000E+01 volume 3.60690 ppm1 1.241 ppm2 1.831 ASSI { 22632} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 56 and name HB2 )) 6 6 0 peak 22632 weight 0.1000E+01 volume 30.15060 ppm1 2.442 ppm2 2.141 ASSI { 22642} (( segid "PROT" and resid 84 and name HB1 )) (( segid "PROT" and resid 84 and name HA )) 6 6 0 peak 22642 weight 0.1000E+01 volume 6.89680 ppm1 2.199 ppm2 3.650 ASSI { 22652} (( segid "PROT" and resid 41 and name HB1 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 22652 weight 0.1000E+01 volume 3.89660 ppm1 2.318 ppm2 -0.372 ASSI { 22662} (( segid "PROT" and resid 41 and name HB2 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 22662 weight 0.1000E+01 volume 5.62340 ppm1 1.709 ppm2 -0.371 ASSI { 22672} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 25 and name HA )) 6 6 0 peak 22672 weight 0.1000E+01 volume 1.61610 ppm1 0.393 ppm2 4.102 ASSI { 22692} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 22692 weight 0.1000E+01 volume 2.60300 ppm1 0.579 ppm2 1.165 ASSI { 22702} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 8 and name HD1# )) 6 6 0 peak 22702 weight 0.1000E+01 volume 18.13130 ppm1 0.682 ppm2 0.826 ASSI { 22712} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 8 and name HD1# )) 6 6 0 peak 22712 weight 0.1000E+01 volume 5.33160 ppm1 0.367 ppm2 0.826 ASSI { 22732} (( segid "PROT" and resid 27 and name HG1 )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 22732 weight 0.1000E+01 volume 11.47920 ppm1 1.700 ppm2 1.414 ASSI { 22742} (( segid "PROT" and resid 27 and name HB1 )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 22742 weight 0.1000E+01 volume 4.42820 ppm1 1.897 ppm2 1.413 ASSI { 22752} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 107 and name HB1 )) 6 6 0 peak 22752 weight 0.1000E+01 volume 3.96450 ppm1 0.956 ppm2 2.259 ASSI { 22762} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 104 and name HE1 )) 6 6 0 peak 22762 weight 0.1000E+01 volume 25.55040 ppm1 0.961 ppm2 2.831 ASSI { 22772} (( segid "PROT" and resid 94 and name HE1 )) (( segid "PROT" and resid 94 and name HB2 )) 6 6 0 peak 22772 weight 0.1000E+01 volume 6.30700 ppm1 2.887 ppm2 1.387 ASSI { 22782} (( segid "PROT" and resid 10 and name HE1 )) (( segid "PROT" and resid 10 and name HD1 )) 6 6 0 peak 22782 weight 0.1000E+01 volume 31.98530 ppm1 3.007 ppm2 1.714 ASSI { 22792} (( segid "PROT" and resid 94 and name HD1 )) (( segid "PROT" and resid 94 and name HE1 )) 6 6 0 peak 22792 weight 0.1000E+01 volume 106.47320 ppm1 1.507 ppm2 2.881 ASSI { 22802} (( segid "PROT" and resid 104 and name HD1 )) (( segid "PROT" and resid 104 and name HE1 )) 6 6 0 peak 22802 weight 0.1000E+01 volume 33.97620 ppm1 1.795 ppm2 2.819 ASSI { 22812} (( segid "PROT" and resid 104 and name HA )) (( segid "PROT" and resid 104 and name HE1 )) 6 6 0 peak 22812 weight 0.1000E+01 volume 10.74890 ppm1 4.240 ppm2 2.829 ASSI { 22822} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 63 and name HE1 )) 6 6 0 peak 22822 weight 0.1000E+01 volume 4.57300 ppm1 6.603 ppm2 2.803 ASSI { 22832} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 22832 weight 0.1000E+01 volume 2.40270 ppm1 7.321 ppm2 2.578 ASSI { 22842} (( segid "PROT" and resid 31 and name HG1 )) (( segid "PROT" and resid 31 and name HG2 )) 6 6 0 peak 22842 weight 0.1000E+01 volume 2.10200 ppm1 2.305 ppm2 1.589 ASSI { 22852} (( segid "PROT" and resid 31 and name HG2 )) (( segid "PROT" and resid 31 and name HG1 )) 6 6 0 peak 22852 weight 0.1000E+01 volume 6.18800 ppm1 1.595 ppm2 2.287 ASSI { 22862} (( segid "PROT" and resid 101 and name HA )) (( segid "PROT" and resid 31 and name HG1 )) 6 6 0 peak 22862 weight 0.1000E+01 volume 1.21350 ppm1 4.505 ppm2 2.298 ASSI { 22872} (( segid "PROT" and resid 101 and name HA )) (( segid "PROT" and resid 31 and name HG2 )) 6 6 0 peak 22872 weight 0.1000E+01 volume 1.45810 ppm1 4.514 ppm2 1.598 ASSI { 22882} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 31 and name HG1 )) 6 6 0 peak 22882 weight 0.1000E+01 volume 1.38370 ppm1 7.101 ppm2 2.305 ASSI { 22892} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 31 and name HG2 )) 6 6 0 peak 22892 weight 0.1000E+01 volume 1.45660 ppm1 7.096 ppm2 1.574 ASSI { 22902} (( segid "PROT" and resid 89 and name HD1 )) (( segid "PROT" and resid 89 and name HA )) 6 6 0 peak 22902 weight 0.1000E+01 volume 0.48780 ppm1 4.993 ppm2 4.808 ASSI { 22912} (( segid "PROT" and resid 71 and name HD1 )) (( segid "PROT" and resid 71 and name HA )) 6 6 0 peak 22912 weight 0.1000E+01 volume 0.51990 ppm1 6.870 ppm2 4.765 ASSI { 22932} (( segid "PROT" and resid 71 and name HB1 )) (( segid "PROT" and resid 71 and name HA )) 6 6 0 peak 22932 weight 0.1000E+01 volume 1.80160 ppm1 2.754 ppm2 4.776 ASSI { 22962} (( segid "PROT" and resid 63 and name HG2 )) (( segid "PROT" and resid 63 and name HE1 )) 6 6 0 peak 22962 weight 0.1000E+01 volume 19.28330 ppm1 1.199 ppm2 2.807 ASSI { 22972} (( segid "PROT" and resid 65 and name HE1 )) (( segid "PROT" and resid 65 and name HB2 )) 6 6 0 peak 22972 weight 0.1000E+01 volume 1.76540 ppm1 2.348 ppm2 0.555 ASSI { 22982} (( segid "PROT" and resid 65 and name HB2 )) (( segid "PROT" and resid 65 and name HB1 )) 6 6 0 peak 22982 weight 0.1000E+01 volume 3.15400 ppm1 0.570 ppm2 1.959 ASSI { 22992} (( segid "PROT" and resid 109 and name HA )) (( segid "PROT" and resid 25 and name HD1# )) 6 6 0 peak 22992 weight 0.1000E+01 volume 3.73720 ppm1 4.031 ppm2 0.661 ASSI { 23002} (( segid "PROT" and resid 91 and name HA )) (( segid "PROT" and resid 90 and name HD2# )) 6 6 0 peak 23002 weight 0.1000E+01 volume 8.75630 ppm1 4.010 ppm2 0.983 ASSI { 23012} (( segid "PROT" and resid 14 and name HB2 )) (( segid "PROT" and resid 11 and name HA )) 6 6 0 peak 23012 weight 0.1000E+01 volume 1.98320 ppm1 1.304 ppm2 4.227 ASSI { 23022} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 120 and name HB2 )) 6 6 0 peak 23022 weight 0.1000E+01 volume 4.36810 ppm1 7.389 ppm2 1.627 ASSI { 23032} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 28 and name HG2 )) 6 6 0 peak 23032 weight 0.1000E+01 volume 11.76160 ppm1 0.881 ppm2 2.055 ASSI { 23042} (( segid "PROT" and resid 101 and name HA )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 23042 weight 0.1000E+01 volume 1.01980 ppm1 4.506 ppm2 2.576 ASSI { 23052} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 32 and name HA )) 6 6 0 peak 23052 weight 0.1000E+01 volume 3.88870 ppm1 7.372 ppm2 4.352 ASSI { 23062} (( segid "PROT" and resid 95 and name HA )) (( segid "PROT" and resid 94 and name HE1 )) 6 6 0 peak 23062 weight 0.1000E+01 volume 14.22050 ppm1 4.100 ppm2 2.928 ASSI { 23082} (( segid "PROT" and resid 63 and name HE1 )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 23082 weight 0.1000E+01 volume 2.54700 ppm1 2.800 ppm2 1.088 ASSI { 23092} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 23092 weight 0.1000E+01 volume 2.11030 ppm1 0.343 ppm2 1.087 ASSI { 23102} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 23102 weight 0.1000E+01 volume 8.08870 ppm1 0.733 ppm2 1.094 ASSI { 23112} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 59 and name HB1 )) 6 6 0 peak 23112 weight 0.1000E+01 volume 0.45380 ppm1 6.614 ppm2 1.709 ASSI { 23122} (( segid "PROT" and resid 38 and name HD2 )) (( segid "PROT" and resid 37 and name HG2 )) 6 6 0 peak 23122 weight 0.1000E+01 volume 2.79840 ppm1 3.455 ppm2 2.142 ASSI { 23132} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 23132 weight 0.1000E+01 volume 2.39720 ppm1 1.765 ppm2 4.029 ASSI { 23142} (( segid "PROT" and resid 112 and name HB1 )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 23142 weight 0.1000E+01 volume 2.74160 ppm1 2.005 ppm2 4.031 ASSI { 23152} (( segid "PROT" and resid 43 and name HD1# )) (( segid "PROT" and resid 40 and name HB1 )) 6 6 0 peak 23152 weight 0.1000E+01 volume 8.25470 ppm1 0.833 ppm2 2.919 ASSI { 23162} (( segid "PROT" and resid 117 and name HG2 )) (( segid "PROT" and resid 113 and name HG11 )) 6 6 0 peak 23162 weight 0.1000E+01 volume 2.26360 ppm1 2.510 ppm2 1.215 ASSI { 23172} (( segid "PROT" and resid 18 and name HD1# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 23172 weight 0.1000E+01 volume 3.78630 ppm1 0.234 ppm2 1.112 ASSI { 23182} (( segid "PROT" and resid 115 and name HB1 )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 23182 weight 0.1000E+01 volume 91.70070 ppm1 2.277 ppm2 2.041 ASSI { 23192} (( segid "PROT" and resid 116 and name HA )) (( segid "PROT" and resid 119 and name HB2 )) 6 6 0 peak 23192 weight 0.1000E+01 volume 26.17640 ppm1 3.673 ppm2 4.000 ASSI { 23202} (( segid "PROT" and resid 113 and name HA )) (( segid "PROT" and resid 116 and name HG1# )) 6 6 0 peak 23202 weight 0.1000E+01 volume 17.02340 ppm1 4.097 ppm2 1.037 ASSI { 23212} (( segid "PROT" and resid 117 and name HE# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 23212 weight 0.1000E+01 volume 10.91700 ppm1 1.472 ppm2 1.112 ASSI { 23222} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 120 and name HB2 )) 6 6 0 peak 23222 weight 0.1000E+01 volume 2.38600 ppm1 4.309 ppm2 1.634 ASSI { 23232} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 23232 weight 0.1000E+01 volume 1.08670 ppm1 4.309 ppm2 0.659 ASSI { 23242} (( segid "PROT" and resid 17 and name HA )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 23242 weight 0.1000E+01 volume 2.41430 ppm1 4.182 ppm2 0.660 ASSI { 23252} (( segid "PROT" and resid 119 and name HB2 )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 23252 weight 0.1000E+01 volume 0.60620 ppm1 3.976 ppm2 0.656 ASSI { 23262} (( segid "PROT" and resid 52 and name HD1# )) (( segid "PROT" and resid 91 and name HB2 )) 6 6 0 peak 23262 weight 0.1000E+01 volume 2.48690 ppm1 0.882 ppm2 2.947 ASSI { 23272} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 52 and name HG2# )) 6 6 0 peak 23272 weight 0.1000E+01 volume 1.68040 ppm1 0.608 ppm2 0.997 ASSI { 23282} (( segid "PROT" and resid 50 and name HA )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 23282 weight 0.1000E+01 volume 1.54980 ppm1 4.974 ppm2 0.607 ASSI { 23292} (( segid "PROT" and resid 83 and name HD1# )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 23292 weight 0.1000E+01 volume 2.35380 ppm1 0.889 ppm2 5.243 ASSI { 23302} (( segid "PROT" and resid 83 and name HD2# )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 23302 weight 0.1000E+01 volume 1.32880 ppm1 1.107 ppm2 5.245 ASSI { 23312} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 105 and name HD2# )) 6 6 0 peak 23312 weight 0.1000E+01 volume 4.60660 ppm1 0.958 ppm2 0.564 ASSI { 23322} (( segid "PROT" and resid 10 and name HB2 )) (( segid "PROT" and resid 13 and name HB1 )) 6 6 0 peak 23322 weight 0.1000E+01 volume 4.08430 ppm1 1.672 ppm2 2.415 ASSI { 23332} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 23332 weight 0.1000E+01 volume 8.05780 ppm1 0.609 ppm2 0.352 ASSI { 23342} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 23342 weight 0.1000E+01 volume 7.34160 ppm1 0.660 ppm2 0.350 ASSI { 23352} (( segid "PROT" and resid 65 and name HB2 )) (( segid "PROT" and resid 65 and name HE1 )) 6 6 0 peak 23352 weight 0.1000E+01 volume 5.50660 ppm1 0.564 ppm2 2.381 ASSI { 23362} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 15 and name HB1 )) 6 6 0 peak 23362 weight 0.1000E+01 volume 4.30700 ppm1 0.882 ppm2 1.903 ASSI { 23372} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 15 and name HG1 )) 6 6 0 peak 23372 weight 0.1000E+01 volume 7.69960 ppm1 0.736 ppm2 1.539 ASSI { 23382} (( segid "PROT" and resid 120 and name HB1 )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 23382 weight 0.1000E+01 volume 11.86200 ppm1 1.782 ppm2 1.335 ASSI { 23392} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 23392 weight 0.1000E+01 volume 4.60090 ppm1 2.072 ppm2 1.337 ASSI { 23402} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 23402 weight 0.1000E+01 volume 13.34330 ppm1 1.551 ppm2 1.334 ASSI { 23412} (( segid "PROT" and resid 120 and name HB2 )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 23412 weight 0.1000E+01 volume 4.41290 ppm1 1.635 ppm2 1.334 ASSI { 23422} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 23422 weight 0.1000E+01 volume 1.74110 ppm1 1.042 ppm2 4.185 ASSI { 23432} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 23432 weight 0.1000E+01 volume 16.91370 ppm1 0.835 ppm2 0.740 ASSI { 23442} (( segid "PROT" and resid 18 and name HB2 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 23442 weight 0.1000E+01 volume 6.46730 ppm1 0.344 ppm2 0.734 ASSI { 23452} (( segid "PROT" and resid 18 and name HB2 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 23452 weight 0.1000E+01 volume 13.59990 ppm1 0.350 ppm2 0.829 ASSI { 23462} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 23462 weight 0.1000E+01 volume 3.04380 ppm1 0.506 ppm2 0.831 ASSI { 23472} (( segid "PROT" and resid 18 and name HB2 )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 23472 weight 0.1000E+01 volume 3.72190 ppm1 0.349 ppm2 0.771 ASSI { 23482} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 23482 weight 0.1000E+01 volume 33.71350 ppm1 0.611 ppm2 0.771 ASSI { 23492} (( segid "PROT" and resid 19 and name HG2 )) (( segid "PROT" and resid 19 and name HA )) 6 6 0 peak 23492 weight 0.1000E+01 volume 5.47690 ppm1 2.552 ppm2 4.421 ASSI { 23502} (( segid "PROT" and resid 113 and name HD1# )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 23502 weight 0.1000E+01 volume 39.75710 ppm1 0.887 ppm2 1.298 ASSI { 23512} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 21 and name HG2# )) 6 6 0 peak 23512 weight 0.1000E+01 volume 6.77490 ppm1 0.721 ppm2 1.301 ASSI { 23522} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 110 and name HB2 )) 6 6 0 peak 23522 weight 0.1000E+01 volume 4.58160 ppm1 0.723 ppm2 2.165 ASSI { 23532} (( segid "PROT" and resid 107 and name HG1 )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 23532 weight 0.1000E+01 volume 5.49330 ppm1 2.503 ppm2 0.961 ASSI { 23542} (( segid "PROT" and resid 107 and name HB1 )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 23542 weight 0.1000E+01 volume 6.79870 ppm1 2.272 ppm2 0.957 ASSI { 23552} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 23552 weight 0.1000E+01 volume 7.16750 ppm1 0.567 ppm2 0.960 ASSI { 23562} (( segid "PROT" and resid 109 and name HA )) (( segid "PROT" and resid 106 and name HA )) 6 6 0 peak 23562 weight 0.1000E+01 volume 1.09670 ppm1 4.032 ppm2 3.418 ASSI { 23572} (( segid "PROT" and resid 109 and name HB2 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 23572 weight 0.1000E+01 volume 3.61230 ppm1 3.045 ppm2 0.922 ASSI { 23582} (( segid "PROT" and resid 104 and name HG2 )) (( segid "PROT" and resid 104 and name HD1 )) 6 6 0 peak 23582 weight 0.1000E+01 volume 16.51040 ppm1 1.236 ppm2 1.797 ASSI { 23592} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 104 and name HD1 )) 6 6 0 peak 23592 weight 0.1000E+01 volume 7.42680 ppm1 0.957 ppm2 1.804 ASSI { 23602} (( segid "PROT" and resid 94 and name HD1 )) (( segid "PROT" and resid 94 and name HB2 )) 6 6 0 peak 23602 weight 0.1000E+01 volume 58.45630 ppm1 1.503 ppm2 1.402 ASSI { 23612} (( segid "PROT" and resid 65 and name HD2 )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 23612 weight 0.1000E+01 volume 17.08770 ppm1 1.346 ppm2 1.141 ASSI { 23622} (( segid "PROT" and resid 65 and name HG2 )) (( segid "PROT" and resid 65 and name HD2 )) 6 6 0 peak 23622 weight 0.1000E+01 volume 4.48420 ppm1 0.728 ppm2 1.350 ASSI { 23632} (( segid "PROT" and resid 61 and name HG2# )) (( segid "PROT" and resid 65 and name HD2 )) 6 6 0 peak 23632 weight 0.1000E+01 volume 4.71880 ppm1 1.139 ppm2 1.346 ASSI { 23642} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 23642 weight 0.1000E+01 volume 11.72500 ppm1 0.356 ppm2 0.659 ASSI { 23652} (( segid "PROT" and resid 51 and name HB2 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 23652 weight 0.1000E+01 volume 4.75580 ppm1 2.689 ppm2 0.883 ASSI { 23682} (( segid "PROT" and resid 117 and name HG1 )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 23682 weight 0.1000E+01 volume 5.35370 ppm1 2.607 ppm2 0.889 ASSI { 23692} (( segid "PROT" and resid 80 and name HB1 )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 23692 weight 0.1000E+01 volume 5.86190 ppm1 2.797 ppm2 0.341 ASSI { 23702} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 23702 weight 0.1000E+01 volume 20.57310 ppm1 1.107 ppm2 0.343 ASSI { 23712} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 62 and name HD1# )) 6 6 0 peak 23712 weight 0.1000E+01 volume 9.34900 ppm1 1.236 ppm2 0.342 ASSI { 23722} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 23722 weight 0.1000E+01 volume 5.67930 ppm1 7.425 ppm2 1.213 ASSI { 23732} (( segid "PROT" and resid 19 and name HG1 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 23732 weight 0.1000E+01 volume 18.06710 ppm1 2.672 ppm2 2.011 ASSI { 23742} (( segid "PROT" and resid 67 and name HA )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 23742 weight 0.1000E+01 volume 9.38970 ppm1 4.359 ppm2 2.014 ASSI { 23752} (( segid "PROT" and resid 102 and name HB2 )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 23752 weight 0.1000E+01 volume 4.38250 ppm1 2.707 ppm2 1.744 ASSI { 23782} (( segid "PROT" and resid 65 and name HZ2 )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 23782 weight 0.1000E+01 volume 6.32530 ppm1 6.830 ppm2 1.164 ASSI { 23792} (( segid "PROT" and resid 39 and name HG1# )) (( segid "PROT" and resid 39 and name HB )) 6 6 0 peak 23792 weight 0.1000E+01 volume 48.65560 ppm1 0.736 ppm2 1.469 ASSI { 23802} (( segid "PROT" and resid 38 and name HA )) (( segid "PROT" and resid 39 and name HG1# )) 6 6 0 peak 23802 weight 0.1000E+01 volume 3.45010 ppm1 4.135 ppm2 0.742 ASSI { 23822} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 39 and name HG1# )) 6 6 0 peak 23822 weight 0.1000E+01 volume 81.88570 ppm1 -0.369 ppm2 0.741 ASSI { 23832} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 53 and name HG2# )) 6 6 0 peak 23832 weight 0.1000E+01 volume 128.09019 ppm1 0.448 ppm2 0.605 ASSI { 23842} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 53 and name HA )) 6 6 0 peak 23842 weight 0.1000E+01 volume 32.90330 ppm1 0.446 ppm2 3.530 ASSI { 23852} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 53 and name HB )) 6 6 0 peak 23852 weight 0.1000E+01 volume 26.85710 ppm1 0.447 ppm2 1.023 ASSI { 23862} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 53 and name HB )) 6 6 0 peak 23862 weight 0.1000E+01 volume 2.51060 ppm1 6.154 ppm2 1.025 ASSI { 23872} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 23872 weight 0.1000E+01 volume 64.06300 ppm1 0.612 ppm2 0.452 ASSI { 23882} (( segid "PROT" and resid 91 and name HB2 )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 23882 weight 0.1000E+01 volume 7.89540 ppm1 2.904 ppm2 0.442 ASSI { 23892} (( segid "PROT" and resid 87 and name HB2 )) (( segid "PROT" and resid 53 and name HG1# )) 6 6 0 peak 23892 weight 0.1000E+01 volume 12.95080 ppm1 2.753 ppm2 0.440 ASSI { 23902} (( segid "PROT" and resid 117 and name HG1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 23902 weight 0.1000E+01 volume 4.63040 ppm1 2.603 ppm2 0.722 ASSI { 23912} (( segid "PROT" and resid 67 and name HB2 )) (( segid "PROT" and resid 68 and name HG2# )) 6 6 0 peak 23912 weight 0.1000E+01 volume 9.26970 ppm1 2.595 ppm2 1.225 ASSI { 23942} (( segid "PROT" and resid 44 and name HD1# )) (( segid "PROT" and resid 44 and name HA )) 6 6 0 peak 23942 weight 0.1000E+01 volume 19.67330 ppm1 0.747 ppm2 4.190 ASSI { 23952} (( segid "PROT" and resid 44 and name HG )) (( segid "PROT" and resid 44 and name HA )) 6 6 0 peak 23952 weight 0.1000E+01 volume 13.40330 ppm1 1.696 ppm2 4.192 ASSI { 23962} (( segid "PROT" and resid 44 and name HD2# )) (( segid "PROT" and resid 44 and name HG )) 6 6 0 peak 23962 weight 0.1000E+01 volume 28.14600 ppm1 0.830 ppm2 1.697 ASSI { 23972} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 83 and name HD2# )) 6 6 0 peak 23972 weight 0.1000E+01 volume 1.71350 ppm1 5.248 ppm2 1.113 ASSI { 23982} (( segid "PROT" and resid 90 and name HB1 )) (( segid "PROT" and resid 90 and name HD2# )) 6 6 0 peak 23982 weight 0.1000E+01 volume 19.01970 ppm1 2.138 ppm2 0.983 ASSI { 23992} (( segid "PROT" and resid 62 and name HD1# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 23992 weight 0.1000E+01 volume 21.13980 ppm1 0.348 ppm2 0.584 ASSI { 24002} (( segid "PROT" and resid 84 and name HE# )) (( segid "PROT" and resid 59 and name HD2# )) 6 6 0 peak 24002 weight 0.1000E+01 volume 6.91690 ppm1 1.239 ppm2 0.582 ASSI { 24012} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 24012 weight 0.1000E+01 volume 12.10270 ppm1 0.963 ppm2 1.233 ASSI { 24022} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 104 and name HG1 )) 6 6 0 peak 24022 weight 0.1000E+01 volume 7.70230 ppm1 0.963 ppm2 1.469 ASSI { 24032} (( segid "PROT" and resid 104 and name HB1 )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 24032 weight 0.1000E+01 volume 10.92790 ppm1 2.050 ppm2 1.230 ASSI { 24042} (( segid "PROT" and resid 104 and name HB1 )) (( segid "PROT" and resid 104 and name HG1 )) 6 6 0 peak 24042 weight 0.1000E+01 volume 10.71510 ppm1 2.051 ppm2 1.479 ASSI { 24052} (( segid "PROT" and resid 104 and name HD1 )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 24052 weight 0.1000E+01 volume 8.78950 ppm1 1.797 ppm2 1.243 ASSI { 24062} (( segid "PROT" and resid 104 and name HD2 )) (( segid "PROT" and resid 104 and name HG2 )) 6 6 0 peak 24062 weight 0.1000E+01 volume 13.61040 ppm1 1.627 ppm2 1.237 ASSI { 24072} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 18 and name HD1# )) 6 6 0 peak 24072 weight 0.1000E+01 volume 30.30110 ppm1 2.653 ppm2 0.234 ASSI { 24082} (( segid "PROT" and resid 7 and name HE1 )) (( segid "PROT" and resid 7 and name HG1 )) 6 6 0 peak 24082 weight 0.1000E+01 volume 25.72710 ppm1 2.680 ppm2 1.095 ASSI { 24092} (( segid "PROT" and resid 7 and name HE1 )) (( segid "PROT" and resid 7 and name HG2 )) 6 6 0 peak 24092 weight 0.1000E+01 volume 27.59470 ppm1 2.681 ppm2 0.963 ASSI { 24102} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 7 and name HG1 )) 6 6 0 peak 24102 weight 0.1000E+01 volume 2.87670 ppm1 7.321 ppm2 1.096 ASSI { 24112} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 7 and name HG1 )) 6 6 0 peak 24112 weight 0.1000E+01 volume 1.77690 ppm1 7.387 ppm2 1.108 ASSI { 24122} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 24122 weight 0.1000E+01 volume 6.27330 ppm1 2.667 ppm2 0.832 ASSI { 24142} (( segid "PROT" and resid 18 and name HB1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 24142 weight 0.1000E+01 volume 50.78530 ppm1 1.377 ppm2 0.732 ASSI { 24152} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 24152 weight 0.1000E+01 volume 12.93520 ppm1 4.421 ppm2 0.736 ASSI { 24162} (( segid "PROT" and resid 19 and name HA )) (( segid "PROT" and resid 66 and name HD2# )) 6 6 0 peak 24162 weight 0.1000E+01 volume 4.20980 ppm1 4.418 ppm2 0.829 ASSI { 24172} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 24172 weight 0.1000E+01 volume 6.66870 ppm1 0.506 ppm2 0.352 ASSI { 24202} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 14 and name HD1# )) 6 6 0 peak 24202 weight 0.1000E+01 volume 11.42940 ppm1 2.664 ppm2 0.351 ASSI { 24212} (( segid "PROT" and resid 18 and name HG )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 24212 weight 0.1000E+01 volume 4.86680 ppm1 1.555 ppm2 0.608 ASSI { 24222} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 24222 weight 0.1000E+01 volume 10.54410 ppm1 0.354 ppm2 0.612 ASSI { 24232} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 120 and name HD1# )) 6 6 0 peak 24232 weight 0.1000E+01 volume 28.06720 ppm1 0.508 ppm2 0.614 ASSI { 24242} (( segid "PROT" and resid 102 and name HB2 )) (( segid "PROT" and resid 102 and name HB1 )) 6 6 0 peak 24242 weight 0.1000E+01 volume 14.47150 ppm1 2.712 ppm2 3.043 ASSI { 24252} (( segid "PROT" and resid 116 and name HG2# )) (( segid "PROT" and resid 120 and name HG )) 6 6 0 peak 24252 weight 0.1000E+01 volume 5.94830 ppm1 0.767 ppm2 1.786 ASSI { 24262} (( segid "PROT" and resid 14 and name HA )) (( segid "PROT" and resid 18 and name HG )) 6 6 0 peak 24262 weight 0.1000E+01 volume 4.35350 ppm1 3.792 ppm2 1.553 ASSI { 24272} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 59 and name HG )) 6 6 0 peak 24272 weight 0.1000E+01 volume 9.84710 ppm1 0.579 ppm2 1.559 ASSI { 24282} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 24282 weight 0.1000E+01 volume 5.45980 ppm1 0.670 ppm2 0.391 ASSI { 24292} (( segid "PROT" and resid 35 and name HB2 )) (( segid "PROT" and resid 105 and name HD1# )) 6 6 0 peak 24292 weight 0.1000E+01 volume 4.06190 ppm1 2.606 ppm2 0.390 ASSI { 24312} (( segid "PROT" and resid 19 and name HE# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 24312 weight 0.1000E+01 volume 19.68150 ppm1 1.994 ppm2 1.083 ASSI { 24322} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 90 and name HD1# )) 6 6 0 peak 24322 weight 0.1000E+01 volume 27.21790 ppm1 0.444 ppm2 0.983 ASSI { 24332} (( segid "PROT" and resid 90 and name HB2 )) (( segid "PROT" and resid 90 and name HG )) 6 6 0 peak 24332 weight 0.1000E+01 volume 57.22740 ppm1 1.785 ppm2 1.406 ASSI { 24342} (( segid "PROT" and resid 64 and name HB1 )) (( segid "PROT" and resid 64 and name HG2 )) 6 6 0 peak 24342 weight 0.1000E+01 volume 24.52140 ppm1 2.009 ppm2 1.510 ASSI { 24352} (( segid "PROT" and resid 64 and name HB2 )) (( segid "PROT" and resid 64 and name HG2 )) 6 6 0 peak 24352 weight 0.1000E+01 volume 23.79320 ppm1 1.930 ppm2 1.504 ASSI { 24362} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 64 and name HG2 )) 6 6 0 peak 24362 weight 0.1000E+01 volume 14.16800 ppm1 1.224 ppm2 1.503 ASSI { 24392} (( segid "PROT" and resid 74 and name HD2 )) (( segid "PROT" and resid 74 and name HG2 )) 6 6 0 peak 24392 weight 0.1000E+01 volume 7.98020 ppm1 2.750 ppm2 1.401 ASSI { 24402} (( segid "PROT" and resid 38 and name HB1 )) (( segid "PROT" and resid 38 and name HG1 )) 6 6 0 peak 24402 weight 0.1000E+01 volume 29.49310 ppm1 2.280 ppm2 1.970 ASSI { 24412} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 34 and name HG2 )) 6 6 0 peak 24412 weight 0.1000E+01 volume 3.43550 ppm1 7.351 ppm2 1.795 ASSI { 24422} (( segid "PROT" and resid 41 and name HG2 )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 24422 weight 0.1000E+01 volume 20.79230 ppm1 1.097 ppm2 1.571 ASSI { 24432} (( segid "PROT" and resid 41 and name HG1 )) (( segid "PROT" and resid 41 and name HG2 )) 6 6 0 peak 24432 weight 0.1000E+01 volume 25.13750 ppm1 1.568 ppm2 1.092 ASSI { 24442} (( segid "PROT" and resid 65 and name HB2 )) (( segid "PROT" and resid 65 and name HD2 )) 6 6 0 peak 24442 weight 0.1000E+01 volume 3.31880 ppm1 0.564 ppm2 1.355 ASSI { 24452} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 111 and name HB1 )) 6 6 0 peak 24452 weight 0.1000E+01 volume 10.88250 ppm1 3.641 ppm2 2.266 ASSI { 24462} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 111 and name HB2 )) 6 6 0 peak 24462 weight 0.1000E+01 volume 11.51990 ppm1 3.643 ppm2 2.170 ASSI { 24492} (( segid "PROT" and resid 63 and name HG2 )) (( segid "PROT" and resid 63 and name HD1 )) 6 6 0 peak 24492 weight 0.1000E+01 volume 35.49800 ppm1 1.179 ppm2 1.488 ASSI { 24502} (( segid "PROT" and resid 63 and name HB1 )) (( segid "PROT" and resid 63 and name HD1 )) 6 6 0 peak 24502 weight 0.1000E+01 volume 54.81890 ppm1 1.991 ppm2 1.462 ASSI { 24512} (( segid "PROT" and resid 117 and name HG1 )) (( segid "PROT" and resid 113 and name HG11 )) 6 6 0 peak 24512 weight 0.1000E+01 volume 1.94470 ppm1 2.596 ppm2 1.215 ASSI { 24522} (( segid "PROT" and resid 61 and name HA )) (( segid "PROT" and resid 64 and name HB1 )) 6 6 0 peak 24522 weight 0.1000E+01 volume 10.82280 ppm1 3.884 ppm2 1.990 ASSI { 24532} (( segid "PROT" and resid 64 and name HA )) (( segid "PROT" and resid 64 and name HB2 )) 6 6 0 peak 24532 weight 0.1000E+01 volume 17.87320 ppm1 4.164 ppm2 1.974 ASSI { 24542} (( segid "PROT" and resid 100 and name HA )) (( segid "PROT" and resid 100 and name HD2 )) 6 6 0 peak 24542 weight 0.1000E+01 volume 12.43480 ppm1 4.317 ppm2 1.632 ASSI { 24552} (( segid "PROT" and resid 112 and name HA )) (( segid "PROT" and resid 112 and name HB2 )) 6 6 0 peak 24552 weight 0.1000E+01 volume 9.48960 ppm1 4.125 ppm2 1.767 ASSI { 24562} (( segid "PROT" and resid 117 and name HG1 )) (( segid "PROT" and resid 117 and name HB2 )) 6 6 0 peak 24562 weight 0.1000E+01 volume 14.40400 ppm1 2.599 ppm2 1.976 ASSI { 24572} (( segid "PROT" and resid 117 and name HG1 )) (( segid "PROT" and resid 117 and name HB1 )) 6 6 0 peak 24572 weight 0.1000E+01 volume 11.70550 ppm1 2.601 ppm2 2.205 ASSI { 24582} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 117 and name HB2 )) 6 6 0 peak 24582 weight 0.1000E+01 volume 5.67950 ppm1 4.308 ppm2 1.973 ASSI { 24622} (( segid "PROT" and resid 34 and name HB2 )) (( segid "PROT" and resid 34 and name HG2 )) 6 6 0 peak 24622 weight 0.1000E+01 volume 11.21550 ppm1 0.591 ppm2 1.820 ASSI { 24632} (( segid "PROT" and resid 34 and name HB2 )) (( segid "PROT" and resid 34 and name HG1 )) 6 6 0 peak 24632 weight 0.1000E+01 volume 8.38080 ppm1 0.597 ppm2 1.977 ASSI { 24642} (( segid "PROT" and resid 84 and name HG1 )) (( segid "PROT" and resid 84 and name HG2 )) 6 6 0 peak 24642 weight 0.1000E+01 volume 4.76620 ppm1 2.583 ppm2 1.823 ASSI { 24652} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 36 and name HG1 )) 6 6 0 peak 24652 weight 0.1000E+01 volume 2.45240 ppm1 0.237 ppm2 2.183 ASSI { 24662} (( segid "PROT" and resid 36 and name HA )) (( segid "PROT" and resid 36 and name HB2 )) 6 6 0 peak 24662 weight 0.1000E+01 volume 5.99410 ppm1 3.935 ppm2 1.897 ASSI { 24672} (( segid "PROT" and resid 36 and name HD2 )) (( segid "PROT" and resid 36 and name HB2 )) 6 6 0 peak 24672 weight 0.1000E+01 volume 1.08290 ppm1 3.049 ppm2 1.889 ASSI { 24682} (( segid "PROT" and resid 35 and name HB2 )) (( segid "PROT" and resid 35 and name HA )) 6 6 0 peak 24682 weight 0.1000E+01 volume 2.41880 ppm1 2.617 ppm2 4.752 ASSI { 24692} (( segid "PROT" and resid 58 and name HB1 )) (( segid "PROT" and resid 58 and name HA )) 6 6 0 peak 24692 weight 0.1000E+01 volume 8.41910 ppm1 2.590 ppm2 4.861 ASSI { 24702} (( segid "PROT" and resid 73 and name HG1 )) (( segid "PROT" and resid 73 and name HB1 )) 6 6 0 peak 24702 weight 0.1000E+01 volume 8.81750 ppm1 2.435 ppm2 2.167 ASSI { 24712} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 84 and name HG2 )) 6 6 0 peak 24712 weight 0.1000E+01 volume 3.67100 ppm1 7.409 ppm2 1.823 ASSI { 24722} (( segid "PROT" and resid 38 and name HA )) (( segid "PROT" and resid 38 and name HB1 )) 6 6 0 peak 24722 weight 0.1000E+01 volume 5.97680 ppm1 4.143 ppm2 2.272 ASSI { 24742} (( segid "PROT" and resid 76 and name HG2 )) (( segid "PROT" and resid 76 and name HG1 )) 6 6 0 peak 24742 weight 0.1000E+01 volume 6.65380 ppm1 1.368 ppm2 1.885 ASSI { 24752} (( segid "PROT" and resid 7 and name HE1 )) (( segid "PROT" and resid 7 and name HB1 )) 6 6 0 peak 24752 weight 0.1000E+01 volume 7.45220 ppm1 2.676 ppm2 1.600 ASSI { 24782} (( segid "PROT" and resid 19 and name HG1 )) (( segid "PROT" and resid 23 and name HG1 )) 6 6 0 peak 24782 weight 0.1000E+01 volume 6.59280 ppm1 2.664 ppm2 2.319 ASSI { 24792} (( segid "PROT" and resid 19 and name HG2 )) (( segid "PROT" and resid 23 and name HG1 )) 6 6 0 peak 24792 weight 0.1000E+01 volume 14.90250 ppm1 2.546 ppm2 2.318 ASSI { 24802} (( segid "PROT" and resid 14 and name HG )) (( segid "PROT" and resid 13 and name HB1 )) 6 6 0 peak 24802 weight 0.1000E+01 volume 3.93720 ppm1 1.555 ppm2 2.339 ASSI { 24812} (( segid "PROT" and resid 102 and name HB2 )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 24812 weight 0.1000E+01 volume 18.51910 ppm1 2.706 ppm2 3.234 ASSI { 24822} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 24822 weight 0.1000E+01 volume 1.72060 ppm1 0.569 ppm2 3.237 ASSI { 24832} (( segid "PROT" and resid 99 and name HA )) (( segid "PROT" and resid 102 and name HA )) 6 6 0 peak 24832 weight 0.1000E+01 volume 1.70400 ppm1 3.786 ppm2 3.238 ASSI { 24842} (( segid "PROT" and resid 101 and name HE1 )) (( segid "PROT" and resid 98 and name HA )) 6 6 0 peak 24842 weight 0.1000E+01 volume 2.06080 ppm1 7.338 ppm2 3.290 ASSI { 24872} (( segid "PROT" and resid 71 and name HB2 )) (( segid "PROT" and resid 71 and name HA )) 6 6 0 peak 24872 weight 0.1000E+01 volume 0.79590 ppm1 2.671 ppm2 4.772 ASSI { 24882} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 77 and name HB2 )) 6 6 0 peak 24882 weight 0.1000E+01 volume 11.87790 ppm1 2.647 ppm2 1.773 ASSI { 24892} (( segid "PROT" and resid 31 and name HA )) (( segid "PROT" and resid 31 and name HG2 )) 6 6 0 peak 24892 weight 0.1000E+01 volume 3.26620 ppm1 2.581 ppm2 1.586 ASSI { 24902} (( segid "PROT" and resid 101 and name HB2 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 24902 weight 0.1000E+01 volume 1.55790 ppm1 3.660 ppm2 2.585 ASSI { 24912} (( segid "PROT" and resid 31 and name HB1 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 24912 weight 0.1000E+01 volume 3.55900 ppm1 1.634 ppm2 2.581 ASSI { 24922} (( segid "PROT" and resid 87 and name HB2 )) (( segid "PROT" and resid 87 and name HB1 )) 6 6 0 peak 24922 weight 0.1000E+01 volume 10.31730 ppm1 2.752 ppm2 3.085 ASSI { 24932} (( segid "PROT" and resid 109 and name HA )) (( segid "PROT" and resid 113 and name HB )) 6 6 0 peak 24932 weight 0.1000E+01 volume 2.61810 ppm1 4.008 ppm2 0.715 ASSI { 24942} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 24942 weight 0.1000E+01 volume 1.89400 ppm1 7.195 ppm2 0.705 ASSI { 24952} (( segid "PROT" and resid 49 and name HB1 )) (( segid "PROT" and resid 49 and name HB2 )) 6 6 0 peak 24952 weight 0.1000E+01 volume 3.73060 ppm1 2.739 ppm2 1.981 ASSI { 24962} (( segid "PROT" and resid 91 and name HD1 )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 24962 weight 0.1000E+01 volume 1.50860 ppm1 6.928 ppm2 3.583 ASSI { 24972} (( segid "PROT" and resid 35 and name HB2 )) (( segid "PROT" and resid 35 and name HB1 )) 6 6 0 peak 24972 weight 0.1000E+01 volume 10.10600 ppm1 2.616 ppm2 3.851 ASSI { 24982} (( segid "PROT" and resid 48 and name HB2 )) (( segid "PROT" and resid 48 and name HB1 )) 6 6 0 peak 24982 weight 0.1000E+01 volume 9.59490 ppm1 2.622 ppm2 3.125 ASSI { 24992} (( segid "PROT" and resid 102 and name HB2 )) (( segid "PROT" and resid 99 and name HA )) 6 6 0 peak 24992 weight 0.1000E+01 volume 3.77320 ppm1 2.706 ppm2 3.778 ASSI { 25002} (( segid "PROT" and resid 92 and name HB1 )) (( segid "PROT" and resid 92 and name HB2 )) 6 6 0 peak 25002 weight 0.1000E+01 volume 9.34230 ppm1 3.075 ppm2 2.871 ASSI { 25012} (( segid "PROT" and resid 92 and name HB2 )) (( segid "PROT" and resid 92 and name HA )) 6 6 0 peak 25012 weight 0.1000E+01 volume 0.73100 ppm1 2.874 ppm2 4.682 ASSI { 25022} (( segid "PROT" and resid 9 and name HB1 )) (( segid "PROT" and resid 14 and name HB1 )) 6 6 0 peak 25022 weight 0.1000E+01 volume 5.80590 ppm1 2.863 ppm2 1.653 ASSI { 25032} (( segid "PROT" and resid 9 and name HB1 )) (( segid "PROT" and resid 14 and name HB2 )) 6 6 0 peak 25032 weight 0.1000E+01 volume 2.33150 ppm1 2.862 ppm2 1.301 ASSI { 25042} (( segid "PROT" and resid 43 and name HD1# )) (( segid "PROT" and resid 40 and name HB2 )) 6 6 0 peak 25042 weight 0.1000E+01 volume 3.31050 ppm1 0.838 ppm2 2.384 ASSI { 25052} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 7 and name HE1 )) 6 6 0 peak 25052 weight 0.1000E+01 volume 4.91220 ppm1 7.330 ppm2 2.675 ASSI { 25062} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 63 and name HE1 )) 6 6 0 peak 25062 weight 0.1000E+01 volume 3.81360 ppm1 3.696 ppm2 2.801 ASSI { 25072} (( segid "PROT" and resid 65 and name HZ2 )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 25072 weight 0.1000E+01 volume 2.04240 ppm1 6.790 ppm2 1.761 ASSI { 25082} (( segid "PROT" and resid 114 and name HB2 )) (( segid "PROT" and resid 115 and name HD2 )) 6 6 0 peak 25082 weight 0.1000E+01 volume 19.86840 ppm1 2.690 ppm2 3.513 ASSI { 25092} (( segid "PROT" and resid 29 and name HB1 )) (( segid "PROT" and resid 29 and name HA )) 6 6 0 peak 25092 weight 0.1000E+01 volume 2.48940 ppm1 2.785 ppm2 4.721 ASSI { 25102} (( segid "PROT" and resid 73 and name HG1 )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 25102 weight 0.1000E+01 volume 1.66240 ppm1 2.437 ppm2 4.613 ASSI { 25112} (( segid "PROT" and resid 48 and name HB2 )) (( segid "PROT" and resid 48 and name HA )) 6 6 0 peak 25112 weight 0.1000E+01 volume 6.54580 ppm1 2.630 ppm2 4.603 ASSI { 25122} (( segid "PROT" and resid 10 and name HD1 )) (( segid "PROT" and resid 10 and name HA )) 6 6 0 peak 25122 weight 0.1000E+01 volume 1.05930 ppm1 1.767 ppm2 4.683 ASSI { 25132} (( segid "PROT" and resid 109 and name HB1 )) (( segid "PROT" and resid 106 and name HA )) 6 6 0 peak 25132 weight 0.1000E+01 volume 5.98930 ppm1 3.327 ppm2 3.433 ASSI { 25142} (( segid "PROT" and resid 17 and name HB# )) (( segid "PROT" and resid 18 and name HA )) 6 6 0 peak 25142 weight 0.1000E+01 volume 7.76940 ppm1 1.363 ppm2 4.186 ASSI { 25152} (( segid "PROT" and resid 87 and name HB2 )) (( segid "PROT" and resid 87 and name HA )) 6 6 0 peak 25152 weight 0.1000E+01 volume 13.58930 ppm1 2.749 ppm2 4.456 ASSI { 25162} (( segid "PROT" and resid 90 and name HG )) (( segid "PROT" and resid 87 and name HA )) 6 6 0 peak 25162 weight 0.1000E+01 volume 3.63720 ppm1 1.406 ppm2 4.447 ASSI { 25172} (( segid "PROT" and resid 51 and name HB2 )) (( segid "PROT" and resid 51 and name HA )) 6 6 0 peak 25172 weight 0.1000E+01 volume 16.19380 ppm1 2.682 ppm2 4.458 ASSI { 25182} (( segid "PROT" and resid 86 and name HB2 )) (( segid "PROT" and resid 86 and name HA )) 6 6 0 peak 25182 weight 0.1000E+01 volume 1.50550 ppm1 2.886 ppm2 4.805 ASSI { 25192} (( segid "PROT" and resid 79 and name HB2 )) (( segid "PROT" and resid 79 and name HA )) 6 6 0 peak 25192 weight 0.1000E+01 volume 7.25300 ppm1 2.710 ppm2 4.550 ASSI { 25212} (( segid "PROT" and resid 79 and name HB2 )) (( segid "PROT" and resid 76 and name HA )) 6 6 0 peak 25212 weight 0.1000E+01 volume 6.35490 ppm1 2.701 ppm2 3.880 ASSI { 25222} (( segid "PROT" and resid 118 and name HB2 )) (( segid "PROT" and resid 118 and name HA )) 6 6 0 peak 25222 weight 0.1000E+01 volume 23.56060 ppm1 2.062 ppm2 4.119 ASSI { 25232} (( segid "PROT" and resid 99 and name HE1 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 25232 weight 0.1000E+01 volume 3.83450 ppm1 7.026 ppm2 2.177 ASSI { 25242} (( segid "PROT" and resid 19 and name HG1 )) (( segid "PROT" and resid 19 and name HA )) 6 6 0 peak 25242 weight 0.1000E+01 volume 3.56190 ppm1 2.671 ppm2 4.424 ASSI { 25252} (( segid "PROT" and resid 67 and name HB2 )) (( segid "PROT" and resid 64 and name HA )) 6 6 0 peak 25252 weight 0.1000E+01 volume 10.75260 ppm1 2.596 ppm2 4.169 ASSI { 25262} (( segid "PROT" and resid 64 and name HB1 )) (( segid "PROT" and resid 64 and name HA )) 6 6 0 peak 25262 weight 0.1000E+01 volume 23.37780 ppm1 1.938 ppm2 4.160 ASSI { 25272} (( segid "PROT" and resid 84 and name HG1 )) (( segid "PROT" and resid 84 and name HA )) 6 6 0 peak 25272 weight 0.1000E+01 volume 4.91500 ppm1 2.582 ppm2 3.648 ASSI { 25282} (( segid "PROT" and resid 87 and name HB1 )) (( segid "PROT" and resid 84 and name HA )) 6 6 0 peak 25282 weight 0.1000E+01 volume 2.59090 ppm1 3.078 ppm2 3.651 ASSI { 25292} (( segid "PROT" and resid 87 and name HB2 )) (( segid "PROT" and resid 84 and name HA )) 6 6 0 peak 25292 weight 0.1000E+01 volume 1.12750 ppm1 2.747 ppm2 3.651 ASSI { 25302} (( segid "PROT" and resid 84 and name HG2 )) (( segid "PROT" and resid 84 and name HA )) 6 6 0 peak 25302 weight 0.1000E+01 volume 4.27920 ppm1 1.836 ppm2 3.658 ASSI { 25312} (( segid "PROT" and resid 84 and name HB2 )) (( segid "PROT" and resid 84 and name HA )) 6 6 0 peak 25312 weight 0.1000E+01 volume 8.81800 ppm1 1.234 ppm2 3.642 ASSI { 25322} (( segid "PROT" and resid 85 and name HB1 )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 25322 weight 0.1000E+01 volume 5.82030 ppm1 2.498 ppm2 3.980 ASSI { 25332} (( segid "PROT" and resid 91 and name HB2 )) (( segid "PROT" and resid 91 and name HA )) 6 6 0 peak 25332 weight 0.1000E+01 volume 14.68640 ppm1 2.903 ppm2 4.004 ASSI { 25342} (( segid "PROT" and resid 91 and name HB1 )) (( segid "PROT" and resid 91 and name HA )) 6 6 0 peak 25342 weight 0.1000E+01 volume 5.36340 ppm1 2.979 ppm2 4.006 ASSI { 25352} (( segid "PROT" and resid 52 and name HB )) (( segid "PROT" and resid 53 and name HA )) 6 6 0 peak 25352 weight 0.1000E+01 volume 0.61060 ppm1 1.826 ppm2 3.536 ASSI { 25362} (( segid "PROT" and resid 58 and name HB1 )) (( segid "PROT" and resid 38 and name HA )) 6 6 0 peak 25362 weight 0.1000E+01 volume 3.06930 ppm1 2.597 ppm2 4.141 ASSI { 25372} (( segid "PROT" and resid 39 and name HG1# )) (( segid "PROT" and resid 38 and name HA )) 6 6 0 peak 25372 weight 0.1000E+01 volume 1.85200 ppm1 0.736 ppm2 4.138 ASSI { 25382} (( segid "PROT" and resid 38 and name HA )) (( segid "PROT" and resid 58 and name HB1 )) 6 6 0 peak 25382 weight 0.1000E+01 volume 1.60870 ppm1 4.139 ppm2 2.601 ASSI { 25392} (( segid "PROT" and resid 38 and name HA )) (( segid "PROT" and resid 58 and name HB2 )) 6 6 0 peak 25392 weight 0.1000E+01 volume 0.16690 ppm1 4.133 ppm2 2.305 ASSI { 25402} (( segid "PROT" and resid 41 and name HB1 )) (( segid "PROT" and resid 47 and name HA )) 6 6 0 peak 25402 weight 0.1000E+01 volume 2.91930 ppm1 2.309 ppm2 4.051 ASSI { 25412} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 32 and name HB2 )) 6 6 0 peak 25412 weight 0.1000E+01 volume 1.01840 ppm1 0.398 ppm2 3.656 ASSI { 25422} (( segid "PROT" and resid 62 and name HG2# )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 25422 weight 0.1000E+01 volume 3.03390 ppm1 1.111 ppm2 2.476 ASSI { 25432} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 21 and name HB )) 6 6 0 peak 25432 weight 0.1000E+01 volume 2.44900 ppm1 1.038 ppm2 4.194 ASSI { 25442} (( segid "PROT" and resid 19 and name HG1 )) (( segid "PROT" and resid 19 and name HB1 )) 6 6 0 peak 25442 weight 0.1000E+01 volume 19.27600 ppm1 2.669 ppm2 2.228 ASSI { 25452} (( segid "PROT" and resid 31 and name HA )) (( segid "PROT" and resid 31 and name HB1 )) 6 6 0 peak 25452 weight 0.1000E+01 volume 3.03560 ppm1 2.589 ppm2 1.632 ASSI { 25462} (( segid "PROT" and resid 38 and name HD2 )) (( segid "PROT" and resid 37 and name HB1 )) 6 6 0 peak 25462 weight 0.1000E+01 volume 4.31960 ppm1 3.469 ppm2 2.194 ASSI { 25472} (( segid "PROT" and resid 38 and name HD2 )) (( segid "PROT" and resid 38 and name HB2 )) 6 6 0 peak 25472 weight 0.1000E+01 volume 0.23860 ppm1 3.449 ppm2 1.648 ASSI { 25482} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 44 and name HD2# )) 6 6 0 peak 25482 weight 0.1000E+01 volume 5.75790 ppm1 -0.366 ppm2 0.823 ASSI { 25492} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 39 and name HB )) 6 6 0 peak 25492 weight 0.1000E+01 volume 5.59400 ppm1 6.152 ppm2 1.471 ASSI { 25502} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 56 and name HA )) 6 6 0 peak 25502 weight 0.1000E+01 volume 1.37350 ppm1 0.447 ppm2 4.134 ASSI { 25512} (( segid "PROT" and resid 49 and name HE1 )) (( segid "PROT" and resid 56 and name HG1 )) 6 6 0 peak 25512 weight 0.1000E+01 volume 2.48720 ppm1 6.155 ppm2 2.136 ASSI { 25522} (( segid "PROT" and resid 51 and name HA )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 25522 weight 0.1000E+01 volume 2.36120 ppm1 4.463 ppm2 0.880 ASSI { 25532} (( segid "PROT" and resid 48 and name HB2 )) (( segid "PROT" and resid 52 and name HD1# )) 6 6 0 peak 25532 weight 0.1000E+01 volume 7.19500 ppm1 2.642 ppm2 0.882 ASSI { 25542} (( segid "PROT" and resid 6 and name HG2 )) (( segid "PROT" and resid 8 and name HD1# )) 6 6 0 peak 25542 weight 0.1000E+01 volume 8.04000 ppm1 1.282 ppm2 0.824 ASSI { 25572} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 113 and name HD1# )) 6 6 0 peak 25572 weight 0.1000E+01 volume 1.32300 ppm1 -0.256 ppm2 0.883 ASSI { 25582} (( segid "PROT" and resid 74 and name HA )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 25582 weight 0.1000E+01 volume 2.63010 ppm1 3.777 ppm2 1.470 ASSI { 25612} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 25612 weight 0.1000E+01 volume 1.54740 ppm1 0.663 ppm2 1.469 ASSI { 25622} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 117 and name HE# )) 6 6 0 peak 25622 weight 0.1000E+01 volume 0.86500 ppm1 0.241 ppm2 1.475 ASSI { 25632} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 25632 weight 0.1000E+01 volume 1.85660 ppm1 6.611 ppm2 2.013 ASSI { 25642} (( segid "PROT" and resid 19 and name HG2 )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 25642 weight 0.1000E+01 volume 9.23690 ppm1 2.555 ppm2 2.017 ASSI { 25652} (( segid "PROT" and resid 66 and name HG )) (( segid "PROT" and resid 19 and name HE# )) 6 6 0 peak 25652 weight 0.1000E+01 volume 10.89450 ppm1 1.750 ppm2 2.017 ASSI { 25662} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 84 and name HE# )) 6 6 0 peak 25662 weight 0.1000E+01 volume 2.67010 ppm1 0.387 ppm2 1.223 ASSI { 25672} (( segid "PROT" and resid 108 and name HA )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 25672 weight 0.1000E+01 volume 2.22930 ppm1 3.639 ppm2 1.409 ASSI { 25682} (( segid "PROT" and resid 108 and name HB )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 25682 weight 0.1000E+01 volume 2.43230 ppm1 2.140 ppm2 1.410 ASSI { 25692} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 24 and name HB# )) 6 6 0 peak 25692 weight 0.1000E+01 volume 7.28410 ppm1 0.955 ppm2 1.411 ASSI { 25712} (( segid "PROT" and resid 82 and name HE3 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 25712 weight 0.1000E+01 volume 2.46610 ppm1 7.886 ppm2 0.918 ASSI { 25722} (( segid "PROT" and resid 85 and name HB1 )) (( segid "PROT" and resid 106 and name HB# )) 6 6 0 peak 25722 weight 0.1000E+01 volume 4.20140 ppm1 2.498 ppm2 0.918 ASSI { 25732} (( segid "PROT" and resid 73 and name HG1 )) (( segid "PROT" and resid 8 and name HG2# )) 6 6 0 peak 25732 weight 0.1000E+01 volume 3.58250 ppm1 2.442 ppm2 0.858 ASSI { 25742} (( segid "PROT" and resid 73 and name HG2 )) (( segid "PROT" and resid 8 and name HG2# )) 6 6 0 peak 25742 weight 0.1000E+01 volume 1.72080 ppm1 2.247 ppm2 0.860 ASSI { 25752} (( segid "PROT" and resid 85 and name HB1 )) (( segid "PROT" and resid 88 and name HB# )) 6 6 0 peak 25752 weight 0.1000E+01 volume 4.40080 ppm1 2.518 ppm2 1.744 ASSI { 25762} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 25762 weight 0.1000E+01 volume 5.32240 ppm1 0.235 ppm2 1.169 ASSI { 25792} (( segid "PROT" and resid 81 and name HB )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 25792 weight 0.1000E+01 volume 5.01040 ppm1 0.842 ppm2 1.167 ASSI { 25802} (( segid "PROT" and resid 80 and name HB1 )) (( segid "PROT" and resid 62 and name HG2# )) 6 6 0 peak 25802 weight 0.1000E+01 volume 2.27190 ppm1 2.790 ppm2 1.169 ASSI { 25822} (( segid "PROT" and resid 116 and name HA )) (( segid "PROT" and resid 17 and name HB# )) 6 6 0 peak 25822 weight 0.1000E+01 volume 3.93010 ppm1 3.683 ppm2 1.335 ASSI { 25862} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 25862 weight 0.1000E+01 volume 2.03470 ppm1 7.476 ppm2 0.712 ASSI { 25872} (( segid "PROT" and resid 82 and name HZ2 )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 25872 weight 0.1000E+01 volume 1.94330 ppm1 7.722 ppm2 0.717 ASSI { 25882} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 25882 weight 0.1000E+01 volume 6.24590 ppm1 2.059 ppm2 0.725 ASSI { 25892} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 25892 weight 0.1000E+01 volume 6.73910 ppm1 1.038 ppm2 0.718 ASSI { 25902} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 113 and name HG2# )) 6 6 0 peak 25902 weight 0.1000E+01 volume 0.77680 ppm1 -1.493 ppm2 0.718 ASSI { 25912} (( segid "PROT" and resid 41 and name HD1 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 25912 weight 0.1000E+01 volume 5.16440 ppm1 3.800 ppm2 -0.367 ASSI { 25922} (( segid "PROT" and resid 49 and name HD1 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 25922 weight 0.1000E+01 volume 3.49580 ppm1 5.422 ppm2 -0.371 ASSI { 25932} (( segid "PROT" and resid 49 and name HB1 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 25932 weight 0.1000E+01 volume 1.97970 ppm1 2.769 ppm2 -0.370 ASSI { 25942} (( segid "PROT" and resid 49 and name HB2 )) (( segid "PROT" and resid 39 and name HG2# )) 6 6 0 peak 25942 weight 0.1000E+01 volume 2.18700 ppm1 1.979 ppm2 -0.369 ASSI { 25962} (( segid "PROT" and resid 106 and name HA )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 25962 weight 0.1000E+01 volume 2.86600 ppm1 3.418 ppm2 -1.498 ASSI { 25972} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 25972 weight 0.1000E+01 volume 1.48330 ppm1 6.615 ppm2 -1.494 ASSI { 25982} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 81 and name HG2# )) 6 6 0 peak 25982 weight 0.1000E+01 volume 2.59310 ppm1 7.474 ppm2 -1.492 ASSI { 25992} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 81 and name HG1# )) 6 6 0 peak 25992 weight 0.1000E+01 volume 1.44200 ppm1 7.476 ppm2 -0.254 ASSI { 26002} (( segid "PROT" and resid 15 and name HA )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 26002 weight 0.1000E+01 volume 2.25830 ppm1 3.680 ppm2 0.508 ASSI { 26012} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 26012 weight 0.1000E+01 volume 3.10370 ppm1 2.650 ppm2 0.506 ASSI { 26022} (( segid "PROT" and resid 116 and name HB )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 26022 weight 0.1000E+01 volume 2.42910 ppm1 2.070 ppm2 0.510 ASSI { 26032} (( segid "PROT" and resid 21 and name HG2# )) (( segid "PROT" and resid 18 and name HD2# )) 6 6 0 peak 26032 weight 0.1000E+01 volume 10.50310 ppm1 1.312 ppm2 0.506 ASSI { 26042} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 26042 weight 0.1000E+01 volume 32.70560 ppm1 0.660 ppm2 0.775 ASSI { 26052} (( segid "PROT" and resid 120 and name HA )) (( segid "PROT" and resid 116 and name HG2# )) 6 6 0 peak 26052 weight 0.1000E+01 volume 2.02120 ppm1 4.435 ppm2 0.769 ASSI { 26082} (( segid "PROT" and resid 65 and name HE1 )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 26082 weight 0.1000E+01 volume 2.97960 ppm1 2.391 ppm2 1.138 ASSI { 26092} (( segid "PROT" and resid 65 and name HG2 )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 26092 weight 0.1000E+01 volume 6.95210 ppm1 0.732 ppm2 1.133 ASSI { 26102} (( segid "PROT" and resid 65 and name HB2 )) (( segid "PROT" and resid 61 and name HG2# )) 6 6 0 peak 26102 weight 0.1000E+01 volume 3.53230 ppm1 0.564 ppm2 1.137 ASSI { 26112} (( segid "PROT" and resid 34 and name HA )) (( segid "PROT" and resid 33 and name HD2# )) 6 6 0 peak 26112 weight 0.1000E+01 volume 4.89860 ppm1 4.360 ppm2 0.825 ASSI { 26122} (( segid "PROT" and resid 43 and name HA )) (( segid "PROT" and resid 44 and name HD2# )) 6 6 0 peak 26122 weight 0.1000E+01 volume 1.87200 ppm1 4.010 ppm2 0.819 ASSI { 26172} (( segid "PROT" and resid 105 and name HD1# )) (( segid "PROT" and resid 108 and name HG1# )) 6 6 0 peak 26172 weight 0.1000E+01 volume 3.75830 ppm1 0.394 ppm2 0.959 ASSI { 26182} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 26182 weight 0.1000E+01 volume 3.83700 ppm1 -0.256 ppm2 1.262 ASSI { 26192} (( segid "PROT" and resid 77 and name HD1 )) (( segid "PROT" and resid 78 and name HG1# )) 6 6 0 peak 26192 weight 0.1000E+01 volume 2.65890 ppm1 6.734 ppm2 1.268 ASSI { 26212} (( segid "PROT" and resid 35 and name HZ )) (( segid "PROT" and resid 98 and name HG1# )) 6 6 0 peak 26212 weight 0.1000E+01 volume 5.09730 ppm1 7.034 ppm2 0.817 ASSI { 26222} (( segid "PROT" and resid 35 and name HE1 )) (( segid "PROT" and resid 98 and name HG1# )) 6 6 0 peak 26222 weight 0.1000E+01 volume 6.91380 ppm1 7.358 ppm2 0.811 ASSI { 26232} (( segid "PROT" and resid 119 and name HB1 )) (( segid "PROT" and resid 120 and name HD2# )) 6 6 0 peak 26232 weight 0.1000E+01 volume 1.88060 ppm1 4.031 ppm2 0.659 ASSI { 26242} (( segid "PROT" and resid 98 and name HA )) (( segid "PROT" and resid 98 and name HG1# )) 6 6 0 peak 26242 weight 0.1000E+01 volume 7.33340 ppm1 3.286 ppm2 0.815 ASSI { 26252} (( segid "PROT" and resid 98 and name HA )) (( segid "PROT" and resid 98 and name HB )) 6 6 0 peak 26252 weight 0.1000E+01 volume 2.96820 ppm1 3.290 ppm2 1.661 ASSI { 26292} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 26292 weight 0.1000E+01 volume 2.76000 ppm1 -1.493 ppm2 1.108 ASSI { 26302} (( segid "PROT" and resid 117 and name HG2 )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 26302 weight 0.1000E+01 volume 4.96990 ppm1 2.507 ppm2 1.112 ASSI { 26312} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 78 and name HG2# )) 6 6 0 peak 26312 weight 0.1000E+01 volume 3.87960 ppm1 4.310 ppm2 1.106 ASSI { 26342} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 26342 weight 0.1000E+01 volume 7.41110 ppm1 7.189 ppm2 0.897 ASSI { 26362} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 25 and name HD2# )) 6 6 0 peak 26362 weight 0.1000E+01 volume 1.86840 ppm1 0.238 ppm2 0.896 ASSI { 26382} (( segid "PROT" and resid 77 and name HB1 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 26382 weight 0.1000E+01 volume 20.60780 ppm1 2.670 ppm2 0.262 ASSI { 26392} (( segid "PROT" and resid 13 and name HB1 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 26392 weight 0.1000E+01 volume 4.00850 ppm1 2.431 ppm2 0.266 ASSI { 26402} (( segid "PROT" and resid 13 and name HB2 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 26402 weight 0.1000E+01 volume 7.09220 ppm1 2.196 ppm2 0.265 ASSI { 26412} (( segid "PROT" and resid 74 and name HB1 )) (( segid "PROT" and resid 14 and name HD2# )) 6 6 0 peak 26412 weight 0.1000E+01 volume 27.24390 ppm1 1.783 ppm2 0.262 ASSI { 26422} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 43 and name HD1# )) 6 6 0 peak 26422 weight 0.1000E+01 volume 2.03200 ppm1 5.090 ppm2 0.856 ASSI { 26432} (( segid "PROT" and resid 105 and name HD2# )) (( segid "PROT" and resid 104 and name HG1 )) 6 6 0 peak 26432 weight 0.1000E+01 volume 1.67800 ppm1 0.570 ppm2 1.477 ASSI { 26442} (( segid "PROT" and resid 63 and name HA )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 26442 weight 0.1000E+01 volume 3.56310 ppm1 3.702 ppm2 1.101 ASSI { 26462} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 26462 weight 0.1000E+01 volume 2.41580 ppm1 -1.492 ppm2 1.101 ASSI { 26472} (( segid "PROT" and resid 25 and name HG )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 26472 weight 0.1000E+01 volume 3.55390 ppm1 2.380 ppm2 1.102 ASSI { 26502} (( segid "PROT" and resid 30 and name HD1 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 26502 weight 0.1000E+01 volume 3.22450 ppm1 3.350 ppm2 0.974 ASSI { 26512} (( segid "PROT" and resid 36 and name HD1 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 26512 weight 0.1000E+01 volume 1.68580 ppm1 3.205 ppm2 0.974 ASSI { 26522} (( segid "PROT" and resid 36 and name HD2 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 26522 weight 0.1000E+01 volume 2.67690 ppm1 3.046 ppm2 0.971 ASSI { 26532} (( segid "PROT" and resid 29 and name HB1 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 26532 weight 0.1000E+01 volume 2.41390 ppm1 2.780 ppm2 0.970 ASSI { 26542} (( segid "PROT" and resid 29 and name HB2 )) (( segid "PROT" and resid 33 and name HD1# )) 6 6 0 peak 26542 weight 0.1000E+01 volume 6.08120 ppm1 2.252 ppm2 0.968 ASSI { 26582} (( segid "PROT" and resid 25 and name HB1 )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 26582 weight 0.1000E+01 volume 3.91570 ppm1 2.297 ppm2 0.235 ASSI { 26592} (( segid "PROT" and resid 25 and name HD2# )) (( segid "PROT" and resid 59 and name HD1# )) 6 6 0 peak 26592 weight 0.1000E+01 volume 3.25260 ppm1 0.890 ppm2 0.231 ASSI { 26602} (( segid "PROT" and resid 41 and name HA )) (( segid "PROT" and resid 46 and name HG11 )) 6 6 0 peak 26602 weight 0.1000E+01 volume 1.70800 ppm1 3.646 ppm2 1.697 ASSI { 26612} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 100 and name HG2 )) 6 6 0 peak 26612 weight 0.1000E+01 volume 3.57270 ppm1 7.127 ppm2 1.593 ASSI { 26622} (( segid "PROT" and resid 18 and name HD2# )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 26622 weight 0.1000E+01 volume 7.82020 ppm1 0.510 ppm2 0.730 ASSI { 26632} (( segid "PROT" and resid 63 and name HE1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 26632 weight 0.1000E+01 volume 4.48540 ppm1 2.774 ppm2 0.741 ASSI { 26642} (( segid "PROT" and resid 19 and name HG1 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 26642 weight 0.1000E+01 volume 8.02890 ppm1 2.666 ppm2 0.741 ASSI { 26652} (( segid "PROT" and resid 19 and name HG2 )) (( segid "PROT" and resid 66 and name HD1# )) 6 6 0 peak 26652 weight 0.1000E+01 volume 1.99900 ppm1 2.557 ppm2 0.741 ASSI { 26672} (( segid "PROT" and resid 55 and name HA )) (( segid "PROT" and resid 83 and name HD1# )) 6 6 0 peak 26672 weight 0.1000E+01 volume 2.32530 ppm1 5.246 ppm2 0.887 ASSI { 26682} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 18 and name HG )) 6 6 0 peak 26682 weight 0.1000E+01 volume 1.60200 ppm1 6.608 ppm2 1.547 ASSI { 26692} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 22 and name HD1# )) 6 6 0 peak 26692 weight 0.1000E+01 volume 2.06690 ppm1 0.234 ppm2 1.089 ASSI { 26702} (( segid "PROT" and resid 81 and name HG1# )) (( segid "PROT" and resid 22 and name HD2# )) 6 6 0 peak 26702 weight 0.1000E+01 volume 0.74580 ppm1 -0.255 ppm2 1.090 ASSI { 26712} (( segid "PROT" and resid 101 and name HZ )) (( segid "PROT" and resid 97 and name HG2 )) 6 6 0 peak 26712 weight 0.1000E+01 volume 2.85960 ppm1 7.137 ppm2 0.663 ASSI { 26722} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 14 and name HG )) 6 6 0 peak 26722 weight 0.1000E+01 volume 3.47900 ppm1 7.330 ppm2 1.402 ASSI { 26732} (( segid "PROT" and resid 44 and name HD1# )) (( segid "PROT" and resid 44 and name HG )) 6 6 0 peak 26732 weight 0.1000E+01 volume 23.28610 ppm1 0.746 ppm2 1.699 ASSI { 26742} (( segid "PROT" and resid 40 and name HB1 )) (( segid "PROT" and resid 43 and name HG )) 6 6 0 peak 26742 weight 0.1000E+01 volume 4.75960 ppm1 2.936 ppm2 1.498 ASSI { 26752} (( segid "PROT" and resid 40 and name HB2 )) (( segid "PROT" and resid 43 and name HG )) 6 6 0 peak 26752 weight 0.1000E+01 volume 5.64820 ppm1 2.382 ppm2 1.490 ASSI { 26762} (( segid "PROT" and resid 78 and name HB )) (( segid "PROT" and resid 75 and name HB1 )) 6 6 0 peak 26762 weight 0.1000E+01 volume 1.53930 ppm1 2.260 ppm2 3.619 ASSI { 26772} (( segid "PROT" and resid 78 and name HB )) (( segid "PROT" and resid 75 and name HB2 )) 6 6 0 peak 26772 weight 0.1000E+01 volume 2.02220 ppm1 2.273 ppm2 3.277 ASSI { 26782} (( segid "PROT" and resid 39 and name HG2# )) (( segid "PROT" and resid 41 and name HG1 )) 6 6 0 peak 26782 weight 0.1000E+01 volume 2.88310 ppm1 -0.368 ppm2 1.574 ASSI { 26792} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 104 and name HD2 )) 6 6 0 peak 26792 weight 0.1000E+01 volume 3.39610 ppm1 7.098 ppm2 1.621 ASSI { 26812} (( segid "PROT" and resid 114 and name HB2 )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 26812 weight 0.1000E+01 volume 14.44850 ppm1 2.689 ppm2 2.044 ASSI { 26822} (( segid "PROT" and resid 114 and name HB1 )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 26822 weight 0.1000E+01 volume 5.60100 ppm1 2.840 ppm2 2.045 ASSI { 26832} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 115 and name HG1 )) 6 6 0 peak 26832 weight 0.1000E+01 volume 16.21050 ppm1 1.038 ppm2 2.039 ASSI { 26842} (( segid "PROT" and resid 82 and name HE3 )) (( segid "PROT" and resid 82 and name HB2 )) 6 6 0 peak 26842 weight 0.1000E+01 volume 1.64690 ppm1 7.896 ppm2 3.106 ASSI { 26852} (( segid "PROT" and resid 70 and name HG1 )) (( segid "PROT" and resid 70 and name HB2 )) 6 6 0 peak 26852 weight 0.1000E+01 volume 6.00170 ppm1 2.266 ppm2 1.085 ASSI { 26862} (( segid "PROT" and resid 65 and name HA )) (( segid "PROT" and resid 65 and name HD1 )) 6 6 0 peak 26862 weight 0.1000E+01 volume 1.66790 ppm1 3.415 ppm2 1.539 ASSI { 26872} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 111 and name HB1 )) 6 6 0 peak 26872 weight 0.1000E+01 volume 1.51600 ppm1 0.958 ppm2 2.268 ASSI { 26882} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 111 and name HB1 )) 6 6 0 peak 26882 weight 0.1000E+01 volume 2.34050 ppm1 0.866 ppm2 2.271 ASSI { 26892} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 100 and name HD1 )) 6 6 0 peak 26892 weight 0.1000E+01 volume 2.57960 ppm1 7.120 ppm2 1.699 ASSI { 26902} (( segid "PROT" and resid 101 and name HD1 )) (( segid "PROT" and resid 100 and name HD2 )) 6 6 0 peak 26902 weight 0.1000E+01 volume 1.01950 ppm1 7.123 ppm2 1.646 ASSI { 26912} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 13 and name HB1 )) 6 6 0 peak 26912 weight 0.1000E+01 volume 4.44960 ppm1 7.334 ppm2 2.404 ASSI { 26922} (( segid "PROT" and resid 9 and name HD1 )) (( segid "PROT" and resid 13 and name HB2 )) 6 6 0 peak 26922 weight 0.1000E+01 volume 4.49870 ppm1 7.326 ppm2 2.200 ASSI { 26932} (( segid "PROT" and resid 82 and name HZ2 )) (( segid "PROT" and resid 110 and name HB2 )) 6 6 0 peak 26932 weight 0.1000E+01 volume 2.00600 ppm1 7.717 ppm2 2.155 ASSI { 26942} (( segid "PROT" and resid 82 and name HH2 )) (( segid "PROT" and resid 110 and name HB2 )) 6 6 0 peak 26942 weight 0.1000E+01 volume 2.25430 ppm1 7.486 ppm2 2.204 ASSI { 26952} (( segid "PROT" and resid 82 and name HH2 )) (( segid "PROT" and resid 110 and name HB1 )) 6 6 0 peak 26952 weight 0.1000E+01 volume 0.93760 ppm1 7.493 ppm2 2.378 ASSI { 26962} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 62 and name HG11 )) 6 6 0 peak 26962 weight 0.1000E+01 volume 3.36610 ppm1 0.736 ppm2 1.861 ASSI { 26972} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 81 and name HB )) 6 6 0 peak 26972 weight 0.1000E+01 volume 2.31490 ppm1 7.185 ppm2 0.869 ASSI { 26982} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 62 and name HG11 )) 6 6 0 peak 26982 weight 0.1000E+01 volume 6.50340 ppm1 0.836 ppm2 1.863 ASSI { 27002} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 36 and name HB1 )) 6 6 0 peak 27002 weight 0.1000E+01 volume 1.01800 ppm1 0.236 ppm2 2.117 ASSI { 27012} (( segid "PROT" and resid 36 and name HD1 )) (( segid "PROT" and resid 36 and name HB1 )) 6 6 0 peak 27012 weight 0.1000E+01 volume 2.19090 ppm1 3.205 ppm2 2.129 ASSI { 27022} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 36 and name HD1 )) 6 6 0 peak 27022 weight 0.1000E+01 volume 1.97530 ppm1 0.233 ppm2 3.193 ASSI { 27032} (( segid "PROT" and resid 59 and name HD1# )) (( segid "PROT" and resid 36 and name HD2 )) 6 6 0 peak 27032 weight 0.1000E+01 volume 1.24110 ppm1 0.238 ppm2 3.050 ASSI { 27042} (( segid "PROT" and resid 26 and name HE1 )) (( segid "PROT" and resid 36 and name HB2 )) 6 6 0 peak 27042 weight 0.1000E+01 volume 1.08520 ppm1 6.613 ppm2 1.904 ASSI { 27052} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 115 and name HB2 )) 6 6 0 peak 27052 weight 0.1000E+01 volume 2.68880 ppm1 1.037 ppm2 1.855 ASSI { 27062} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 115 and name HB1 )) 6 6 0 peak 27062 weight 0.1000E+01 volume 1.22980 ppm1 1.037 ppm2 2.273 ASSI { 27072} (( segid "PROT" and resid 104 and name HE1 )) (( segid "PROT" and resid 104 and name HB1 )) 6 6 0 peak 27072 weight 0.1000E+01 volume 2.68210 ppm1 2.828 ppm2 2.040 ASSI { 27082} (( segid "PROT" and resid 75 and name HE3 )) (( segid "PROT" and resid 78 and name HB )) 6 6 0 peak 27082 weight 0.1000E+01 volume 2.33290 ppm1 7.543 ppm2 2.264 ASSI { 27092} (( segid "PROT" and resid 82 and name HD1 )) (( segid "PROT" and resid 78 and name HB )) 6 6 0 peak 27092 weight 0.1000E+01 volume 3.26910 ppm1 7.475 ppm2 2.264 ASSI { 27112} (( segid "PROT" and resid 99 and name HD1 )) (( segid "PROT" and resid 94 and name HB1 )) 6 6 0 peak 27112 weight 0.1000E+01 volume 6.06680 ppm1 7.120 ppm2 1.389 ASSI { 27122} (( segid "PROT" and resid 99 and name HE1 )) (( segid "PROT" and resid 94 and name HB1 )) 6 6 0 peak 27122 weight 0.1000E+01 volume 3.97070 ppm1 7.029 ppm2 1.388 ASSI { 27132} (( segid "PROT" and resid 108 and name HG2# )) (( segid "PROT" and resid 28 and name HG1 )) 6 6 0 peak 27132 weight 0.1000E+01 volume 4.93780 ppm1 0.885 ppm2 2.807 ASSI { 27142} (( segid "PROT" and resid 28 and name HA )) (( segid "PROT" and resid 28 and name HB2 )) 6 6 0 peak 27142 weight 0.1000E+01 volume 14.30950 ppm1 4.115 ppm2 2.049 ASSI { 27162} (( segid "PROT" and resid 56 and name HD1 )) (( segid "PROT" and resid 56 and name HB1 )) 6 6 0 peak 27162 weight 0.1000E+01 volume 2.57870 ppm1 3.692 ppm2 2.438 ASSI { 27172} (( segid "PROT" and resid 41 and name HD2 )) (( segid "PROT" and resid 41 and name HB2 )) 6 6 0 peak 27172 weight 0.1000E+01 volume 2.81020 ppm1 3.725 ppm2 1.735 ASSI { 27192} (( segid "PROT" and resid 6 and name HE1 )) (( segid "PROT" and resid 6 and name HB1 )) 6 6 0 peak 27192 weight 0.1000E+01 volume 11.63550 ppm1 2.929 ppm2 1.756 ASSI { 27202} (( segid "PROT" and resid 6 and name HG2 )) (( segid "PROT" and resid 6 and name HB1 )) 6 6 0 peak 27202 weight 0.1000E+01 volume 31.33970 ppm1 1.300 ppm2 1.759 ASSI { 27212} (( segid "PROT" and resid 6 and name HG1 )) (( segid "PROT" and resid 6 and name HB1 )) 6 6 0 peak 27212 weight 0.1000E+01 volume 11.80130 ppm1 1.390 ppm2 1.725 ASSI { 27222} (( segid "PROT" and resid 6 and name HE1 )) (( segid "PROT" and resid 6 and name HA )) 6 6 0 peak 27222 weight 0.1000E+01 volume 6.11840 ppm1 2.926 ppm2 4.271 ASSI { 27232} (( segid "PROT" and resid 6 and name HG1 )) (( segid "PROT" and resid 6 and name HA )) 6 6 0 peak 27232 weight 0.1000E+01 volume 24.68540 ppm1 1.384 ppm2 4.272 ASSI { 27252} (( segid "PROT" and resid 41 and name HB2 )) (( segid "PROT" and resid 42 and name HG1 )) 6 6 0 peak 27252 weight 0.1000E+01 volume 4.46550 ppm1 1.732 ppm2 2.362 ASSI { 27262} (( segid "PROT" and resid 41 and name HG1 )) (( segid "PROT" and resid 42 and name HG1 )) 6 6 0 peak 27262 weight 0.1000E+01 volume 3.55580 ppm1 1.580 ppm2 2.363 ASSI { 27282} (( segid "PROT" and resid 68 and name HG2# )) (( segid "PROT" and resid 70 and name HG1 )) 6 6 0 peak 27282 weight 0.1000E+01 volume 5.14050 ppm1 1.224 ppm2 2.239 ASSI { 27292} (( segid "PROT" and resid 14 and name HD1# )) (( segid "PROT" and resid 72 and name HG1 )) 6 6 0 peak 27292 weight 0.1000E+01 volume 1.81570 ppm1 0.353 ppm2 2.430 ASSI { 27302} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 72 and name HG1 )) 6 6 0 peak 27302 weight 0.1000E+01 volume 0.78020 ppm1 0.266 ppm2 2.423 ASSI { 27322} (( segid "PROT" and resid 74 and name HD1 )) (( segid "PROT" and resid 73 and name HG2 )) 6 6 0 peak 27322 weight 0.1000E+01 volume 1.86800 ppm1 3.758 ppm2 2.247 ASSI { 27332} (( segid "PROT" and resid 75 and name HZ2 )) (( segid "PROT" and resid 73 and name HG1 )) 6 6 0 peak 27332 weight 0.1000E+01 volume 2.39390 ppm1 7.476 ppm2 2.433 ASSI { 27342} (( segid "PROT" and resid 75 and name HZ2 )) (( segid "PROT" and resid 73 and name HG2 )) 6 6 0 peak 27342 weight 0.1000E+01 volume 2.33480 ppm1 7.474 ppm2 2.247 ASSI { 27352} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 107 and name HB1 )) 6 6 0 peak 27352 weight 0.1000E+01 volume 4.59560 ppm1 0.956 ppm2 2.209 ASSI { 27362} (( segid "PROT" and resid 108 and name HG1# )) (( segid "PROT" and resid 107 and name HG1 )) 6 6 0 peak 27362 weight 0.1000E+01 volume 2.25050 ppm1 0.953 ppm2 2.493 ASSI { 27372} (( segid "PROT" and resid 10 and name HD1 )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 27372 weight 0.1000E+01 volume 3.71640 ppm1 1.767 ppm2 2.339 ASSI { 27382} (( segid "PROT" and resid 120 and name HD2# )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 27382 weight 0.1000E+01 volume 0.67550 ppm1 0.659 ppm2 2.355 ASSI { 27392} (( segid "PROT" and resid 14 and name HD2# )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 27392 weight 0.1000E+01 volume 1.60470 ppm1 0.267 ppm2 2.358 ASSI { 27402} (( segid "PROT" and resid 10 and name HE1 )) (( segid "PROT" and resid 13 and name HG1 )) 6 6 0 peak 27402 weight 0.1000E+01 volume 2.15070 ppm1 3.006 ppm2 2.341 ASSI { 27412} (( segid "PROT" and resid 26 and name HB1 )) (( segid "PROT" and resid 23 and name HG1 )) 6 6 0 peak 27412 weight 0.1000E+01 volume 2.91200 ppm1 2.892 ppm2 2.326 ASSI { 27422} (( segid "PROT" and resid 26 and name HB1 )) (( segid "PROT" and resid 23 and name HG2 )) 6 6 0 peak 27422 weight 0.1000E+01 volume 4.19700 ppm1 2.892 ppm2 2.116 ASSI { 27432} (( segid "PROT" and resid 19 and name HG1 )) (( segid "PROT" and resid 23 and name HG2 )) 6 6 0 peak 27432 weight 0.1000E+01 volume 2.06070 ppm1 2.681 ppm2 2.129 ASSI { 27462} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 87 and name HB1 )) 6 6 0 peak 27462 weight 0.1000E+01 volume 3.22560 ppm1 0.612 ppm2 3.090 ASSI { 27472} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 87 and name HB2 )) 6 6 0 peak 27472 weight 0.1000E+01 volume 2.48090 ppm1 0.613 ppm2 2.754 ASSI { 27482} (( segid "PROT" and resid 111 and name HA )) (( segid "PROT" and resid 114 and name HB1 )) 6 6 0 peak 27482 weight 0.1000E+01 volume 3.04610 ppm1 4.108 ppm2 2.850 ASSI { 27492} (( segid "PROT" and resid 111 and name HA )) (( segid "PROT" and resid 114 and name HB2 )) 6 6 0 peak 27492 weight 0.1000E+01 volume 3.40160 ppm1 4.109 ppm2 2.685 ASSI { 27502} (( segid "PROT" and resid 113 and name HG2# )) (( segid "PROT" and resid 114 and name HB2 )) 6 6 0 peak 27502 weight 0.1000E+01 volume 3.03070 ppm1 0.724 ppm2 2.694 ASSI { 27512} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 62 and name HB )) 6 6 0 peak 27512 weight 0.1000E+01 volume 0.77660 ppm1 6.614 ppm2 1.695 ASSI { 27522} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 35 and name HB2 )) 6 6 0 peak 27522 weight 0.1000E+01 volume 3.10750 ppm1 7.431 ppm2 2.636 ASSI { 27532} (( segid "PROT" and resid 35 and name HD1 )) (( segid "PROT" and resid 35 and name HB1 )) 6 6 0 peak 27532 weight 0.1000E+01 volume 2.49740 ppm1 7.424 ppm2 3.856 ASSI { 27542} (( segid "PROT" and resid 49 and name HB2 )) (( segid "PROT" and resid 49 and name HB1 )) 6 6 0 peak 27542 weight 0.1000E+01 volume 3.06430 ppm1 1.981 ppm2 2.781 ASSI { 27552} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 109 and name HB1 )) 6 6 0 peak 27552 weight 0.1000E+01 volume 2.29240 ppm1 0.673 ppm2 3.353 ASSI { 27562} (( segid "PROT" and resid 25 and name HD1# )) (( segid "PROT" and resid 109 and name HB2 )) 6 6 0 peak 27562 weight 0.1000E+01 volume 1.09440 ppm1 0.676 ppm2 3.072 ASSI { 27572} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 49 and name HA )) 6 6 0 peak 27572 weight 0.1000E+01 volume 1.33190 ppm1 0.450 ppm2 3.572 ASSI { 27582} (( segid "PROT" and resid 83 and name HG )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 27582 weight 0.1000E+01 volume 3.59830 ppm1 1.407 ppm2 2.724 ASSI { 27592} (( segid "PROT" and resid 83 and name HB1 )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 27592 weight 0.1000E+01 volume 2.10130 ppm1 2.149 ppm2 2.736 ASSI { 27602} (( segid "PROT" and resid 83 and name HB2 )) (( segid "PROT" and resid 55 and name HB1 )) 6 6 0 peak 27602 weight 0.1000E+01 volume 0.80070 ppm1 1.650 ppm2 2.748 ASSI { 27612} (( segid "PROT" and resid 91 and name HE1 )) (( segid "PROT" and resid 91 and name HB1 )) 6 6 0 peak 27612 weight 0.1000E+01 volume 2.35450 ppm1 6.707 ppm2 2.950 ASSI { 27642} (( segid "PROT" and resid 40 and name HA )) (( segid "PROT" and resid 43 and name HB1 )) 6 6 0 peak 27642 weight 0.1000E+01 volume 3.14860 ppm1 5.083 ppm2 1.552 ASSI { 27652} (( segid "PROT" and resid 102 and name HA )) (( segid "PROT" and resid 105 and name HB2 )) 6 6 0 peak 27652 weight 0.1000E+01 volume 1.14410 ppm1 3.241 ppm2 1.111 ASSI { 27662} (( segid "PROT" and resid 44 and name HD2# )) (( segid "PROT" and resid 43 and name HB1 )) 6 6 0 peak 27662 weight 0.1000E+01 volume 4.61630 ppm1 0.750 ppm2 1.561 ASSI { 27672} (( segid "PROT" and resid 9 and name HE1 )) (( segid "PROT" and resid 120 and name HB1 )) 6 6 0 peak 27672 weight 0.1000E+01 volume 3.90660 ppm1 7.399 ppm2 1.764 ASSI { 27682} (( segid "PROT" and resid 117 and name HA )) (( segid "PROT" and resid 120 and name HB1 )) 6 6 0 peak 27682 weight 0.1000E+01 volume 5.18740 ppm1 4.318 ppm2 1.766 ASSI { 27692} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 66 and name HB1 )) 6 6 0 peak 27692 weight 0.1000E+01 volume 2.92610 ppm1 1.093 ppm2 1.935 ASSI { 27702} (( segid "PROT" and resid 22 and name HD2# )) (( segid "PROT" and resid 66 and name HB2 )) 6 6 0 peak 27702 weight 0.1000E+01 volume 2.76080 ppm1 1.093 ppm2 1.759 ASSI { 27722} (( segid "PROT" and resid 66 and name HD1# )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 27722 weight 0.1000E+01 volume 2.78950 ppm1 0.738 ppm2 3.281 ASSI { 27732} (( segid "PROT" and resid 66 and name HD2# )) (( segid "PROT" and resid 15 and name HD1 )) 6 6 0 peak 27732 weight 0.1000E+01 volume 2.27290 ppm1 0.835 ppm2 3.285 ASSI { 27742} (( segid "PROT" and resid 72 and name HG1 )) (( segid "PROT" and resid 69 and name HA2 )) 6 6 0 peak 27742 weight 0.1000E+01 volume 1.85000 ppm1 2.443 ppm2 3.902 ASSI { 27752} (( segid "PROT" and resid 72 and name HG1 )) (( segid "PROT" and resid 69 and name HA1 )) 6 6 0 peak 27752 weight 0.1000E+01 volume 1.80580 ppm1 2.439 ppm2 4.260 ASSI { 27772} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 27772 weight 0.1000E+01 volume 1.94690 ppm1 0.612 ppm2 5.245 ASSI { 27782} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 55 and name HA )) 6 6 0 peak 27782 weight 0.1000E+01 volume 2.12310 ppm1 2.446 ppm2 5.255 ASSI { 27792} (( segid "PROT" and resid 53 and name HG2# )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 27792 weight 0.1000E+01 volume 3.47570 ppm1 0.613 ppm2 3.704 ASSI { 27802} (( segid "PROT" and resid 56 and name HB1 )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 27802 weight 0.1000E+01 volume 3.48160 ppm1 2.442 ppm2 3.449 ASSI { 27812} (( segid "PROT" and resid 55 and name HB1 )) (( segid "PROT" and resid 56 and name HD1 )) 6 6 0 peak 27812 weight 0.1000E+01 volume 6.28580 ppm1 2.741 ppm2 3.709 ASSI { 27822} (( segid "PROT" and resid 55 and name HB1 )) (( segid "PROT" and resid 56 and name HD2 )) 6 6 0 peak 27822 weight 0.1000E+01 volume 2.96460 ppm1 2.741 ppm2 3.443 ASSI { 27832} (( segid "PROT" and resid 73 and name HG2 )) (( segid "PROT" and resid 73 and name HA )) 6 6 0 peak 27832 weight 0.1000E+01 volume 3.79530 ppm1 2.245 ppm2 4.626 ASSI { 27842} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 17 and name HA )) 6 6 0 peak 27842 weight 0.1000E+01 volume 1.26910 ppm1 0.615 ppm2 4.187 ASSI { 27852} (( segid "PROT" and resid 81 and name HG2# )) (( segid "PROT" and resid 106 and name HA )) 6 6 0 peak 27852 weight 0.1000E+01 volume 1.08200 ppm1 -1.494 ppm2 3.416 ASSI { 27882} (( segid "PROT" and resid 4 and name HB1 )) (( segid "PROT" and resid 4 and name HA )) 6 6 0 peak 27882 weight 0.1000E+01 volume 15.07660 ppm1 2.028 ppm2 4.401 ASSI { 27892} (( segid "PROT" and resid 4 and name HB2 )) (( segid "PROT" and resid 4 and name HA )) 6 6 0 peak 27892 weight 0.1000E+01 volume 11.29610 ppm1 1.952 ppm2 4.399 ASSI { 27902} (( segid "PROT" and resid 4 and name HG1 )) (( segid "PROT" and resid 4 and name HA )) 6 6 0 peak 27902 weight 0.1000E+01 volume 2.62020 ppm1 2.502 ppm2 4.401 ASSI { 27912} (( segid "PROT" and resid 4 and name HG2 )) (( segid "PROT" and resid 4 and name HA )) 6 6 0 peak 27912 weight 0.1000E+01 volume 6.13060 ppm1 2.443 ppm2 4.403 ASSI { 27922} (( segid "PROT" and resid 3 and name HB1 )) (( segid "PROT" and resid 3 and name HA )) 6 6 0 peak 27922 weight 0.1000E+01 volume 14.77490 ppm1 3.112 ppm2 4.603 ASSI { 27932} (( segid "PROT" and resid 3 and name HB2 )) (( segid "PROT" and resid 3 and name HA )) 6 6 0 peak 27932 weight 0.1000E+01 volume 11.09160 ppm1 3.027 ppm2 4.602 ASSI { 27982} (( segid "PROT" and resid 3 and name HA )) (( segid "PROT" and resid 3 and name HB1 )) 6 6 0 peak 27982 weight 0.1000E+01 volume 22.44580 ppm1 4.608 ppm2 3.113 ASSI { 27992} (( segid "PROT" and resid 3 and name HA )) (( segid "PROT" and resid 3 and name HB2 )) 6 6 0 peak 27992 weight 0.1000E+01 volume 30.35250 ppm1 4.606 ppm2 3.030 ASSI { 28002} (( segid "PROT" and resid 3 and name HD2 )) (( segid "PROT" and resid 3 and name HB2 )) 6 6 0 peak 28002 weight 0.1000E+01 volume 6.79280 ppm1 7.018 ppm2 3.026 ASSI { 28012} (( segid "PROT" and resid 3 and name HD2 )) (( segid "PROT" and resid 3 and name HB1 )) 6 6 0 peak 28012 weight 0.1000E+01 volume 3.27500 ppm1 7.019 ppm2 3.097 ASSI { 28022} (( segid "PROT" and resid 4 and name HA )) (( segid "PROT" and resid 4 and name HB1 )) 6 6 0 peak 28022 weight 0.1000E+01 volume 15.49310 ppm1 4.402 ppm2 2.021 ASSI { 28032} (( segid "PROT" and resid 4 and name HG2 )) (( segid "PROT" and resid 4 and name HB1 )) 6 6 0 peak 28032 weight 0.1000E+01 volume 11.51890 ppm1 2.442 ppm2 2.035 ASSI { 28042} (( segid "PROT" and resid 4 and name HG1 )) (( segid "PROT" and resid 4 and name HB2 )) 6 6 0 peak 28042 weight 0.1000E+01 volume 11.33850 ppm1 2.506 ppm2 1.958 ASSI { 28052} (( segid "PROT" and resid 4 and name HA )) (( segid "PROT" and resid 4 and name HG2 )) 6 6 0 peak 28052 weight 0.1000E+01 volume 5.94670 ppm1 4.406 ppm2 2.441 ASSI { 28062} (( segid "PROT" and resid 4 and name HB1 )) (( segid "PROT" and resid 4 and name HG2 )) 6 6 0 peak 28062 weight 0.1000E+01 volume 26.82030 ppm1 2.036 ppm2 2.444 ASSI { 28072} (( segid "PROT" and resid 4 and name HB2 )) (( segid "PROT" and resid 4 and name HG1 )) 6 6 0 peak 28072 weight 0.1000E+01 volume 5.90350 ppm1 1.953 ppm2 2.510 ASSI { 28102} (( segid "PROT" and resid 26 and name HB1 )) (( segid "PROT" and resid 27 and name HA )) 6 6 0 peak 28102 weight 0.1000E+01 volume 2.91270 ppm1 2.907 ppm2 4.008 ASSI { 28112} (( segid "PROT" and resid 27 and name HD2 )) (( segid "PROT" and resid 27 and name HA )) 6 6 0 peak 28112 weight 0.1000E+01 volume 2.05680 ppm1 3.121 ppm2 4.009 ASSI { 28122} (( segid "PROT" and resid 27 and name HD1 )) (( segid "PROT" and resid 27 and name HA )) 6 6 0 peak 28122 weight 0.1000E+01 volume 2.78060 ppm1 3.191 ppm2 4.008 ASSI { 28142} (( segid "PROT" and resid 104 and name HE1 )) (( segid "PROT" and resid 104 and name HA )) 6 6 0 peak 28142 weight 0.1000E+01 volume 3.48380 ppm1 2.829 ppm2 4.240 ASSI { 28152} (( segid "PROT" and resid 83 and name HG )) (( segid "PROT" and resid 83 and name HA )) 6 6 0 peak 28152 weight 0.1000E+01 volume 3.27180 ppm1 1.409 ppm2 4.235 ASSI { 28172} (( segid "PROT" and resid 2 and name HB1 )) (( segid "PROT" and resid 2 and name HA )) 6 6 0 peak 28172 weight 0.1000E+01 volume 32.34560 ppm1 3.754 ppm2 4.396 ASSI { 28182} (( segid "PROT" and resid 2 and name HA )) (( segid "PROT" and resid 2 and name HB1 )) 6 6 0 peak 28182 weight 0.1000E+01 volume 24.99090 ppm1 4.399 ppm2 3.753 ASSI { 28192} (( segid "PROT" and resid 94 and name HE1 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 28192 weight 0.1000E+01 volume 1.53120 ppm1 2.883 ppm2 2.171 ASSI { 28202} (( segid "PROT" and resid 99 and name HB2 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 28202 weight 0.1000E+01 volume 3.14320 ppm1 2.599 ppm2 2.180 ASSI { 28212} (( segid "PROT" and resid 94 and name HD1 )) (( segid "PROT" and resid 94 and name HA )) 6 6 0 peak 28212 weight 0.1000E+01 volume 6.53990 ppm1 1.505 ppm2 2.178 ASSI { 28222} (( segid "PROT" and resid 28 and name HB1 )) (( segid "PROT" and resid 31 and name HA )) 6 6 0 peak 28222 weight 0.1000E+01 volume 1.59140 ppm1 2.098 ppm2 2.589 ASSI { 28272} (( segid "PROT" and resid 82 and name HZ2 )) (( segid "PROT" and resid 110 and name HA )) 6 6 0 peak 28272 weight 0.1000E+01 volume 2.17530 ppm1 7.718 ppm2 4.005 ASSI { 28282} (( segid "PROT" and resid 80 and name HB2 )) (( segid "PROT" and resid 77 and name HA )) 6 6 0 peak 28282 weight 0.1000E+01 volume 1.30950 ppm1 2.497 ppm2 3.387 ASSI { 28292} (( segid "PROT" and resid 7 and name HG2 )) (( segid "PROT" and resid 8 and name HA )) 6 6 0 peak 28292 weight 0.1000E+01 volume 1.66690 ppm1 0.959 ppm2 4.284 ASSI { 28302} (( segid "PROT" and resid 103 and name HB2 )) (( segid "PROT" and resid 100 and name HA )) 6 6 0 peak 28302 weight 0.1000E+01 volume 8.95940 ppm1 4.114 ppm2 4.317 ASSI { 28312} (( segid "PROT" and resid 77 and name HE1 )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 28312 weight 0.1000E+01 volume 1.09700 ppm1 6.612 ppm2 3.693 ASSI { 28322} (( segid "PROT" and resid 63 and name HE1 )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 28322 weight 0.1000E+01 volume 1.96690 ppm1 2.798 ppm2 3.694 ASSI { 28332} (( segid "PROT" and resid 60 and name HA )) (( segid "PROT" and resid 63 and name HA )) 6 6 0 peak 28332 weight 0.1000E+01 volume 2.92800 ppm1 4.229 ppm2 3.683 ASSI { 28342} (( segid "PROT" and resid 36 and name HB2 )) (( segid "PROT" and resid 33 and name HA )) 6 6 0 peak 28342 weight 0.1000E+01 volume 2.63240 ppm1 1.908 ppm2 3.903 ASSI { 28352} (( segid "PROT" and resid 85 and name HB2 )) (( segid "PROT" and resid 82 and name HA )) 6 6 0 peak 28352 weight 0.1000E+01 volume 2.43550 ppm1 1.460 ppm2 3.980 ASSI { 28362} (( segid "PROT" and resid 70 and name HA )) (( segid "PROT" and resid 65 and name HA )) 6 6 0 peak 28362 weight 0.1000E+01 volume 1.94540 ppm1 3.983 ppm2 3.417 ASSI { 28372} (( segid "PROT" and resid 53 and name HG1# )) (( segid "PROT" and resid 91 and name HA )) 6 6 0 peak 28372 weight 0.1000E+01 volume 5.27940 ppm1 0.447 ppm2 4.008 ASSI { 28392} (( segid "PROT" and resid 85 and name HE1 )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 28392 weight 0.1000E+01 volume 2.08830 ppm1 6.070 ppm2 4.036 ASSI { 28402} (( segid "PROT" and resid 109 and name HE1 )) (( segid "PROT" and resid 109 and name HA )) 6 6 0 peak 28402 weight 0.1000E+01 volume 2.95370 ppm1 7.188 ppm2 4.034 ASSI { 28412} (( segid "PROT" and resid 26 and name HD1 )) (( segid "PROT" and resid 26 and name HA )) 6 6 0 peak 28412 weight 0.1000E+01 volume 6.33780 ppm1 6.935 ppm2 3.715 ASSI { 28422} (( segid "PROT" and resid 59 and name HD2# )) (( segid "PROT" and resid 26 and name HA )) 6 6 0 peak 28422 weight 0.1000E+01 volume 1.79560 ppm1 0.573 ppm2 3.707 ASSI { 28432} (( segid "PROT" and resid 27 and name HA )) (( segid "PROT" and resid 26 and name HA )) 6 6 0 peak 28432 weight 0.1000E+01 volume 2.03500 ppm1 4.019 ppm2 3.711 ASSI { 28452} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 119 and name HB2 )) 6 6 0 peak 28452 weight 0.1000E+01 volume 2.80970 ppm1 0.618 ppm2 4.012 ASSI { 28462} (( segid "PROT" and resid 120 and name HB1 )) (( segid "PROT" and resid 119 and name HB2 )) 6 6 0 peak 28462 weight 0.1000E+01 volume 2.18500 ppm1 1.780 ppm2 4.017 ASSI { 28472} (( segid "PROT" and resid 112 and name HB1 )) (( segid "PROT" and resid 21 and name HA )) 6 6 0 peak 28472 weight 0.1000E+01 volume 12.50180 ppm1 2.013 ppm2 4.147 ASSI { 28482} (( segid "PROT" and resid 112 and name HB2 )) (( segid "PROT" and resid 21 and name HA )) 6 6 0 peak 28482 weight 0.1000E+01 volume 6.21620 ppm1 1.758 ppm2 4.139 ASSI { 28492} (( segid "PROT" and resid 116 and name HG1# )) (( segid "PROT" and resid 21 and name HA )) 6 6 0 peak 28492 weight 0.1000E+01 volume 1.42880 ppm1 1.036 ppm2 4.148 ASSI { 28502} (( segid "PROT" and resid 44 and name HD2# )) (( segid "PROT" and resid 39 and name HA )) 6 6 0 peak 28502 weight 0.1000E+01 volume 3.82580 ppm1 0.829 ppm2 3.202 ASSI { 28522} (( segid "PROT" and resid 120 and name HD1# )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 28522 weight 0.1000E+01 volume 1.48450 ppm1 0.610 ppm2 3.767 ASSI { 28532} (( segid "PROT" and resid 71 and name HB2 )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 28532 weight 0.1000E+01 volume 2.67390 ppm1 2.655 ppm2 3.772 ASSI { 28542} (( segid "PROT" and resid 71 and name HB1 )) (( segid "PROT" and resid 74 and name HA )) 6 6 0 peak 28542 weight 0.1000E+01 volume 1.16230 ppm1 2.760 ppm2 3.774 ASSI { 28552} (( segid "PROT" and resid 118 and name HG1 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 28552 weight 0.1000E+01 volume 4.72330 ppm1 2.506 ppm2 4.269 ASSI { 28562} (( segid "PROT" and resid 118 and name HG2 )) (( segid "PROT" and resid 115 and name HA )) 6 6 0 peak 28562 weight 0.1000E+01 volume 3.15010 ppm1 2.409 ppm2 4.263 ASSI { 28572} (( segid "PROT" and resid 84 and name HB2 )) (( segid "PROT" and resid 81 and name HA )) 6 6 0 peak 28572 weight 0.1000E+01 volume 3.99160 ppm1 1.239 ppm2 2.479 ASSI { 28582} (( segid "PROT" and resid 64 and name HG1 )) (( segid "PROT" and resid 61 and name HA )) 6 6 0 peak 28582 weight 0.1000E+01 volume 1.15830 ppm1 1.675 ppm2 3.882 ASSI { 28592} (( segid "PROT" and resid 75 and name HA )) (( segid "PROT" and resid 78 and name HA )) 6 6 0 peak 28592 weight 0.1000E+01 volume 2.45550 ppm1 4.205 ppm2 3.063 ASSI { 28602} (( segid "PROT" and resid 94 and name HE1 )) (( segid "PROT" and resid 95 and name HB )) 6 6 0 peak 28602 weight 0.1000E+01 volume 1.09790 ppm1 2.924 ppm2 4.439
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