Content for NMR-STAR saveframe, "spectral_peak_list_1"
save_spectral_peak_list_1
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_1
_Spectral_peak_list.Entry_ID 51027
_Spectral_peak_list.ID 1
_Spectral_peak_list.Name .
_Spectral_peak_list.Sample_ID 1
_Spectral_peak_list.Sample_label $sample_1
_Spectral_peak_list.Sample_condition_list_ID 1
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_1
_Spectral_peak_list.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 2
_Spectral_peak_list.Experiment_name '3D HNCA'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 3
_Spectral_peak_list.Chemical_shift_list .
_Spectral_peak_list.Assigned_chem_shift_list_ID .
_Spectral_peak_list.Assigned_chem_shift_list_label .
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
_nef_spectrum_dimension.dimension_id
_nef_spectrum_dimension.axis_unit
_nef_spectrum_dimension.axis_code
_nef_spectrum_dimension.spectrometer_frequency
_nef_spectrum_dimension.spectral_width
_nef_spectrum_dimension.value_first_point
_nef_spectrum_dimension.folding
_nef_spectrum_dimension.absolute_peak_positions
_nef_spectrum_dimension.is_acquisition
1 ppm 1H 899.7540283 7.262375446 12.75216746 circular true true
2 ppm 13C 226.2539978 30.06674471 71.05737062 circular true false
3 ppm 15N 91.18199921 33.23356589 133.4907835 circular true false
_nef_peak.index
_nef_peak.peak_id
_nef_peak.volume
_nef_peak.volume_uncertainty
_nef_peak.height
_nef_peak.height_uncertainty
_nef_peak.position_1
_nef_peak.position_uncertainty_1
_nef_peak.position_2
_nef_peak.position_uncertainty_2
_nef_peak.position_3
_nef_peak.position_uncertainty_3
_nef_peak.chain_code_1
_nef_peak.sequence_code_1
_nef_peak.residue_name_1
_nef_peak.atom_name_1
_nef_peak.chain_code_2
_nef_peak.sequence_code_2
_nef_peak.residue_name_2
_nef_peak.atom_name_2
_nef_peak.chain_code_3
_nef_peak.sequence_code_3
_nef_peak.residue_name_3
_nef_peak.atom_name_3
201 267 16383352.58 . 1096186.375 . 8.183928674 . 61.49263581 . 116.443684 . A 4 TYR H A 4 TYR CA A 4 TYR N
339 450 4787912.43 . 301707.0312 . 7.804169812 . 61.67273138 . 120.4618202 . A 5 ILE H A 4 TYR CA A 5 ILE N
143 193 6623099.105 . 390213 . 7.802946069 . 64.51168299 . 120.4618202 . A 5 ILE H A 5 ILE CA A 5 ILE N
71 97 19366523.5 . 1245412 . 7.00283978 . 61.17992761 . 119.101468 . A 6 TYR H A 6 TYR CA A 6 TYR N
211 279 9780905.141 . 933426.875 . 7.010671858 . 64.49171604 . 118.9908587 . A 6 TYR H A 5 ILE CA A 6 TYR N
338 449 5728856.941 . 348876.4062 . 7.765650758 . 61.22074668 . 119.8902262 . A 7 LEU H A 6 TYR CA A 7 LEU N
267 346 18711803.75 . 1203408.5 . 7.76536602 . 57.65635666 . 119.8902262 . A 7 LEU H A 7 LEU CA A 7 LEU N
44 62 23500409.27 . 1694328.375 . 8.675150658 . 47.41279972 . 106.4001114 . A 8 GLY H A 8 GLY CA A 8 GLY N
187 248 8113327.555 . 623944.3125 . 8.672738796 . 57.68939832 . 106.33251 . A 8 GLY H A 7 LEU CA A 8 GLY N
315 416 43534572.26 . 1730373.875 . 8.773976617 . 47.36946396 . 109.4148107 . A 9 GLY H A 8 GLY CA A 9 GLY N
316 417 56843418.47 . 3200254.5 . 8.772839501 . 47.72946258 . 109.4148107 . A 9 GLY H A 9 GLY CA A 9 GLY N
166 223 11906138.16 . 816919.0625 . 8.911889903 . 47.73440624 . 124.5854121 . A 10 ALA H A 9 GLY CA A 10 ALA N
19 28 24968464.23 . 1736128.5 . 8.908319742 . 55.48797886 . 124.5854121 . A 10 ALA H A 10 ALA CA A 10 ALA N
145 195 8472415.703 . 421435.6562 . 8.456968971 . 47.24793162 . 108.4849956 . A 17 GLY H A 17 GLY CA A 17 GLY N
195 258 32451956.8 . 2223791.75 . 8.205739957 . 59.39575224 . 121.6035342 . A 21 MET H A 21 MET CA A 21 MET N
381 505 13960284.73 . 841408.1875 . 8.207483812 . 57.95227883 . 121.5542031 . A 21 MET H A 20 LEU CA A 21 MET N
11 17 17674301.41 . 1264172.875 . 7.646698193 . 59.75654472 . 124.8811863 . A 22 LYS H A 22 LYS CA A 22 LYS N
377 501 17372522.51 . 1297927.375 . 7.466483576 . 59.90849738 . 118.782654 . A 23 PHE H A 23 PHE CA A 23 PHE N
376 500 17372522.51 . 1297927.375 . 7.468528466 . 59.97799963 . 118.7692824 . A 23 PHE H A 23 PHE CA A 23 PHE N
299 391 7663940.992 . 494743.125 . 7.97988089 . 60.01136014 . 113.8166825 . A 24 SER H A 23 PHE CA A 24 SER N
41 59 16696372.48 . 1348734.875 . 7.972997676 . 60.69844822 . 113.8114592 . A 24 SER H A 24 SER CA A 24 SER N
172 231 8674855.766 . 681744.6875 . 7.703588641 . 60.65390508 . 121.0848952 . A 25 GLU H . . . A 25 GLU N
23 32 26211765.16 . 2062221.875 . 7.702403965 . 56.17076434 . 121.0761579 . A 25 GLU H A 25 GLU CA A 25 GLU N
374 496 12949803.44 . 910546.375 . 9.381588366 . 46.23702431 . 112.0673392 . A 26 GLY H A 26 GLY CA A 26 GLY N
375 497 5244600.909 . 462158.6562 . 9.38414552 . 56.04614568 . 112.0528712 . A 26 GLY H A 25 GLU CA A 26 GLY N
20 29 19140903.35 . 1456684.625 . 7.936908316 . 59.80936729 . 113.5745734 . A 27 PHE H A 27 PHE CA A 27 PHE N
170 228 7629099.672 . 562206.3125 . 7.941243268 . 46.35462338 . 113.5709813 . A 27 PHE H A 26 GLY CA A 27 PHE N
235 307 5999568.438 . 341297.375 . 7.531838168 . 59.77228335 . 102.3175554 . A 28 THR H A 27 PHE CA A 28 THR N
234 306 19027939.06 . 1308881.125 . 7.535562941 . 62.2116494 . 102.4436945 . A 28 THR H A 28 THR CA A 28 THR N
57 79 14553578.28 . 1094589.5 . 7.388285616 . 54.28734199 . 119.8117597 . A 29 ARG H A 29 ARG CA A 29 ARG N
326 432 2876805.465 . 197248.25 . 7.389572059 . 62.17277188 . 119.7879094 . A 29 ARG H A 28 THR CA A 29 ARG N
313 414 23519298.25 . 1715842.25 . 9.078592009 . 54.28924072 . 131.2207075 . A 30 LEU H . . . A 30 LEU N
314 415 28942165.89 . 2031867.375 . 9.078592009 . 60.18895921 . 131.2207075 . A 30 LEU H A 30 LEU CA A 30 LEU N
65 88 39868499.41 . 3351930.25 . 9.331903761 . 61.92215203 . 119.1840229 . A 31 TRP H A 31 TRP CA A 31 TRP N
204 271 11662209.95 . 883821.75 . 9.330374366 . 60.1722922 . 119.2214147 . A 31 TRP H A 30 LEU CA A 31 TRP N
3 5 19472553.36 . 1443332.25 . 7.409149439 . 64.03622242 . 115.9192295 . A 33 SER H A 33 SER CA A 33 SER N
137 184 7781367.199 . 543573.875 . 7.410801933 . 65.60430926 . 115.9206583 . A 33 SER H A 32 PRO CA A 33 SER N
323 428 71311860.31 . 4838684 . 8.386022478 . 66.8314497 . 122.0812795 . A 34 VAL H A 34 VAL CA A 34 VAL N
324 429 22111351.5 . 1325138.875 . 8.387730906 . 64.02849917 . 122.0812795 . A 34 VAL H A 33 SER CA A 34 VAL N
254 331 12054470.19 . 715546.5625 . 8.807167301 . 66.79933152 . 105.0266758 . A 35 GLY H A 34 VAL CA A 35 GLY N
253 330 40363570 . 2664587 . 8.804076729 . 48.01841673 . 105.0266758 . A 35 GLY H A 35 GLY CA A 35 GLY N
384 508 13734743.89 . 935012.75 . 8.228113592 . 68.72058702 . 121.0031173 . A 36 THR H A 36 THR CA A 36 THR N
385 509 12483459.22 . 893758.25 . 8.230948334 . 48.00380294 . 121.0256257 . A 36 THR H A 35 GLY CA A 36 THR N
383 507 19785194.47 . 1296435.75 . 7.474667191 . 68.75573736 . 119.3847482 . A 37 ILE H A 36 THR CA A 37 ILE N
382 506 108528070.5 . 7890398.5 . 7.478305086 . 65.46754208 . 119.3847482 . A 37 ILE H A 37 ILE CA A 37 ILE N
348 460 18180385.73 . 950525.4375 . 8.294627705 . 65.4816321 . 118.7285956 . A 38 ILE H . . . A 38 ILE N
140 190 20144547.53 . 1360619.875 . 8.294043138 . 65.6732122 . 118.7254016 . A 38 ILE H A 38 ILE CA A 38 ILE N
60 82 21433675.88 . 1437741.125 . 8.188625515 . 65.54458903 . 116.464521 . A 39 CYS H A 39 CYS CA A 39 CYS N
346 458 21491885.31 . 1471447.875 . 8.517626105 . 60.00281958 . 119.0880522 . A 40 TYR H A 40 TYR CA A 40 TYR N
347 459 13367169.36 . 858449.9375 . 8.518765057 . 65.47704273 . 119.0880522 . A 40 TYR H A 39 CYS CA A 40 TYR N
292 383 9042838.77 . 570982.8125 . 8.479531061 . 60.01795484 . 117.8687197 . A 41 CYS H A 40 TYR CA A 41 CYS N
291 382 14924809.94 . 1081776.625 . 8.480996187 . 65.24582559 . 117.8639491 . A 41 CYS H A 41 CYS CA A 41 CYS N
220 289 17125058.73 . 973493.375 . 8.333549689 . 55.2309021 . 119.599481 . A 42 ALA H A 42 ALA CA A 42 ALA N
248 324 11252032.73 . 948180.375 . 8.337430486 . 65.2107784 . 119.7855976 . A 42 ALA H A 41 CYS CA A 42 ALA N
345 456 4838313.688 . 390055.4688 . 8.539422191 . 55.32623373 . 112.3717894 . A 43 SER H A 42 ALA CA A 43 SER N
49 68 8302284.832 . 705147.75 . 8.54680906 . 62.57093665 . 112.394075 . A 43 SER H A 43 SER CA A 43 SER N
84 114 16320200.42 . 1078111.625 . 7.395920222 . 56.85246321 . 114.5511396 . A 49 GLN H A 49 GLN CA A 49 GLN N
228 298 9821458.656 . 655297.5625 . 7.397562791 . 54.91948146 . 114.6009502 . A 49 GLN H . . . A 49 GLN N
62 84 7491115.312 . 607677.5625 . 7.268321428 . 56.09653839 . 119.9372226 . A 51 LEU H A 51 LEU CA A 51 LEU N
42 60 9497812.531 . 769438.625 . 7.080005621 . 53.12633284 . 118.9429417 . A 52 ALA H A 52 ALA CA A 52 ALA N
305 401 4943821.332 . 371208.375 . 7.086240876 . 56.02561843 . 118.9778846 . A 52 ALA H . . . A 52 ALA N
153 209 8048967.305 . 579718.4375 . 7.682206159 . 58.37152223 . 113.7111268 . A 53 TYR H A 53 TYR CA A 53 TYR N
82 112 12257640.56 . 927454.625 . 8.212461772 . 66.1220959 . 118.204819 . A 56 THR H A 56 THR CA A 56 THR N
227 297 9445368.562 . 573494.25 . 8.210506772 . 62.97607514 . 118.2139856 . A 56 THR H A 55 PRO CA A 56 THR N
115 159 15830491.85 . 1260425.625 . 8.738701447 . 47.61342523 . 107.5332199 . A 57 GLY H A 57 GLY CA A 57 GLY N
332 439 5202104.773 . 327193.75 . 8.732889328 . 66.14844956 . 107.5532136 . A 57 GLY H A 56 THR CA A 57 GLY N
40 57 12226306.58 . 899305.1875 . 6.859136295 . 64.63762121 . 119.4687845 . A 58 ILE H A 58 ILE CA A 58 ILE N
331 437 5310883.352 . 491875.4688 . 6.848170727 . 47.56349018 . 119.4353153 . A 58 ILE H . . . A 58 ILE N
7 13 15745001.64 . 1006833.688 . 7.933453665 . 55.80884792 . 121.1948928 . A 59 ALA H B 59 ALA CA A 59 ALA N
325 430 4927430.059 . 314740.5312 . 7.920261369 . 64.59886046 . 121.1907035 . A 59 ALA H A 58 ILE CA A 59 ALA N
295 387 4097750.73 . 300445.1562 . 8.75183158 . 55.67488163 . 114.9459802 . A 60 TYR H B 59 ALA CA A 60 TYR N
63 86 7825510.822 . 571459.875 . 8.750568823 . 61.24821564 . 114.9410278 . A 60 TYR H A 60 TYR CA A 60 TYR N
135 182 7294083.508 . 555504 . 8.269642652 . 65.21908476 . 108.4690322 . A 65 GLY H A 64 SER CA A 65 GLY N
1 2 29278648.39 . 2045416.125 . 8.275925438 . 48.07189575 . 108.4210049 . A 65 GLY H A 65 GLY CA A 65 GLY N
366 484 5823466.094 . 456266.8125 . 8.907587765 . 48.10573512 . 119.9905896 . A 66 VAL H A 65 GLY CA A 66 VAL N
104 139 12970354.7 . 937812.75 . 8.911400794 . 66.20197756 . 119.9906057 . A 66 VAL H A 66 VAL CA A 66 VAL N
14 23 8360497.219 . 613567.6875 . 7.23644492 . 47.56777759 . 106.7649632 . A 67 GLY H A 67 GLY CA A 67 GLY N
307 403 4315121.07 . 285101.8125 . 7.240200669 . 66.19006314 . 106.6878773 . A 67 GLY H A 66 VAL CA A 67 GLY N
94 129 15382364.41 . 1005703 . 8.280246394 . 65.95526579 . 120.0326025 . A 68 ILE H A 68 ILE CA A 68 ILE N
386 510 8653546.344 . 743303.1875 . 8.275548494 . 47.59927085 . 120.0238519 . A 68 ILE H A 67 GLY CA A 68 ILE N
379 503 15543377.51 . 1144263.375 . 7.407443031 . 66.94931286 . 119.5154862 . A 69 VAL H A 69 VAL CA A 69 VAL N
380 504 5617263.305 . 328614.3438 . 7.411586911 . 65.91556003 . 119.5200982 . A 69 VAL H A 68 ILE CA A 69 VAL N
92 127 6389677.523 . 354426.7188 . 8.195056716 . 62.86083675 . 115.1999371 . A 75 SER H A 75 SER CA A 75 SER N
336 447 4098113.952 . 262553.9062 . 7.706671493 . 62.81028581 . 124.7166122 . A 76 TRP H A 75 SER CA A 76 TRP N
15 24 22977368.47 . 1608540.5 . 7.711150712 . 59.34471534 . 124.7152173 . A 76 TRP H A 76 TRP CA A 76 TRP N
52 71 6963113.456 . 545785.875 . 8.179803197 . 47.16687034 . 103.7750341 . A 77 GLY H A 77 GLY CA A 77 GLY N
310 409 6367403.008 . 392111.5938 . 8.185862421 . 59.2955623 . 103.7915394 . A 77 GLY H A 76 TRP CA A 77 GLY N
354 467 5064869.012 . 328973.9375 . 8.4570136 . 47.34922508 . 114.5601183 . A 78 PHE H . . . A 78 PHE N
353 466 5598487.551 . 413729.25 . 8.464612395 . 58.77028218 . 114.5859482 . A 78 PHE H A 78 PHE CA A 78 PHE N
351 463 4862542.762 . 406318.4375 . 6.818220387 . 55.59182682 . 112.2056832 . A 79 PHE H A 79 PHE CA A 79 PHE N
352 464 3219645.883 . 121427.5781 . 6.799724676 . 58.8333165 . 112.1896026 . A 79 PHE H A 78 PHE CA A 79 PHE N
90 125 28321128.03 . 2378969.25 . 7.441744822 . 46.63390933 . 108.8442468 . A 80 GLY H A 80 GLY CA A 80 GLY N
301 394 6291924.961 . 345057.3125 . 7.426287043 . 55.48075878 . 108.9170568 . A 80 GLY H A 79 PHE CA A 80 GLY N
34 50 10642751.25 . 821971.25 . 7.679242584 . 55.40669227 . 119.4065474 . A 81 GLN H A 81 GLN CA A 81 GLN N
181 241 5625278.67 . 417347.6562 . 7.676951257 . 46.51883135 . 119.4385389 . A 81 GLN H A 80 GLY CA A 81 GLN N
67 91 29394302.12 . 2225058.5 . 7.755497692 . 55.56030847 . 125.726803 . A 82 ARG H A 82 ARG CA A 82 ARG N
150 202 10821949.98 . 717264.875 . 6.500527803 . 55.56044458 . 122.7569679 . A 83 LEU H A 82 ARG CA A 83 LEU N
10 16 18219107.2 . 1406988.5 . 6.502702118 . 53.01025272 . 122.7707811 . A 83 LEU H A 83 LEU CA A 83 LEU N
281 368 24430863.84 . 1861105.375 . 7.484555879 . 51.30533922 . 119.0543063 . A 84 ASP H A 84 ASP CA A 84 ASP N
282 369 8603232.328 . 530162.3125 . 7.488170529 . 53.04037114 . 119.0543063 . A 84 ASP H A 83 LEU CA A 84 ASP N
285 372 65182945.75 . 4621620.5 . 8.72210765 . 51.32533685 . 118.4731111 . A 85 LEU H A 84 ASP CA A 85 LEU N
101 136 93224403.5 . 7187129.5 . 8.724718353 . 59.5179417 . 118.4731111 . A 85 LEU H A 85 LEU CA A 85 LEU N
183 243 18481782.28 . 1346466.5 . 7.528474698 . 66.38652145 . 117.3731661 . A 87 ALA H A 86 PRO CA A 87 ALA N
38 54 48623356.12 . 3855936 . 7.52870464 . 55.55181415 . 117.3930933 . A 87 ALA H A 87 ALA CA A 87 ALA N
76 104 5629752.965 . 417186.6562 . 8.300460966 . 55.5233451 . 118.3361235 . A 88 ILE H A 87 ALA CA A 88 ILE N
219 288 21095806.81 . 1440745.75 . 8.299001296 . 65.59551231 . 118.3559877 . A 88 ILE H A 88 ILE CA A 88 ILE N
371 491 19621900.13 . 1582677.5 . 8.715174276 . 64.59551504 . 119.2164311 . A 89 ILE H A 89 ILE CA A 89 ILE N
372 492 5930032.797 . 387072.4375 . 8.716840431 . 65.53675163 . 119.2064838 . A 89 ILE H . . . A 89 ILE N
320 424 15161553.13 . 1181891.375 . 8.828333843 . 64.50843282 . 107.2507329 . A 90 GLY H A 89 ILE CA A 90 GLY N
319 423 44169984.88 . 3609238.25 . 8.830611747 . 47.79146243 . 107.2507329 . A 90 GLY H A 90 GLY CA A 90 GLY N
163 220 8948302.234 . 721728.4375 . 8.668745449 . 59.51027659 . 120.7268359 . A 91 MET H A 91 MET CA A 91 MET N
164 221 5363659.247 . 367731.0938 . 8.656323118 . 47.7620137 . 120.7467235 . A 91 MET H A 90 GLY CA A 91 MET N
349 461 6368552.715 . 578207.9375 . 8.553336659 . 59.34789733 . 120.0346764 . A 92 MET H A 92 MET CA A 92 MET N
350 462 8579124.375 . 468380.25 . 8.551058754 . 59.60985633 . 120.0346764 . A 92 MET H A 91 MET CA A 92 MET N
157 213 14883427.84 . 795134 . 7.34663256 . 56.56252923 . 114.2132255 . A 102 ASN H A 102 ASN CA A 102 ASN N
333 441 6284532.877 . 322850.5625 . 7.344105578 . 65.7170714 . 114.2226736 . A 102 ASN H . . . A 102 ASN N
264 342 19230045.88 . 1385863.25 . 8.343796244 . 56.48839483 . 115.0335299 . A 103 LEU H A 103 LEU CA A 103 LEU N
334 442 17375102.53 . 868037.875 . 8.34378624 . 56.59952357 . 115.0507158 . A 103 LEU H A 102 ASN CA A 103 LEU N
93 128 25405079.56 . 1630154.375 . 7.709865615 . 54.70525783 . 114.3425001 . A 104 LEU H A 104 LEU CA A 104 LEU N
232 304 9623016.42 . 799094.6875 . 7.712851751 . 56.48746315 . 114.3353708 . A 104 LEU H A 103 LEU CA A 104 LEU N
189 250 8509840.297 . 583055.375 . 7.110678877 . 54.67615609 . 112.7198074 . A 105 SER H A 104 LEU CA A 105 SER N
48 67 27883105.09 . 2130790 . 7.110967539 . 57.95972251 . 112.779677 . A 105 SER H A 105 SER CA A 105 SER N
30 40 29803296.95 . 2350195.5 . 9.237192465 . 55.58797585 . 127.0522494 . A 106 ARG H A 106 ARG CA A 106 ARG N
177 237 16300964.33 . 1200591.625 . 9.235673769 . 57.93688995 . 127.0520038 . A 106 ARG H A 105 SER CA A 106 ARG N
79 108 86537618 . 6791448.5 . 8.369870242 . 58.60972836 . 117.1644858 . A 107 SER H A 107 SER CA A 107 SER N
222 291 28629748.75 . 2299528 . 8.370227616 . 55.55018123 . 117.1785114 . A 107 SER H A 106 ARG CA A 107 SER N
13 22 98436257.5 . 6811121 . 7.825217298 . 59.45104655 . 117.2869638 . A 108 THR H A 108 THR CA A 108 THR N
152 207 29731027.06 . 2132157.5 . 7.829113682 . 58.59856729 . 117.2877494 . A 108 THR H A 107 SER CA A 108 THR N
131 178 273271035 . 20465982 . 7.908454896 . 56.82502229 . 123.5544405 . A 110 HIS H A 110 HIS CA A 110 HIS N
257 335 137992051.5 . 10948849 . 7.908476266 . 63.31014572 . 123.5590694 . A 110 HIS H A 109 PRO CA A 110 HIS N
75 103 84338106.25 . 5998207 . 8.397813274 . 51.26459835 . 122.6807628 . B 2 ASN H . . . B 2 ASN N
218 287 54751850.38 . 4453981 . 8.398641513 . 55.07342609 . 122.6890951 . B 2 ASN H . . . B 2 ASN N
27 36 21090662.11 . 1481724.5 . 8.385893802 . 61.93918159 . 116.5728988 . B 4 TYR H B 4 TYR CA B 4 TYR N
176 236 9545300.641 . 759759.3125 . 8.386592136 . 64.50185939 . 116.5565248 . B 4 TYR H B 3 PRO CA B 4 TYR N
317 419 5501517.246 . 289627.6875 . 7.793208663 . 62.15728627 . 121.2403021 . B 5 ILE H B 4 TYR CA B 5 ILE N
12 21 9164324.379 . 722465.4375 . 7.792677848 . 64.5329402 . 121.2258331 . B 5 ILE H B 5 ILE CA B 5 ILE N
182 242 17829241.91 . 1157322.5 . 6.898831845 . 61.60409057 . 118.9648626 . B 6 TYR H B 6 TYR CA B 6 TYR N
37 53 8979878.383 . 815741.6875 . 6.899403337 . 64.49950243 . 118.9718246 . B 6 TYR H B 5 ILE CA B 6 TYR N
252 329 9876291.016 . 663534.625 . 7.986385076 . 61.64866195 . 119.955966 . B 7 LEU H B 6 TYR CA B 7 LEU N
121 165 23199363.84 . 1605117 . 7.988466357 . 57.72889633 . 120.0479199 . B 7 LEU H B 7 LEU CA B 7 LEU N
210 278 10324097.31 . 783913 . 8.746686209 . 57.69019797 . 106.4934168 . B 8 GLY H B 7 LEU CA B 8 GLY N
70 96 26883724.39 . 2266785.75 . 8.749832092 . 47.3984823 . 106.4742428 . B 8 GLY H B 8 GLY CA B 8 GLY N
45 64 92844977.56 . 6320542 . 8.749179983 . 47.6655076 . 109.403833 . B 9 GLY H B 9 GLY CA B 9 GLY N
6 11 20847261.39 . 1569532.875 . 8.867504511 . 55.52232119 . 124.8410418 . B 10 ALA H B 10 ALA C@10717 B 10 ALA N
147 199 8283183.805 . 437776.6562 . 8.863747339 . 47.71110381 . 124.8617311 . B 10 ALA H B 9 GLY CA B 10 ALA N
39 56 11223877.36 . 953459.6875 . 8.528823617 . 65.38888826 . 122.9053295 . B 11 ILE H B 11 ILE C@10716 B 11 ILE N
335 446 3667946.484 . 214989.375 . 8.524078606 . 55.52611712 . 122.8382823 . B 11 ILE H . . . B 11 ILE N
229 299 40074851.78 . 2760059 . 8.328340404 . 58.17139614 . 120.1894846 . B 12 LEU H B 12 LEU C@10715 B 12 LEU N
276 361 12330829 . 688429.9375 . 8.32963056 . 65.34265525 . 120.1894846 . B 12 LEU H . . . B 12 LEU N
251 328 17228003.75 . 1167773.125 . 8.486294533 . 58.08781062 . 119.0884198 . B 13 ALA H . . . B 13 ALA N
120 164 34409228.97 . 2414126.25 . 8.484975501 . 64.07854692 . 119.097338 . B 13 ALA H . . . B 13 ALA N
169 227 9570630.641 . 727501.1875 . 8.609966704 . 64.82304992 . 122.2877832 . B 16 ILE H B 16 ILE CA B 16 ILE N
274 358 7027537.016 . 391798.5 . 8.619623616 . 65.38330817 . 122.3173984 . B 16 ILE H . . . B 16 ILE N
302 395 6627757.438 . 393417.0938 . 8.505514226 . 64.84141469 . 108.5191847 . B 17 GLY H B 16 ILE CA B 17 GLY N
56 75 25753627.56 . 1814000.375 . 8.507805011 . 47.82829342 . 108.5699723 . B 17 GLY H B 17 GLY CA B 17 GLY N
239 313 35193658.62 . 2190477.5 . 8.312750383 . 58.1699476 . 120.8411411 . B 20 LEU H B 20 LEU CA B 20 LEU N
212 280 38366537.19 . 2677710.25 . 8.258800784 . 59.34499808 . 121.2697064 . B 21 MET H B 21 MET CA B 21 MET N
378 502 13839360.34 . 779364.625 . 8.257802129 . 58.15231177 . 121.2697064 . B 21 MET H B 20 LEU CA B 21 MET N
213 281 12148455.14 . 836705.1875 . 8.262913609 . 54.16283805 . 121.2697064 . B 21 MET H . . . B 21 MET N
273 357 16607507.56 . 710007.4375 . 7.754773769 . 59.34613923 . 122.3642413 . B 22 LYS H B 21 MET CA B 22 LYS N
16 25 27192680.78 . 1784181 . 7.754649184 . 58.86270413 . 122.3826366 . B 22 LYS H B 22 LYS CA B 22 LYS N
249 326 5866231.25 . 365527.5625 . 7.636108855 . 62.09811756 . 117.8878368 . B 23 PHE H . . . B 23 PHE N
116 160 33966127.25 . 2494192.75 . 7.633167033 . 58.88729552 . 117.8813194 . B 23 PHE H B 23 PHE CA B 23 PHE N
132 179 28148075.75 . 1917194.375 . 7.914076973 . 60.3979694 . 115.0135149 . B 24 SER H B 24 SER CA B 24 SER N
258 336 9321326.547 . 504240.9688 . 7.918231845 . 58.78183149 . 114.9669246 . B 24 SER H B 23 PHE CA B 24 SER N
32 47 32413547.88 . 2039388.75 . 8.14353876 . 56.05163872 . 122.1672405 . B 25 GLU H B 25 GLU CA B 25 GLU N
179 239 7384419.471 . 523160.25 . 8.146811296 . 60.31140028 . 122.1552672 . B 25 GLU H B 24 SER CA B 25 GLU N
244 319 6630456.137 . 395379.2812 . 9.146627774 . 56.16411305 . 112.9685106 . B 26 GLY H B 25 GLU CA B 26 GLY N
111 150 17465429.97 . 1342825.625 . 9.141036429 . 47.12648656 . 112.9573343 . B 26 GLY H B 26 GLY CA B 26 GLY N
298 390 6704488.466 . 553082.0625 . 7.935952402 . 47.10291566 . 114.0718062 . B 27 PHE H B 26 GLY CA B 27 PHE N
53 72 20534804.95 . 1332680.25 . 7.944205433 . 59.18531919 . 114.0757553 . B 27 PHE H B 27 PHE CA B 27 PHE N
236 308 5655134.766 . 314346.25 . 7.565492447 . 59.50470476 . 102.4506572 . B 28 THR H B 27 PHE CA B 28 THR N
95 130 20414451.42 . 1399332.875 . 7.563734088 . 62.27575489 . 102.4096069 . B 28 THR H B 28 THR CA B 28 THR N
158 214 3459117.59 . 306184.9375 . 7.545909792 . 62.2118374 . 120.7495615 . B 29 ARG H B 28 THR CA B 29 ARG N
17 26 18434551.45 . 1376368.875 . 7.548541863 . 54.43897256 . 120.7560461 . B 29 ARG H B 29 ARG CA B 29 ARG N
311 411 22641134.19 . 1722233.375 . 8.935197435 . 54.40363407 . 130.8655265 . B 30 LEU H B 29 ARG CA B 30 LEU N
312 413 24517595.28 . 1883133 . 8.936388779 . 60.02064142 . 130.8655265 . B 30 LEU H B 30 LEU CA B 30 LEU N
202 268 11979246.28 . 796051.75 . 9.204908106 . 59.9323697 . 118.6160101 . B 31 TRP H B 30 LEU CA B 31 TRP N
61 83 37951938.12 . 2984664.5 . 9.205901741 . 61.94028458 . 118.6593365 . B 31 TRP H B 31 TRP CA B 31 TRP N
58 80 20467826.09 . 1467026.625 . 7.278145333 . 63.77988207 . 115.5513436 . B 33 SER H B 33 SER CA B 33 SER N
199 265 7461696.904 . 608807.5625 . 7.272120194 . 65.56397588 . 115.5292628 . B 33 SER H B 32 PRO CA B 33 SER N
188 249 26054897.59 . 1618975 . 8.399543346 . 63.84477304 . 121.8876635 . B 34 VAL H B 33 SER CA B 34 VAL N
46 65 88835022.12 . 6331152.5 . 8.401290621 . 66.71451269 . 121.9244217 . B 34 VAL H B 34 VAL CA B 34 VAL N
215 283 13720756.82 . 879098.6875 . 8.80807401 . 66.81649314 . 105.4500043 . B 35 GLY H B 34 VAL CA B 35 GLY N
72 99 51342081.88 . 3822820.75 . 8.804699262 . 48.02128725 . 105.2260956 . B 35 GLY H B 35 GLY CA B 35 GLY N
214 282 46900123.25 . 3276504.75 . 8.80807401 . 48.05156768 . 105.4500043 . B 35 GLY H B 35 GLY CA B 35 GLY N
161 218 14381379.71 . 966196.875 . 8.300319453 . 68.78732942 . 121.1508103 . B 36 THR H B 36 THR CA B 36 THR N
162 219 12673172.02 . 835949.8125 . 8.30139353 . 48.00334555 . 121.1098815 . B 36 THR H B 35 GLY CA B 36 THR N
185 245 20833824.47 . 1328385.625 . 7.490821772 . 68.83133572 . 119.3847482 . B 37 ILE H B 36 THR CA B 37 ILE N
43 61 119028231.8 . 8693320 . 7.493804107 . 65.3291662 . 119.3847482 . B 37 ILE H B 37 ILE CA B 37 ILE N
4 7 21494043.36 . 1314478.5 . 8.290288058 . 65.55205849 . 116.7400114 . B 39 CYS H B 39 CYS CA B 39 CYS N
259 337 8878790.381 . 712523.125 . 8.585380638 . 65.47340532 . 119.0555156 . B 40 TYR H B 39 CYS CA B 40 TYR N
133 180 20545352.47 . 1524648.5 . 8.587305185 . 60.76581096 . 119.0408237 . B 40 TYR H B 40 TYR CA B 40 TYR N
99 134 21061147.84 . 1571918.625 . 8.605548414 . 65.25216326 . 117.9175798 . B 41 CYS H B 41 CYS CA B 41 CYS N
328 434 5058023.863 . 368244 . 8.607101218 . 60.85184309 . 117.8548194 . B 41 CYS H . . . B 41 CYS N
278 365 11252032.73 . 948180.375 . 8.370302594 . 65.25232965 . 119.9089791 . B 42 ALA H B 41 CYS CA B 42 ALA N
114 158 32132442.58 . 2390609 . 8.369614086 . 55.18111075 . 119.9717141 . B 42 ALA H B 42 ALA CA B 42 ALA N
98 133 11735533.11 . 764857.8125 . 8.469095478 . 63.05457354 . 111.9021628 . B 43 SER H B 43 SER CA B 43 SER N
300 392 6406287.348 . 425631.2812 . 8.472552879 . 55.10090537 . 111.9332597 . B 43 SER H B 42 ALA CA B 43 SER N
359 473 6416271.945 . 511130.9375 . 8.299020818 . 63.07843255 . 115.903507 . B 44 PHE H B 43 SER CA B 44 PHE N
96 131 9673926.768 . 759310.3125 . 8.311511639 . 60.95833177 . 115.9311159 . B 44 PHE H B 44 PHE CA B 44 PHE N
178 238 4845107.439 . 387622.3438 . 8.607438386 . 57.52676841 . 120.9863978 . B 47 LEU H B 47 LEU CA B 47 LEU N
216 284 5795696.623 . 524560.125 . 8.743359092 . 57.42080921 . 121.4006265 . B 48 ALA H B 47 LEU CA B 48 ALA N
73 100 25602406.7 . 1959100.5 . 8.746009885 . 55.0556032 . 121.3938286 . B 48 ALA H B 48 ALA CA B 48 ALA N
217 285 13060650.97 . 862891.25 . 7.337052479 . 55.06278931 . 114.7765338 . B 49 GLN H B 48 ALA CA B 49 GLN N
74 101 24021431.31 . 1512949.5 . 7.332873623 . 56.34402651 . 114.8049116 . B 49 GLN H B 49 GLN CA B 49 GLN N
21 30 7481556.266 . 465062.9375 . 7.465493776 . 64.4886742 . 107.1822912 . B 50 THR H B 50 THR CA B 50 THR N
141 191 7658622.09 . 601571.5 . 6.873538838 . 55.83015159 . 117.9689179 . B 51 LEU H B 51 LEU CA B 51 LEU N
28 37 12039676.94 . 990097.9375 . 7.058225816 . 52.97299243 . 120.0548309 . B 52 ALA H B 52 ALA CA B 52 ALA N
398 526 2270532.887 . 242277.0781 . 7.063062762 . 55.85811577 . 119.9983649 . B 52 ALA H B 51 LEU CA B 52 ALA N
330 436 5524407.348 . 487199.2812 . 7.509536953 . 52.98673727 . 113.1658727 . B 53 TYR H B 52 ALA CA B 53 TYR N
91 126 9686293.414 . 711009.1875 . 7.508636585 . 58.14683411 . 113.0891042 . B 53 TYR H B 53 TYR CA B 53 TYR N
180 240 5356572.344 . 451101.8125 . 9.137361235 . 63.50568664 . 124.6353275 . B 56 THR H . . . B 56 THR N
33 48 4538058.971 . 389600.125 . 9.15352444 . 67.25529037 . 124.6901966 . B 56 THR H . . . B 56 THR N
318 422 6581939.803 . 410023.75 . 10.06549337 . 46.91759425 . 107.1487898 . B 57 GLY H B 57 GLY CA B 57 GLY N
306 402 5287108.531 . 315851 . 6.526695952 . 46.86141598 . 118.4079499 . B 58 ILE H B 57 GLY CA B 58 ILE N
117 161 8899040.758 . 663567.125 . 6.517946462 . 63.96144971 . 118.3970235 . B 58 ILE H B 58 ILE CA B 58 ILE N
396 522 4447681.781 . 285565.6562 . 8.622179841 . 55.55597589 . 115.8783811 . B 60 TYR H B 59 ALA CA B 60 TYR N
66 89 7951117.624 . 643123.8125 . 8.595096117 . 62.79039936 . 115.9998 . B 60 TYR H B 60 TYR CA B 60 TYR N
303 398 9945468.482 . 591349.3125 . 8.755172871 . 47.06886614 . 107.6708354 . B 65 GLY H B 65 GLY CA B 65 GLY N
304 399 6400129.363 . 456153 . 8.94723798 . 46.97495214 . 120.2715296 . B 66 VAL H B 65 GLY CA B 66 VAL N
51 70 14469062.76 . 904553.1875 . 8.937375094 . 66.38062273 . 120.2715296 . B 66 VAL H B 66 VAL CA B 66 VAL N
47 66 8307959.154 . 661630.8125 . 7.092411208 . 47.60880169 . 106.0463479 . B 67 GLY H B 67 GLY CA B 67 GLY N
308 406 4578653.027 . 365783.5625 . 7.094266519 . 66.50445559 . 105.9577006 . B 67 GLY H B 66 VAL CA B 67 GLY N
9 15 10262396.06 . 784939.8125 . 7.619040705 . 67.08140748 . 123.0895151 . B 69 VAL H B 69 VAL CA B 69 VAL N
144 194 8851527.809 . 617994.3125 . 8.208843308 . 58.11534639 . 117.4889021 . B 70 LEU H B 70 LEU CA B 70 LEU N
394 520 12794435.07 . 718127.3125 . 8.819026966 . 58.13136908 . 119.1309537 . B 71 ILE H B 70 LEU CA B 71 ILE N
399 527 14071480.34 . 650394.4375 . 8.822344493 . 64.19563246 . 119.1956048 . B 71 ILE H B 71 ILE CA B 71 ILE N
340 451 4086844.167 . 366615.1562 . 7.934178099 . 64.06467745 . 119.4162566 . B 72 SER H . . . B 72 SER N
29 39 17484375.02 . 1245976.625 . 7.9356762 . 63.14514382 . 119.4086354 . B 72 SER H B 72 SER CA B 72 SER N
369 488 20747500.53 . 1195700.125 . 8.153273875 . 58.12667587 . 121.1060019 . B 73 LEU H B 73 LEU CA B 73 LEU N
370 489 5259066.588 . 287117.75 . 8.146440162 . 63.04351088 . 121.1060019 . B 73 LEU H B 72 SER CA B 73 LEU N
368 487 29103421.03 . 2109503.75 . 8.670719925 . 58.09900793 . 120.0103457 . B 74 LEU H B 73 LEU CA B 74 LEU N
110 149 29036454.22 . 2116978.75 . 8.66997389 . 58.17922323 . 120.0477408 . B 74 LEU H B 74 LEU CA B 74 LEU N
108 147 10785197.19 . 749864.5 . 8.507000452 . 62.40995201 . 116.9049883 . B 75 SER H B 75 SER CA B 75 SER N
243 318 10188659.1 . 600279.9375 . 8.503997236 . 58.36297066 . 116.9172672 . B 75 SER H B 74 LEU CA B 75 SER N
31 46 30001959.95 . 2093335.75 . 7.793284018 . 59.22657868 . 124.4370816 . B 76 TRP H B 76 TRP CA B 76 TRP N
271 355 3453806.957 . 386738.25 . 7.798113483 . 62.57154105 . 124.3437472 . B 76 TRP H B 75 SER CA B 76 TRP N
88 123 14409513.8 . 1019930.438 . 8.675018844 . 47.00340296 . 105.3294376 . B 77 GLY H B 77 GLY CA B 77 GLY N
309 408 4072616.892 . 405127.1562 . 8.674597205 . 59.32548067 . 105.3090266 . B 77 GLY H B 76 TRP CA B 77 GLY N
81 111 11723926.84 . 799630.125 . 8.202057012 . 58.52032864 . 113.353518 . B 78 PHE H B 78 PHE CA B 78 PHE N
226 296 5846022.066 . 370725.1875 . 8.202528412 . 46.97839513 . 113.4609547 . B 78 PHE H B 77 GLY CA B 78 PHE N
119 163 13142064.04 . 922189.875 . 7.179704524 . 56.89447186 . 114.0248816 . B 79 PHE H B 79 PHE CA B 79 PHE N
322 426 5248666.398 . 305744.4062 . 7.176671706 . 58.38010955 . 114.0425757 . B 79 PHE H B 78 PHE CA B 79 PHE N
321 425 9920579.223 . 749881.625 . 7.918919147 . 56.82828723 . 108.8691034 . B 80 GLY H . . . B 80 GLY N
230 300 9920579.223 . 749881.625 . 7.916575717 . 56.83720563 . 108.8884347 . B 80 GLY H B 79 PHE CA B 80 GLY N
86 121 59227216.5 . 4892452.5 . 7.916889369 . 46.63322612 . 108.8987536 . B 80 GLY H B 80 GLY CA B 80 GLY N
196 259 54731941.16 . 3833845.25 . 7.736893931 . 55.15595389 . 120.2991814 . B 81 GLN H B 81 GLN CA B 81 GLN N
197 260 12087478.82 . 1054400.5 . 7.738274921 . 46.62543677 . 120.3182803 . B 81 GLN H B 80 GLY CA B 81 GLN N
118 162 87299910.5 . 6792374 . 8.232682246 . 56.03422088 . 123.7416724 . B 82 ARG H B 82 ARG CA B 82 ARG N
250 327 40840478.34 . 2968462 . 8.231995438 . 55.15485298 . 123.70913 . B 82 ARG H B 81 GLN CA B 82 ARG N
102 137 63328475.09 . 4554696 . 8.057797448 . 54.03501473 . 124.2771892 . B 83 LEU H B 83 LEU CA B 83 LEU N
237 311 39274705.88 . 3017670.25 . 8.057110352 . 56.025453 . 124.2807879 . B 83 LEU H B 82 ARG CA B 83 LEU N
203 270 21602853.38 . 1534535.625 . 7.465195482 . 54.03425881 . 120.4396985 . B 84 ASP H B 83 LEU CA B 84 ASP N
64 87 66800013.12 . 5379248 . 7.464823537 . 51.31854415 . 120.4873235 . B 84 ASP H B 84 ASP CA B 84 ASP N
284 371 93137685.12 . 7110214 . 8.727041482 . 59.56673846 . 118.8060297 . B 85 LEU H B 85 LEU CA B 85 LEU N
283 370 77043900.75 . 5867276 . 8.725836599 . 51.32380267 . 118.8060297 . B 85 LEU H B 84 ASP CA B 85 LEU N
136 183 19210691.73 . 1412744.625 . 7.467775842 . 66.40455976 . 117.4983272 . B 87 ALA H B 86 PRO CA B 87 ALA N
2 3 53312848.81 . 4070193.25 . 7.46878402 . 55.57489369 . 117.5752936 . B 87 ALA H B 87 ALA CA B 87 ALA N
240 314 11434240.88 . 845146.6875 . 7.910268747 . 55.55818869 . 117.9302313 . B 88 ILE H B 87 ALA CA B 88 ILE N
106 143 21167025.45 . 1511336.75 . 7.914531185 . 64.81365468 . 117.9404734 . B 88 ILE H B 88 ILE CA B 88 ILE N
154 210 26057424.17 . 1852783.125 . 8.649450651 . 64.60181535 . 119.4067043 . B 89 ILE H B 89 ILE CA B 89 ILE N
337 448 26057424.17 . 1852783.125 . 8.649022493 . 64.71799555 . 119.4067043 . B 89 ILE H B 88 ILE CA B 89 ILE N
146 197 17718429.38 . 1444875 . 8.809168139 . 64.51141873 . 107.2377075 . B 90 GLY H . . . B 90 GLY N
5 10 64610106 . 5016792 . 8.794692032 . 47.79715719 . 107.2766958 . B 90 GLY H B 90 GLY CA B 90 GLY N
224 294 16979212.22 . 1070932 . 8.548045505 . 60.0142555 . 119.598045 . B 91 MET H B 91 MET CA B 91 MET N
277 364 7019961.594 . 428986.9375 . 8.544983321 . 47.79728042 . 119.598045 . B 91 MET H B 90 GLY CA B 91 MET N
105 142 10156839.26 . 688194.6875 . 8.116366385 . 64.96140209 . 115.910007 . B 95 CYS H . . . B 95 CYS N
373 494 8236182.516 . 455836.6875 . 8.114668933 . 65.2108877 . 115.9226652 . B 95 CYS H . . . B 95 CYS N
286 373 7115041.391 . 401418.7188 . 8.401499739 . 58.40975797 . 118.8571569 . B 100 ILE H . . . B 100 ILE N
241 315 7447657.133 . 416857.625 . 8.383958486 . 66.07042275 . 118.8051465 . B 100 ILE H B 100 ILE CA B 100 ILE N
156 212 6955896.277 . 381971.0938 . 7.781771799 . 56.64195782 . 118.4145403 . B 101 ILE H . . . B 101 ILE N
289 378 7950641.246 . 647456.3125 . 7.783128251 . 65.87635322 . 118.4480341 . B 101 ILE H B 101 ILE CA B 101 ILE N
130 177 19923718.62 . 1544531.5 . 8.158420169 . 56.76068756 . 115.3012293 . B 102 ASN H B 102 ASN CA B 102 ASN N
294 386 7407569.957 . 611686.375 . 8.157521784 . 65.92193069 . 115.2904122 . B 102 ASN H B 101 ILE CA B 102 ASN N
296 388 17526537.67 . 876880.9375 . 8.445546932 . 56.65739133 . 114.5530265 . B 103 LEU H B 102 ASN CA B 103 LEU N
78 107 22903912.03 . 1497760.375 . 8.443476741 . 56.44732474 . 114.5420679 . B 103 LEU H B 103 LEU CA B 103 LEU N
129 176 20654143.59 . 1396098.375 . 7.772767531 . 54.82178355 . 114.1318554 . B 104 LEU H B 104 LEU CA B 104 LEU N
297 389 6937301.609 . 399077.9375 . 7.768373161 . 56.4419848 . 114.1465434 . B 104 LEU H B 103 LEU CA B 104 LEU N
127 173 22653845.36 . 1695380.875 . 7.509507311 . 58.2465584 . 111.7020755 . B 105 SER H B 105 SER CA B 105 SER N
256 333 7284803.297 . 538196.8125 . 7.513850359 . 54.9004668 . 111.7437595 . B 105 SER H B 104 LEU CA B 105 SER N
165 222 5934132.43 . 504591.0938 . 10.05215691 . 58.16610636 . 129.0986601 . B 106 ARG H B 105 SER CA B 106 ARG N
18 27 12220952.92 . 855473.375 . 10.05124619 . 55.08504169 . 129.1212603 . B 106 ARG H B 106 ARG CA B 106 ARG N
327 433 5178427.047 . 260842.875 . 8.49429171 . 55.11595603 . 117.6284735 . B 107 SER H B 106 ARG CA B 107 SER N
128 174 15686033.73 . 1201207.875 . 8.496916692 . 60.0545454 . 117.6100459 . B 107 SER H B 107 SER CA B 107 SER N
77 106 48878622.44 . 3721161.75 . 7.608195069 . 58.39424844 . 114.0204945 . B 108 THR H B 108 THR CA B 108 THR N
221 290 8955271.898 . 641510.625 . 7.611709716 . 60.07720717 . 114.0321856 . B 108 THR H B 107 SER CA B 108 THR N
191 252 207004498.4 . 16993538 . 7.802717433 . 63.3549387 . 123.2882539 . B 110 HIS H B 109 PRO CA B 110 HIS N
54 73 450289875.8 . 36899668 . 7.802950907 . 56.77870218 . 123.2902867 . B 110 HIS H B 110 HIS CA B 110 HIS N
;
loop_
_Spectral_dim.ID
_Spectral_dim.Axis_code
_Spectral_dim.Spectrometer_frequency
_Spectral_dim.Atom_type
_Spectral_dim.Atom_isotope_number
_Spectral_dim.Spectral_region
_Spectral_dim.Magnetization_linkage_ID
_Spectral_dim.Under_sampling_type
_Spectral_dim.Sweep_width
_Spectral_dim.Sweep_width_units
_Spectral_dim.Value_first_point
_Spectral_dim.Absolute_peak_positions
_Spectral_dim.Acquisition
_Spectral_dim.Center_frequency_offset
_Spectral_dim.Encoding_code
_Spectral_dim.Encoded_reduced_dimension_ID
_Spectral_dim.Entry_ID
_Spectral_dim.Spectral_peak_list_ID
1 . . H 1 H . . . ppm . . . . . . 51027 1
2 . . C 13 C . . . ppm . . . . . . 51027 1
3 . . N 15 N . . . ppm . . . . . . 51027 1
stop_
save_