Content for NMR-STAR saveframe, "spectral_peak_list_5"
save_spectral_peak_list_5
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_5
_Spectral_peak_list.Entry_ID 51381
_Spectral_peak_list.ID 5
_Spectral_peak_list.Name HNcoCACB_Tom22_1_74_pH6
_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 3
_Spectral_peak_list.Experiment_name '3D CBCA(CO)NH'
_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 1
_Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1
_Spectral_peak_list.Details .
_Spectral_peak_list.Text_data_format text
_Spectral_peak_list.Text_data
;
_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
_nef_peak.ccpn_figure_of_merit
_nef_peak.ccpn_linked_integral
_nef_peak.ccpn_annotation
_nef_peak.ccpn_comment
_nef_peak.ccpn_peak_list_serial
1 2 . . -46148784 . 8.030363268 . 113.4244058 . 52.51189484 . A 33 THR H A 33 THR N A 32 ALA CA 1 . . . 1
2 3 . . 42443316 . 8.030386471 . 113.4241196 . 19.30900798 . A 33 THR H A 33 THR N A 32 ALA CB 1 . . . 1
3 4 . . -43784272 . 8.165286784 . 115.7576718 . 52.54528869 . A 31 SER H A 31 SER N A 30 ALA CA 1 . . . 1
4 5 . . 39072768 . 8.165298254 . 115.7582691 . 19.13335061 . A 31 SER H A 31 SER N A 30 ALA CB 1 . . . 1
5 6 . . -37424000 . 8.076874997 . 117.4683737 . 57.65781807 . A 20 SER H A 20 SER N A 20-1 . CA 1 . . . 1
6 7 . . 31920796 . 8.076955417 . 117.4685982 . 39.49222098 . A 20 SER H A 20 SER N A 20-1 . CB 1 . . . 1
7 8 . . -45238548 . 8.328662375 . 120.1109721 . 53.18268527 . A 35 ASN H A 35 ASN N A 34 ASN CA 1 . . . 1
8 9 . . 51878624 . 8.328649509 . 120.1108854 . 38.93361017 . A 35 ASN H A 35 ASN N A 34 ASN CB 1 . . . 1
9 10 . . -34998584 . 8.28314354 . 119.9044378 . 56.30869901 . A 22 ASN H A 22 ASN N A 21 ARG CA 1 . . . 1
10 11 . . 29746556 . 8.283196042 . 119.9057168 . 30.56916132 . A 22 ASN H A 22 ASN N A 21 ARG CB 1 . . . 1
11 15 . . 43224048 . 8.301801713 . 121.4232204 . 69.88346189 . A 34 ASN H A 34 ASN N A 33 THR CB 1 . . . 1
12 16 . . -41205212 . 8.301810612 . 121.4219202 . 61.68994443 . A 34 ASN H A 34 ASN N A 33 THR CA 1 . . . 1
13 17 . . -12115598 . 8.443125646 . 123.4417521 . 55.61606202 . A 1 MET H A 1 MET N A 1-1 . CA 1 . . . 1
14 18 . . 10633479 . 8.443089802 . 123.4441326 . 29.82762626 . A 1 MET H A 1 MET N A 1-1 . CB 1 . . . 1
15 20 . . -39926684 . 8.263985481 . 123.3673454 . 56.56297103 . A 29 LYS H A 29 LYS N A 28 GLU CA 1 . . . 1
16 21 . . 33816588 . 8.264046164 . 123.3680351 . 30.2084134 . A 29 LYS H A 29 LYS N A 28 GLU CB 1 . . . 1
17 24 . . -42398536 . 8.129316656 . 125.4611181 . 55.95294943 . A 24 ALA H A 24 ALA N A 23 GLN CA 1 . . . 1
18 25 . . 36475816 . 8.12926923 . 125.4612686 . 29.467254 . A 24 ALA H A 24 ALA N A 23 GLN CB 1 . . . 1
19 26 . . -47878780 . 8.244758729 . 126.0475961 . 56.16382676 . A 30 ALA H A 30 ALA N A 29 LYS CA 1 . . . 1
20 27 . . 42570576 . 8.245003237 . 126.0455847 . 33.0104373 . A 30 ALA H A 30 ALA N A 29 LYS CB 1 . . . 1
21 28 . . 45239044 . 8.224223203 . 126.6854819 . 63.82542074 . A 32 ALA H A 32 ALA N A 31 SER CB 1 . . . 1
22 29 . . -40440244 . 8.224188659 . 126.6841279 . 58.2058583 . A 32 ALA H A 32 ALA N A 31 SER CA 1 . . . 1
23 31 . . 42712964 . 8.216762864 . 121.2340166 . 38.98374373 . A 36 ASP H A 36 ASP N A 35 ASN CB 1 . . . 1
24 32 . . 33289391.47 . 8.190164247 . 123.327 . 63.73167791 . A 21 ARG H A 21 ARG N A 20 SER CB 1 . . . 1
25 33 . . 41249104 . 8.165039218 . 121.2289752 . 38.66426578 . A 23 GLN H A 23 GLN N A 22 ASN CB 1 . . . 1
26 34 . . -52143144 . 8.164411158 . 121.5102457 . 53.69739426 . A 23 GLN H A 23 GLN N A 22 ASN CA 1 . . . 1
27 35 . . -48528412 . 7.984825858 . 115.3361381 . 55.26091974 . A 5 THR H A 5 THR N A 4 LEU CA 1 . . . 1
28 36 . . 41560516 . 7.98487598 . 115.3361525 . 42.22634689 . A 5 THR H A 5 THR N A 4 LEU CB 1 . . . 1
29 37 . . 22934510.6 . 8.249406414 . 124.435 . 30.09103895 . A 4 LEU H A 4 LEU N A 3 GLU CB 1 . . . 1
30 39 . . -30584147.87 . 8.250991134 . 124.435 . 56.3182874 . A 4 LEU H A 4 LEU N A 3 GLU CA 1 . . . 1
31 40 . . -65759796 . 8.340131114 . 125.6908923 . 62.29400665 . A 27 GLU H A 27 GLU N A 26 VAL CA 1 . . . 1
32 41 . . 53121500 . 8.340047357 . 125.6936389 . 32.6950521 . A 27 GLU H A 27 GLU N A 26 VAL CB 1 . . . 1
33 42 . . -40945584 . 8.349602271 . 123.7767313 . 56.34807625 . A 28 GLU H A 28 GLU N A 27 GLU CA 1 . . . 1
34 43 . . 33864860 . 8.349633402 . 123.7760038 . 30.40254477 . A 28 GLU H A 28 GLU N A 27 GLU CB 1 . . . 1
35 44 . . -49600048 . 8.112973313 . 122.6794974 . 55.51393122 . A 2 VAL H A 2 VAL N A 1 MET CA 1 . . . 1
36 45 . . 34067404 . 8.113018651 . 122.6804775 . 32.86686524 . A 2 VAL H A 2 VAL N A 1 MET CB 1 . . . 1
37 52 . . -35852144 . 8.076138927 . 120.9477047 . 56.4328475 . A 67 ASP H A 67 ASP N A 66 LYS CA 1 . . . 1
38 55 . . 30472350 . 8.07794157 . 121.0051993 . 32.94306107 . A 67 ASP H A 67 ASP N A 66 LYS CB 1 . . . 1
39 56 . . 18458078 . 8.417317603 . 125.3285205 . 32.69819486 . A 3 GLU H A 3 GLU N A 2 VAL CB 1 . . . 1
40 57 . . -23159594 . 8.418678678 . 125.3285205 . 62.2933504 . A 3 GLU H A 3 GLU N A 2 VAL CA 1 . . . 1
41 59 . . 27710448 . 8.111447819 . 124.0416799 . 30.71958704 . A 7 ILE H A 7 ILE N A 6 GLU CB 1 . . . 1
42 60 . . -33022240 . 8.111447819 . 124.0416799 . 56.4328475 . A 7 ILE H A 7 ILE N A 6 GLU CA 1 . . . 1
43 61 . . 34207180 . 8.311531544 . 127.1356551 . 38.37885611 . A 8 LYS H A 8 LYS N A 7 ILE CB 1 . . . 1
44 62 . . -39784456 . 8.311531544 . 127.1356551 . 60.80957269 . A 8 LYS H A 8 LYS N A 7 ILE CA 1 . . . 1
45 63 . . -37400484 . 8.217374497 . 122.6353276 . 55.88575685 . A 9 ASP H A 9 ASP N A 8 LYS CA 1 . . . 1
46 64 . . 31134972 . 8.217374497 . 122.6353276 . 33.45504028 . A 9 ASP H A 9 ASP N A 8 LYS CB 1 . . . 1
47 65 . . 35758424 . 8.205604866 . 120.9477047 . 41.11430935 . A 10 ASP H A 10 ASP N A 9 ASP CB 1 . . . 1
48 66 . . -42846404 . 8.211489682 . 121.2289752 . 53.69739426 . A 10 ASP H A 10 ASP N A 9 ASP CA 1 . . . 1
49 67 . . 27269050 . 8.060718141 . 125.1581139 . 32.68894193 . A 12 VAL H A 12 VAL N A 11 VAL CB 1 . . . 1
50 68 . . -44444120 . 8.064369296 . 125.1667618 . 61.90375398 . A 12 VAL H A 12 VAL N A 11 VAL CA 1 . . . 1
51 70 . . 62404904 . 7.8896493 . 120.8716277 . 41.08881828 . A 11 VAL H A 11 VAL N A 10 ASP CB 1 . . . 1
52 71 . . -55585300 . 7.888061745 . 120.8716277 . 54.5258832 . A 11 VAL H A 11 VAL N A 10 ASP CA 1 . . . 1
53 73 . . 36105080 . 8.345351989 . 125.5693866 . 32.48438795 . A 13 GLN H A 13 GLN N A 12 VAL CB 1 . . . 1
54 74 . . -43073828 . 8.345352089 . 125.5693866 . 62.00390247 . A 13 GLN H A 13 GLN N A 12 VAL CA 1 . . . 1
55 75 . . 29982786 . 8.217374497 . 125.1667618 . 29.62540574 . A 14 LEU H A 14 LEU N A 13 GLN CB 1 . . . 1
56 76 . . -34654504 . 8.217374497 . 125.1667618 . 55.3386662 . A 14 LEU H A 14 LEU N A 13 GLN CA 1 . . . 1
57 77 . . 24687106 . 7.937127218 . 120.8389248 . 19.02132386 . A 25 ILE H A 25 ILE N A 24 ALA CB 1 . . . 1
58 78 . . -37882440 . 7.940788171 . 120.9477047 . 52.60321296 . A 25 ILE H A 25 ILE N A 24 ALA CA 1 . . . 1
59 79 . . 28186956 . 8.064369296 . 125.4480323 . 38.37885611 . A 26 VAL H A 26 VAL N A 25 ILE CB 1 . . . 1
60 80 . . -31926288 . 8.060197806 . 125.3655925 . 61.08207422 . A 26 VAL H A 26 VAL N A 25 ILE CA 1 . . . 1
61 82 . . -33779264 . 8.215207592 . 121.3185675 . 53.23562241 . A 36 ASP H A 36 ASP N A 35 ASN CA 1 . . . 1
62 83 . . 58268896 . 7.888570408 . 120.8075184 . 40.80232457 . A 37 VAL H A 37 VAL N A 36 ASP CB 1 . . . 1
63 84 . . -54737264 . 7.889004799 . 120.822711 . 54.26372364 . A 37 VAL H A 37 VAL N A 36 ASP CA 1 . . . 1
64 85 . . 29954940 . 8.129102265 . 125.1667618 . 32.90794963 . A 38 VAL H A 38 VAL N A 37 VAL CB 1 . . . 1
65 86 . . -35542616 . 8.129102265 . 125.1667618 . 62.45084463 . A 38 VAL H A 38 VAL N A 37 VAL CA 1 . . . 1
66 87 . . 24723404 . 8.298961882 . 125.4040622 . 32.93870126 . A 39 ASP H A 39 ASP N A 38 VAL CB 1 . . . 1
67 88 . . -31247868 . 8.300517632 . 125.4040622 . 61.86342165 . A 39 ASP H A 39 ASP N A 38 VAL CA 1 . . . 1
68 89 . . 28090102 . 8.204108369 . 121.8769146 . 41.21453387 . A 40 ASP H A 40 ASP N A 39 ASP CB 1 . . . 1
69 90 . . -28157398 . 8.205047623 . 121.8769146 . 54.1837492 . A 40 ASP H A 40 ASP N A 39 ASP CA 1 . . . 1
70 91 . . 35667952 . 8.235028943 . 121.5102457 . 41.6614 . A 41 GLU H A 41 GLU N A 40 ASP CB 1 . . . 1
71 92 . . -41650740 . 8.233695803 . 121.6137868 . 54.19664467 . A 41 GLU H A 41 GLU N A 40 ASP CA 1 . . . 1
72 93 . . -37581924 . 8.258568205 . 122.3540571 . 56.4328475 . A 42 ASP H A 42 ASP N A 41 GLU CA 1 . . . 1
73 94 . . 28264576 . 8.257861816 . 122.199626 . 30.19082053 . A 42 ASP H A 42 ASP N A 41 GLU CB 1 . . . 1
74 95 . . 26115426 . 8.245447899 . 122.5804215 . 41.18517486 . A 43 ASP H A 43 ASP N A 42 ASP CB 1 . . . 1
75 96 . . -23206850 . 8.244360674 . 122.5804215 . 54.34315306 . A 43 ASP H A 43 ASP N A 42 ASP CA 1 . . . 1
76 97 . . 36362712 . 8.206029907 . 116.9563653 . 40.91893414 . A 44 SER H A 44 SER N A 43 ASP CB 1 . . . 1
77 98 . . -28337056 . 8.201668563 . 116.9563653 . 53.99677796 . A 44 SER H A 44 SER N A 43 ASP CA 1 . . . 1
78 99 . . -34134000 . 8.311531544 . 122.916598 . 59.16830074 . A 45 ASP H A 45 ASP N A 44 SER CA 1 . . . 1
79 100 . . 36146176 . 8.311531544 . 122.916598 . 64.09211657 . A 45 ASP H A 45 ASP N A 44 SER CB 1 . . . 1
80 101 . . 32314184 . 8.070254111 . 116.4473772 . 41.11430935 . A 46 SER H A 46 SER N A 45 ASP CB 1 . . . 1
81 102 . . -29419028 . 8.070254111 . 116.4473772 . 54.24448491 . A 46 SER H A 46 SER N A 45 ASP CA 1 . . . 1
82 103 . . -35116388 . 8.182065604 . 122.916598 . 58.62121009 . A 47 ASP H A 47 ASP N A 46 SER CA 1 . . . 1
83 104 . . 40516808 . 8.182065604 . 122.916598 . 64.09211657 . A 47 ASP H A 47 ASP N A 46 SER CA 1 . . . 1
84 105 . . 25807260 . 7.981981879 . 120.9477047 . 41.11430935 . A 48 PHE H A 48 PHE N A 47 ASP CB 1 . . . 1
85 106 . . -19914748 . 7.980214666 . 120.9109566 . 54.20330203 . A 48 PHE H A 48 PHE N A 47 ASP CA 1 . . . 1
86 108 . . 40305324 . 8.146756712 . 123.1978685 . 39.47303741 . A 49 GLU H A 49 GLU N A 48 PHE CB 1 . . . 1
87 109 . . -50419304 . 8.152641527 . 123.1978685 . 57.5270288 . A 49 GLU H A 49 GLU N A 48 PHE CA 1 . . . 1
88 110 . . 27737392 . 8.140871896 . 122.3540571 . 30.17249639 . A 50 ASP H A 50 ASP N A 49 GLU CB 1 . . . 1
89 111 . . -30568850 . 8.140587296 . 122.228918 . 56.10192833 . A 50 ASP H A 50 ASP N A 49 GLU CA 1 . . . 1
90 112 . . 27534734 . 8.168378905 . 121.6771076 . 41.38051241 . A 51 GLU H A 51 GLU N A 50 ASP CB 1 . . . 1
91 113 . . -37019384 . 8.167833827 . 121.6771076 . 54.19739987 . A 51 GLU H A 51 GLU N A 50 ASP CA 1 . . . 1
92 114 . . 22671166 . 8.128065703 . 121.6503565 . 30.13850023 . A 52 PHE H A 52 PHE N A 51 GLU CB 1 . . . 1
93 115 . . -28218174 . 8.129172315 . 121.6503565 . 56.40000745 . A 52 PHE H A 52 PHE N A 51 GLU CA 1 . . . 1
94 116 . . 32143934 . 8.374010415 . 122.931925 . 41.42699612 . A 54 GLU H A 54 GLU N A 53 ASP CB 1 . . . 1
95 117 . . -29496868 . 8.380356865 . 122.931925 . 53.7814815 . A 54 GLU H A 54 GLU N A 53 ASP CA 1 . . . 1
96 118 . . -9641240 . 8.196681677 . 123.5470562 . 57.40775336 . A 53 ASP H A 53 ASP N A 52 PHE CA 1 . . . 1
97 119 . . -274989.3438 . 8.19142406 . 123.5470562 . 39.70632972 . A 53 ASP H A 53 ASP N A 52 PHE CB 1 . . . 1
98 120 . . 27061524 . 8.365874451 . 119.2118462 . 29.74794614 . A 55 ASN H A 55 ASN N A 54 GLU CB 1 . . . 1
99 121 . . -31172096 . 8.36005582 . 119.2118462 . 57.06184691 . A 55 ASN H A 55 ASN N A 54 GLU CA 1 . . . 1
100 122 . . -25014648 . 8.136493759 . 121.3466708 . 53.8667268 . A 56 GLU H A 56 GLU N A 55 ASN CA 1 . . . 1
101 123 . . 28816508 . 8.137723286 . 121.3466708 . 39.00854496 . A 56 GLU H A 56 GLU N A 55 ASN CB 1 . . . 1
102 124 . . 22441532 . 8.079070151 . 115.2867237 . 29.97211725 . A 57 THR H A 57 THR N A 56 GLU CB 1 . . . 1
103 125 . . -28026592 . 8.081318696 . 115.2867237 . 57.24550042 . A 57 THR H A 57 THR N A 56 GLU CA 1 . . . 1
104 126 . . -30295578 . 8.010376399 . 124.5119437 . 62.43873921 . A 58 LEU H A 58 LEU N A 57 THR CA 1 . . . 1
105 127 . . 27755182 . 8.011964425 . 124.5119437 . 69.56707605 . A 58 LEU H A 58 LEU N A 57 THR CB 1 . . . 1
106 128 . . 29330854 . 7.946672987 . 122.3540571 . 42.20849065 . A 59 LEU H A 59 LEU N A 58 LEU CB 1 . . . 1
107 129 . . -37012064 . 7.946672987 . 122.3540571 . 55.88575685 . A 59 LEU H A 59 LEU N A 58 LEU CA 1 . . . 1
108 130 . . 27011596 . 8.052599665 . 120.1038933 . 42.20849065 . A 60 ASP H A 60 ASP N A 59 LEU CB 1 . . . 1
109 131 . . -33123796 . 8.052599665 . 120.1038933 . 55.88575685 . A 60 ASP H A 60 ASP N A 59 LEU CA 1 . . . 1
110 132 . . 49894032 . 7.88203635 . 120.6272999 . 40.93673456 . A 61 ARG H A 61 ARG N A 60 ASP CB 1 . . . 1
111 133 . . -38433484 . 7.873852091 . 120.6272999 . 54.79272678 . A 61 ARG H A 61 ARG N A 60 ASP CA 1 . . . 1
112 134 . . 22254188 . 7.956002679 . 121.9359984 . 30.71200972 . A 62 ILE H A 62 ILE N A 61 ARG CB 1 . . . 1
113 135 . . -28393244 . 7.953814065 . 121.9359984 . 56.41081878 . A 62 ILE H A 62 ILE N A 61 ARG CA 1 . . . 1
114 136 . . 19775332 . 7.99375151 . 124.3229504 . 38.37885611 . A 63 VAL H A 63 VAL N A 62 ILE CB 1 . . . 1
115 138 . . -26085240 . 7.996944298 . 124.4267222 . 61.65200019 . A 63 VAL H A 63 VAL N A 62 ILE CA 1 . . . 1
116 139 . . -36038460 . 8.111447819 . 127.4169256 . 62.99793528 . A 64 ALA H A 64 ALA N A 63 VAL CA 1 . . . 1
117 141 . . 28438192 . 8.111447819 . 127.4169256 . 32.36085898 . A 64 ALA H A 64 ALA N A 63 VAL CB 1 . . . 1
118 142 . . 34954052 . 7.964327433 . 121.7915162 . 19.23068343 . A 65 LEU H A 65 LEU N A 64 ALA CB 1 . . . 1
119 144 . . -37818748 . 7.964327433 . 121.7915162 . 52.60321296 . A 65 LEU H A 65 LEU N A 64 ALA CA 1 . . . 1
120 145 . . 34312580 . 8.011405957 . 121.2289752 . 42.20849065 . A 66 LYS H A 66 LYS N A 65 LEU CB 1 . . . 1
121 146 . . -56457788 . 8.011405957 . 120.9477047 . 55.88575685 . A 66 LYS H A 66 LYS N A 65 LEU CA 1 . . . 1
122 147 . . 27035410 . 7.834861493 . 120.9477047 . 41.11430935 . A 68 ILE H A 68 ILE N A 67 ASP CB 1 . . . 1
123 148 . . -24969984 . 7.834861493 . 120.9477047 . 54.24448491 . A 68 ILE H A 68 ILE N A 67 ASP CA 1 . . . 1
124 149 . . 23363810 . 8.093793373 . 127.1356551 . 38.92594676 . A 69 VAL H A 69 VAL N A 68 ILE CB 1 . . . 1
125 150 . . -28204268 . 8.093793373 . 127.1356551 . 60.80957269 . A 69 VAL H A 69 VAL N A 68 ILE CA 1 . . . 1
126 151 . . 25665906 . 7.752474077 . 126.8543847 . 42.20849065 . A 76 GLU H A 76 GLU N A 76-1 . CB 1 . . . 1
127 152 . . -28383204 . 7.752474077 . 126.8543847 . 55.3386662 . A 76 GLU H A 76 GLU N A 76-1 . CA 1 . . . 1
;
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 1H . aliased 6.02605 ppm . . . . . . 51381 5
2 . . N 15 15N . aliased 36.0026 ppm . . . . . . 51381 5
3 . . C 13 CaCb . aliased 70.0276 ppm . . . . . . 51381 5
stop_
loop_
_Spectral_peak_software.Software_ID
_Spectral_peak_software.Software_label
_Spectral_peak_software.Method_ID
_Spectral_peak_software.Method_label
_Spectral_peak_software.Entry_ID
_Spectral_peak_software.Spectral_peak_list_ID
2 $software_2 . . 51381 5
stop_
save_