Content for NMR-STAR saveframe, "peak_list_1_2_3_4_5_6_7"
save_peak_list_1_2_3_4_5_6_7
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_1_2_3_4_5_6_7
_Spectral_peak_list.Entry_ID 25684
_Spectral_peak_list.ID 7
_Spectral_peak_list.Sample_ID 3
_Spectral_peak_list.Sample_label $wr18_39
_Spectral_peak_list.Sample_condition_list_ID 2
_Spectral_peak_list.Sample_condition_list_label $2
_Spectral_peak_list.Experiment_ID 11
_Spectral_peak_list.Experiment_name '2D 1H-1H NOESY'
_Spectral_peak_list.Experiment_class .
_Spectral_peak_list.Experiment_type .
_Spectral_peak_list.Number_of_spectral_dimensions 2
_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
;
cyana format, file /Volumes/CGI/Mac_10Sep2014/wr10_43/ccpnmr/NOESY_200ms_4.peaks.
;
_Spectral_peak_list.Text_data_format .
_Spectral_peak_list.Text_data .
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 . . 11718.75 Hz . . . . . . 25684 7
2 . . H 1 1H . . 11718.75 Hz . . . . . . 25684 7
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . 'Original number 1' 25684 7
2 1.0 . 'Original number 2' 25684 7
3 1.0 . 'Original number 3' 25684 7
4 1.0 . 'Original number 4' 25684 7
5 1.0 . 'Original number 13' 25684 7
6 1.0 . 'Original number 14' 25684 7
7 1.0 . 'Original number 16' 25684 7
8 1.0 . 'Original number 18' 25684 7
9 1.0 . 'Original number 19' 25684 7
10 1.0 . 'Original number 20' 25684 7
11 1.0 . 'Original number 21' 25684 7
12 1.0 . 'Original number 22' 25684 7
13 1.0 . 'Original number 24' 25684 7
14 1.0 . 'Original number 25' 25684 7
15 1.0 . 'Original number 27' 25684 7
16 1.0 . 'Original number 38' 25684 7
17 1.0 . 'Original number 39' 25684 7
18 1.0 . 'Original number 40' 25684 7
19 1.0 . 'Original number 41' 25684 7
20 1.0 . 'Original number 42' 25684 7
21 1.0 . 'Original number 44' 25684 7
22 1.0 . 'Original number 45' 25684 7
23 1.0 . 'Original number 46' 25684 7
24 1.0 . 'Original number 48' 25684 7
25 1.0 . 'Original number 49' 25684 7
26 1.0 . 'Original number 50' 25684 7
27 1.0 . 'Original number 51' 25684 7
28 1.0 . 'Original number 52' 25684 7
29 1.0 . 'Original number 53' 25684 7
30 1.0 . 'Original number 54' 25684 7
31 1.0 . 'Original number 55' 25684 7
32 1.0 . 'Original number 57' 25684 7
33 1.0 . 'Original number 58' 25684 7
34 1.0 . 'Original number 59' 25684 7
35 1.0 . 'Original number 60' 25684 7
36 1.0 . 'Original number 61' 25684 7
37 1.0 . 'Original number 62' 25684 7
38 1.0 . 'Original number 63' 25684 7
39 1.0 . 'Original number 64' 25684 7
40 1.0 . 'Original number 65' 25684 7
41 1.0 . 'Original number 66' 25684 7
42 1.0 . 'Original number 68' 25684 7
43 1.0 . 'Original number 71' 25684 7
44 1.0 . 'Original number 72' 25684 7
45 1.0 . 'Original number 74' 25684 7
46 1.0 . 'Original number 75' 25684 7
47 1.0 . 'Original number 76' 25684 7
48 1.0 . 'Original number 77' 25684 7
49 1.0 . 'Original number 78' 25684 7
stop_
loop_
_Peak_general_char.Peak_ID
_Peak_general_char.Intensity_val
_Peak_general_char.Intensity_val_err
_Peak_general_char.Measurement_method
_Peak_general_char.Entry_ID
_Peak_general_char.Spectral_peak_list_ID
1 10077509.00 . height 25684 7
1 81789171.50 . volume 25684 7
2 6589545.50 . height 25684 7
2 52340191.50 . volume 25684 7
3 5120117.00 . height 25684 7
3 40860536.00 . volume 25684 7
4 5558398.00 . height 25684 7
4 44038428.75 . volume 25684 7
5 14651017.00 . height 25684 7
5 116377013.00 . volume 25684 7
6 10846335.00 . height 25684 7
6 85079100.00 . volume 25684 7
7 28430064.00 . height 25684 7
7 220560396.00 . volume 25684 7
8 16710960.00 . height 25684 7
8 131850632.00 . volume 25684 7
9 25661578.00 . height 25684 7
9 206179742.00 . volume 25684 7
10 7532202.50 . height 25684 7
10 58829254.00 . volume 25684 7
11 3227163.00 . height 25684 7
11 25063308.75 . volume 25684 7
12 6648053.00 . height 25684 7
12 53556045.00 . volume 25684 7
13 43975588.00 . height 25684 7
13 348372032.00 . volume 25684 7
14 7253291.00 . height 25684 7
14 58869142.50 . volume 25684 7
15 60124972.00 . height 25684 7
15 485906644.00 . volume 25684 7
16 13718938.00 . height 25684 7
16 115708836.00 . volume 25684 7
17 10683344.00 . height 25684 7
17 86169707.00 . volume 25684 7
18 41870744.00 . height 25684 7
18 314217436.00 . volume 25684 7
19 9005905.00 . height 25684 7
19 74102601.50 . volume 25684 7
20 26412254.00 . height 25684 7
20 210681090.00 . volume 25684 7
21 43160904.00 . height 25684 7
21 336891906.00 . volume 25684 7
22 66800796.00 . height 25684 7
22 537006192.00 . volume 25684 7
23 24066596.00 . height 25684 7
23 194313670.00 . volume 25684 7
24 62991008.00 . height 25684 7
24 497513876.00 . volume 25684 7
25 34578844.00 . height 25684 7
25 269674294.00 . volume 25684 7
26 26107906.00 . height 25684 7
26 213526628.00 . volume 25684 7
27 10522297.00 . height 25684 7
27 77495006.00 . volume 25684 7
28 11385360.00 . height 25684 7
28 87001492.00 . volume 25684 7
29 9323167.00 . height 25684 7
29 77999259.50 . volume 25684 7
30 14382296.00 . height 25684 7
30 122430362.00 . volume 25684 7
31 6319885.00 . height 25684 7
31 56465330.00 . volume 25684 7
32 11916642.00 . height 25684 7
32 99776179.00 . volume 25684 7
33 56633532.00 . height 25684 7
33 456000496.00 . volume 25684 7
34 21792410.00 . height 25684 7
34 172911178.00 . volume 25684 7
35 10116387.00 . height 25684 7
35 91564500.00 . volume 25684 7
36 9567995.00 . height 25684 7
36 79905403.50 . volume 25684 7
37 7036396.00 . height 25684 7
37 61533330.00 . volume 25684 7
38 15367262.00 . height 25684 7
38 135729540.00 . volume 25684 7
39 6003648.50 . height 25684 7
39 51411263.00 . volume 25684 7
40 2942382.00 . height 25684 7
40 25942390.75 . volume 25684 7
41 10771249.00 . height 25684 7
41 90122150.00 . volume 25684 7
42 7781570.00 . height 25684 7
42 61366465.50 . volume 25684 7
43 19097194.00 . height 25684 7
43 151911216.00 . volume 25684 7
44 7614244.50 . height 25684 7
44 61596718.50 . volume 25684 7
45 22399712.00 . height 25684 7
45 172654918.00 . volume 25684 7
46 8001896.50 . height 25684 7
46 62412814.00 . volume 25684 7
47 9027751.00 . height 25684 7
47 70836339.50 . volume 25684 7
48 12852860.00 . height 25684 7
48 99825316.00 . volume 25684 7
49 24995522.00 . height 25684 7
49 203847314.00 . volume 25684 7
stop_
loop_
_Peak_char.Peak_ID
_Peak_char.Spectral_dim_ID
_Peak_char.Chem_shift_val
_Peak_char.Chem_shift_val_err
_Peak_char.Line_width_val
_Peak_char.Line_width_val_err
_Peak_char.Phase_val
_Peak_char.Phase_val_err
_Peak_char.Decay_rate_val
_Peak_char.Decay_rate_val_err
_Peak_char.Coupling_pattern
_Peak_char.Bounding_box_upper_val
_Peak_char.Bounding_box_lower_val
_Peak_char.Bounding_box_range_val
_Peak_char.Details
_Peak_char.Derivation_method_ID
_Peak_char.Entry_ID
_Peak_char.Spectral_peak_list_ID
1 1 8.355 . 17.4790620804 . . . . . . . . . . 2 25684 7
1 2 3.057 . 29.8954546452 . . . . . . . . . . 2 25684 7
2 1 8.355 . 16.5519886650 . . . . . . . . . . 2 25684 7
2 2 3.256 . 27.3480545729 . . . . . . . . . . 2 25684 7
3 1 8.076 . 17.0720159076 . . . . . . . . . . 2 25684 7
3 2 3.057 . 28.7827569991 . . . . . . . . . . 2 25684 7
4 1 8.076 . 16.0040217452 . . . . . . . . . . 2 25684 7
4 2 3.258 . 28.2281544060 . . . . . . . . . . 2 25684 7
5 1 8.053 . 17.7401234396 . . . . . . . . . . 2 25684 7
5 2 3.748 . 27.6798382401 . . . . . . . . . . 2 25684 7
6 1 8.053 . 17.8216723725 . . . . . . . . . . 2 25684 7
6 2 3.889 . 26.3568945229 . . . . . . . . . . 2 25684 7
7 1 8.053 . 17.3299340531 . . . . . . . . . . 2 25684 7
7 2 4.305 . 23.9058863372 . . . . . . . . . . 2 25684 7
8 1 8.052 . 17.0019920915 . . . . . . . . . . 2 25684 7
8 2 4.482 . 29.9268867821 . . . . . . . . . . 2 25684 7
9 1 8.053 . 18.0556671694 . . . . . . . . . . 2 25684 7
9 2 8.110 . 89.0771043487 . . . . . . . . . . 2 25684 7
10 1 8.053 . 18.2943767868 . . . . . . . . . . 2 25684 7
10 2 8.272 . 25.9163207375 . . . . . . . . . . 2 25684 7
11 1 8.053 . 20.2552182600 . . . . . . . . . . 2 25684 7
11 2 2.302 . 29.7781080008 . . . . . . . . . . 2 25684 7
12 1 8.052 . 18.4925738722 . . . . . . . . . . 2 25684 7
12 2 1.937 . 32.8563619405 . . . . . . . . . . 2 25684 7
13 1 8.125 . 14.9793340825 . . . . . . . . . . 2 25684 7
13 2 3.737 . 27.9766973108 . . . . . . . . . . 2 25684 7
14 1 8.356 . 17.7043257281 . . . . . . . . . . 2 25684 7
14 2 3.737 . 27.7245417237 . . . . . . . . . . 2 25684 7
15 1 8.125 . 15.7682807185 . . . . . . . . . . 2 25684 7
15 2 4.268 . 33.8251702487 . . . . . . . . . . 2 25684 7
16 1 8.108 . 18.4087548405 . . . . . . . . . . 2 25684 7
16 2 1.937 . 33.3725474775 . . . . . . . . . . 2 25684 7
17 1 8.107 . 17.0320272446 . . . . . . . . . . 2 25684 7
17 2 2.301 . 29.3687917292 . . . . . . . . . . 2 25684 7
18 1 8.266 . 17.7476322278 . . . . . . . . . . 2 25684 7
18 2 1.127 . 20.0229696929 . . . . . . . . . . 2 25684 7
19 1 8.266 . 17.9379712790 . . . . . . . . . . 2 25684 7
19 2 3.748 . 40.6571198255 . . . . . . . . . . 2 25684 7
20 1 8.266 . 17.9070630111 . . . . . . . . . . 2 25684 7
20 2 4.263 . 26.2437388301 . . . . . . . . . . 2 25684 7
21 1 8.266 . 16.9281265698 . . . . . . . . . . 2 25684 7
21 2 4.482 . 23.1857411563 . . . . . . . . . . 2 25684 7
22 1 8.108 . 19.8411871679 . . . . . . . . . . 2 25684 7
22 2 4.453 . 23.4162434936 . . . . . . . . . . 2 25684 7
23 1 8.107 . 20.6896802410 . . . . . . . . . . 2 25684 7
23 2 4.306 . 27.0819291472 . . . . . . . . . . 2 25684 7
24 1 8.076 . 18.6539255083 . . . . . . . . . . 2 25684 7
24 2 4.257 . 31.8631064147 . . . . . . . . . . 2 25684 7
25 1 8.076 . 16.4538505487 . . . . . . . . . . 2 25684 7
25 2 1.610 . 28.7289731205 . . . . . . . . . . 2 25684 7
26 1 8.076 . 17.3662556335 . . . . . . . . . . 2 25684 7
26 2 1.522 . 46.7018689960 . . . . . . . . . . 2 25684 7
27 1 8.076 . 17.6760368049 . . . . . . . . . . 2 25684 7
27 2 0.858 . 20.2807132155 . . . . . . . . . . 2 25684 7
28 1 8.076 . 18.0111383088 . . . . . . . . . . 2 25684 7
28 2 0.810 . 21.9396315515 . . . . . . . . . . 2 25684 7
29 1 8.080 . 16.2525102496 . . . . . . . . . . 2 25684 7
29 2 1.793 . 28.8183800876 . . . . . . . . . . 2 25684 7
30 1 8.081 . 16.7046091519 . . . . . . . . . . 2 25684 7
30 2 1.675 . 30.3753186017 . . . . . . . . . . 2 25684 7
31 1 8.081 . 20.8436977118 . . . . . . . . . . 2 25684 7
31 2 1.353 . 51.1764083058 . . . . . . . . . . 2 25684 7
32 1 8.081 . 17.0936691575 . . . . . . . . . . 2 25684 7
32 2 7.928 . 26.2547400780 . . . . . . . . . . 2 25684 7
33 1 7.923 . 15.8617040142 . . . . . . . . . . 2 25684 7
33 2 4.274 . 21.6329935938 . . . . . . . . . . 2 25684 7
34 1 8.356 . 17.0700950548 . . . . . . . . . . 2 25684 7
34 2 4.274 . 23.2758466154 . . . . . . . . . . 2 25684 7
35 1 7.923 . 19.5541069843 . . . . . . . . . . 2 25684 7
35 2 4.078 . 24.6630515903 . . . . . . . . . . 2 25684 7
36 1 7.923 . 15.9586197697 . . . . . . . . . . 2 25684 7
36 2 2.206 . 25.7010105997 . . . . . . . . . . 2 25684 7
37 1 7.923 . 16.8979167938 . . . . . . . . . . 2 25684 7
37 2 1.995 . 28.4265261143 . . . . . . . . . . 2 25684 7
38 1 7.923 . 16.8477999978 . . . . . . . . . . 2 25684 7
38 2 1.827 . 32.6056033373 . . . . . . . . . . 2 25684 7
39 1 7.924 . 16.6242825799 . . . . . . . . . . 2 25684 7
39 2 1.675 . 29.3988268822 . . . . . . . . . . 2 25684 7
40 1 7.923 . 15.8866751008 . . . . . . . . . . 2 25684 7
40 2 1.609 . 30.6400470436 . . . . . . . . . . 2 25684 7
41 1 7.923 . 16.7342950590 . . . . . . . . . . 2 25684 7
41 2 8.085 . 25.4013575613 . . . . . . . . . . 2 25684 7
42 1 8.355 . 17.9332564585 . . . . . . . . . . 2 25684 7
42 2 8.130 . 24.1367379203 . . . . . . . . . . 2 25684 7
43 1 8.267 . 17.3487933353 . . . . . . . . . . 2 25684 7
43 2 8.130 . 25.7696374319 . . . . . . . . . . 2 25684 7
44 1 8.266 . 17.9009512067 . . . . . . . . . . 2 25684 7
44 2 8.058 . 31.8910460919 . . . . . . . . . . 2 25684 7
45 1 8.126 . 14.2008648254 . . . . . . . . . . 2 25684 7
45 2 8.271 . 24.8619471677 . . . . . . . . . . 2 25684 7
46 1 8.126 . 14.6199599840 . . . . . . . . . . 2 25684 7
46 2 8.361 . 23.5809129663 . . . . . . . . . . 2 25684 7
47 1 8.073 . 15.5164743774 . . . . . . . . . . 2 25684 7
47 2 8.361 . 24.1826637648 . . . . . . . . . . 2 25684 7
48 1 8.355 . 17.7123583853 . . . . . . . . . . 2 25684 7
48 2 8.079 . 24.0162480623 . . . . . . . . . . 2 25684 7
49 1 8.108 . 26.4468253590 . . . . . . . . . . 2 25684 7
49 2 1.109 . 24.5303381234 . . . . . . . . . . 2 25684 7
stop_
loop_
_Assigned_peak_chem_shift.Peak_ID
_Assigned_peak_chem_shift.Spectral_dim_ID
_Assigned_peak_chem_shift.Set_ID
_Assigned_peak_chem_shift.Magnetization_linkage_ID
_Assigned_peak_chem_shift.Assembly_atom_ID
_Assigned_peak_chem_shift.Val
_Assigned_peak_chem_shift.Contribution_fractional_val
_Assigned_peak_chem_shift.Figure_of_merit
_Assigned_peak_chem_shift.Assigned_chem_shift_list_ID
_Assigned_peak_chem_shift.Atom_chem_shift_ID
_Assigned_peak_chem_shift.Entity_assembly_ID
_Assigned_peak_chem_shift.Entity_ID
_Assigned_peak_chem_shift.Comp_index_ID
_Assigned_peak_chem_shift.Comp_ID
_Assigned_peak_chem_shift.Atom_ID
_Assigned_peak_chem_shift.Ambiguity_code
_Assigned_peak_chem_shift.Ambiguity_set_ID
_Assigned_peak_chem_shift.Auth_atom_peak_num
_Assigned_peak_chem_shift.Auth_entity_ID
_Assigned_peak_chem_shift.Auth_seq_ID
_Assigned_peak_chem_shift.Auth_comp_ID
_Assigned_peak_chem_shift.Auth_atom_ID
_Assigned_peak_chem_shift.Auth_ambiguity_code
_Assigned_peak_chem_shift.Auth_ambiguity_set_ID
_Assigned_peak_chem_shift.Auth_amb_atom_grp_ID
_Assigned_peak_chem_shift.Resonance_ID
_Assigned_peak_chem_shift.Details
_Assigned_peak_chem_shift.Entry_ID
_Assigned_peak_chem_shift.Spectral_peak_list_ID
1 1 1 . . 8.355 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
1 2 1 . . 3.057 . . 4 . 1 1 32 HIS HB3 . . . . . . . . . . 259 . 25684 7
2 1 1 . . 8.355 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
2 2 1 . . 3.256 . . 4 . 1 1 32 HIS HB2 . . . . . . . . . . 258 . 25684 7
3 1 1 . . 8.076 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
3 2 1 . . 3.057 . . 4 . 1 1 32 HIS HB3 . . . . . . . . . . 259 . 25684 7
4 1 1 . . 8.076 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
4 2 1 . . 3.258 . . 4 . 1 1 32 HIS HB2 . . . . . . . . . . 258 . 25684 7
5 1 1 . . 8.053 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
5 2 1 . . 3.748 . . 4 . 1 1 29 SER HB3 . . . . . . . . . . 253 . 25684 7
6 1 1 . . 8.053 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
6 2 1 . . 3.889 . . 4 . 1 1 29 SER HB2 . . . . . . . . . . 252 . 25684 7
7 1 1 . . 8.053 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
7 2 1 . . 4.305 . . 4 . 1 1 28 THR HA . . . . . . . . . . 411 . 25684 7
8 1 1 . . 8.052 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
8 2 1 . . 4.482 . . 4 . 1 1 29 SER HA . . . . . . . . . . 251 . 25684 7
9 1 1 . . 8.053 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
9 2 1 . . 8.110 . . 4 . 1 1 28 THR H . . . . . . . . . . 124 . 25684 7
10 1 1 . . 8.053 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
10 2 1 . . 8.272 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
11 1 1 . . 8.053 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
11 2 1 . . 2.302 . . 4 . 1 1 27 PRO HB3 . . . . . . . . . . 247 . 25684 7
11 2 2 . . 2.302 . . 4 . 1 1 27 PRO HB2 . . . . . . . . . . 246 . 25684 7
12 1 1 . . 8.052 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
12 2 1 . . 1.937 . . 4 . 1 1 27 PRO HG3 . . . . . . . . . . 395 . 25684 7
12 2 2 . . 1.937 . . 4 . 1 1 27 PRO HG2 . . . . . . . . . . 394 . 25684 7
13 1 1 . . 8.125 . . 4 . 1 1 31 SER H . . . . . . . . . . 99 . 25684 7
13 2 1 . . 3.737 . . 4 . 1 1 31 SER HB2 . . . . . . . . . . 291 . 25684 7
14 1 1 . . 8.356 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
14 2 1 . . 3.737 . . 4 . 1 1 31 SER HB2 . . . . . . . . . . 291 . 25684 7
15 1 1 . . 8.125 . . 4 . 1 1 31 SER H . . . . . . . . . . 99 . 25684 7
15 2 1 . . 4.268 . . 4 . 1 1 31 SER HA . . . . . . . . . . 326 . 25684 7
16 1 1 . . 8.108 . . 4 . 1 1 28 THR H . . . . . . . . . . 124 . 25684 7
16 2 1 . . 1.937 . . 4 . 1 1 27 PRO HG3 . . . . . . . . . . 395 . 25684 7
16 2 2 . . 1.937 . . 4 . 1 1 27 PRO HG2 . . . . . . . . . . 394 . 25684 7
17 1 1 . . 8.107 . . 4 . 1 1 28 THR H . . . . . . . . . . 124 . 25684 7
17 2 1 . . 2.301 . . 4 . 1 1 27 PRO HB3 . . . . . . . . . . 247 . 25684 7
17 2 2 . . 2.301 . . 4 . 1 1 27 PRO HB2 . . . . . . . . . . 246 . 25684 7
18 1 1 . . 8.266 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
18 2 1 . . 1.127 . . 4 . 1 1 30 THR MG . . . . . . . . . . 256 . 25684 7
19 1 1 . . 8.266 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
19 2 1 . . 3.748 . . 4 . 1 1 29 SER HB3 . . . . . . . . . . 253 . 25684 7
20 1 1 . . 8.266 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
20 2 1 . . 4.263 . . 4 . 1 1 30 THR HA . . . . . . . . . . 325 . 25684 7
21 1 1 . . 8.266 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
21 2 1 . . 4.482 . . 4 . 1 1 29 SER HA . . . . . . . . . . 251 . 25684 7
22 1 1 . . 8.108 . . 4 . 1 1 28 THR H . . . . . . . . . . 124 . 25684 7
22 2 1 . . 4.453 . . 4 . 1 1 27 PRO HA . . . . . . . . . . 412 . 25684 7
23 1 1 . . 8.107 . . 4 . 1 1 28 THR H . . . . . . . . . . 124 . 25684 7
23 2 1 . . 4.306 . . 4 . 1 1 28 THR HA . . . . . . . . . . 411 . 25684 7
24 1 1 . . 8.076 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
24 2 1 . . 4.257 . . 4 . 1 1 33 LEU HA . . . . . . . . . . 327 . 25684 7
25 1 1 . . 8.076 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
25 2 1 . . 1.610 . . 4 . 1 1 33 LEU HB3 . . . . . . . . . . 262 . 25684 7
26 1 1 . . 8.076 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
26 2 1 . . 1.522 . . 4 . 1 1 33 LEU HB2 . . . . . . . . . . 261 . 25684 7
27 1 1 . . 8.076 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
27 2 1 . . 0.858 . . 4 . 1 1 33 LEU MD1 . . . . . . . . . . 264 . 25684 7
28 1 1 . . 8.076 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
28 2 1 . . 0.810 . . 4 . 1 1 33 LEU MD2 . . . . . . . . . . 265 . 25684 7
29 1 1 . . 8.080 . . 4 . 1 1 34 LYS H . . . . . . . . . . 29 . 25684 7
29 2 1 . . 1.793 . . 4 . 1 1 34 LYS HB3 . . . . . . . . . . 273 . 25684 7
30 1 1 . . 8.081 . . 4 . 1 1 34 LYS H . . . . . . . . . . 29 . 25684 7
30 2 1 . . 1.675 . . 4 . 1 1 34 LYS HB2 . . . . . . . . . . 272 . 25684 7
31 1 1 . . 8.081 . . 4 . 1 1 34 LYS H . . . . . . . . . . 29 . 25684 7
31 2 1 . . 1.353 . . 4 . 1 1 34 LYS HG3 . . . . . . . . . . 269 . 25684 7
31 2 2 . . 1.353 . . 4 . 1 1 34 LYS HG2 . . . . . . . . . . 268 . 25684 7
32 1 1 . . 8.081 . . 4 . 1 1 34 LYS H . . . . . . . . . . 29 . 25684 7
32 2 1 . . 7.928 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
33 1 1 . . 7.923 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
33 2 1 . . 4.274 . . 4 . 1 1 34 LYS HA . . . . . . . . . . 266 . 25684 7
34 1 1 . . 8.356 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
34 2 1 . . 4.274 . . 4 . 1 1 34 LYS HA . . . . . . . . . . 266 . 25684 7
35 1 1 . . 7.923 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
35 2 1 . . 4.078 . . 4 . 1 1 35 GLU HA . . . . . . . . . . 274 . 25684 7
36 1 1 . . 7.923 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
36 2 1 . . 2.206 . . 4 . 1 1 35 GLU HG2 . . . . . . . . . . 277 . 25684 7
37 1 1 . . 7.923 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
37 2 1 . . 1.995 . . 4 . 1 1 35 GLU HG3 . . . . . . . . . . 413 . 25684 7
38 1 1 . . 7.923 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
38 2 1 . . 1.827 . . 4 . 1 1 35 GLU HB3 . . . . . . . . . . 276 . 25684 7
38 2 2 . . 1.827 . . 4 . 1 1 35 GLU HB2 . . . . . . . . . . 275 . 25684 7
39 1 1 . . 7.924 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
39 2 1 . . 1.675 . . 4 . 1 1 34 LYS HB2 . . . . . . . . . . 272 . 25684 7
40 1 1 . . 7.923 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
40 2 1 . . 1.609 . . 4 . 1 1 33 LEU HB3 . . . . . . . . . . 262 . 25684 7
41 1 1 . . 7.923 . . 4 . 1 1 35 GLU H . . . . . . . . . . 39 . 25684 7
41 2 1 . . 8.085 . . 4 . 1 1 34 LYS H . . . . . . . . . . 29 . 25684 7
42 1 1 . . 8.355 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
42 2 1 . . 8.130 . . 4 . 1 1 31 SER H . . . . . . . . . . 99 . 25684 7
43 1 1 . . 8.267 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
43 2 1 . . 8.130 . . 4 . 1 1 31 SER H . . . . . . . . . . 99 . 25684 7
44 1 1 . . 8.266 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
44 2 1 . . 8.058 . . 4 . 1 1 29 SER H . . . . . . . . . . 119 . 25684 7
45 1 1 . . 8.126 . . 4 . 1 1 31 SER H . . . . . . . . . . 99 . 25684 7
45 2 1 . . 8.271 . . 4 . 1 1 30 THR H . . . . . . . . . . 129 . 25684 7
46 1 1 . . 8.126 . . 4 . 1 1 31 SER H . . . . . . . . . . 99 . 25684 7
46 2 1 . . 8.361 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
47 1 1 . . 8.073 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
47 2 1 . . 8.361 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
48 1 1 . . 8.355 . . 4 . 1 1 32 HIS H . . . . . . . . . . 337 . 25684 7
48 2 1 . . 8.079 . . 4 . 1 1 33 LEU H . . . . . . . . . . 27 . 25684 7
49 1 1 . . 8.108 . . 4 . 1 1 28 THR H . . . . . . . . . . 124 . 25684 7
49 2 1 . . 1.109 . . 4 . 1 1 28 THR MG . . . . . . . . . . 250 . 25684 7
stop_
save_