Content for NMR-STAR saveframe, spectral_peak_list_6
save_spectral_peak_list_6
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode spectral_peak_list_6
_Spectral_peak_list.Entry_ID 52627
_Spectral_peak_list.ID 6
_Spectral_peak_list.Name peak_list_1_2a
_Spectral_peak_list.Sample_ID 2
_Spectral_peak_list.Sample_label $sample_2
_Spectral_peak_list.Sample_condition_list_ID 2
_Spectral_peak_list.Sample_condition_list_label $sample_conditions_2
_Spectral_peak_list.Chem_shift_reference_ID 1
_Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1
_Spectral_peak_list.Experiment_ID 11
_Spectral_peak_list.Experiment_name '3D HNCO'
_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 'Default list'
_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 . aliased 12 ppm . . . . . . 52627 6
2 . . C 13 13C . aliased 5 ppm . . . . . . 52627 6
3 . . N 15 15N . aliased 20.5 ppm . . . . . . 52627 6
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
1 $software_1 . . 52627 6
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Type
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . . . 52627 6
2 1.0 . . . 52627 6
3 1.0 . . . 52627 6
4 1.0 . . . 52627 6
5 1.0 . . . 52627 6
6 1.0 . . . 52627 6
7 1.0 . . . 52627 6
8 1.0 . . . 52627 6
9 1.0 . . . 52627 6
10 1.0 . . . 52627 6
11 1.0 . . . 52627 6
12 1.0 . . . 52627 6
13 1.0 . . . 52627 6
14 1.0 . . . 52627 6
15 1.0 . . . 52627 6
16 1.0 . . . 52627 6
17 1.0 . . . 52627 6
18 1.0 . . . 52627 6
19 1.0 . . . 52627 6
20 1.0 . . . 52627 6
21 1.0 . . . 52627 6
22 1.0 . . . 52627 6
23 1.0 . . . 52627 6
24 1.0 . . . 52627 6
25 1.0 . . . 52627 6
26 1.0 . . . 52627 6
27 1.0 . . . 52627 6
28 1.0 . . . 52627 6
29 1.0 . . . 52627 6
30 1.0 . . . 52627 6
31 1.0 . . . 52627 6
32 1.0 . . . 52627 6
33 1.0 . . . 52627 6
34 1.0 . . . 52627 6
35 1.0 . . . 52627 6
36 1.0 . . . 52627 6
37 1.0 . . . 52627 6
38 1.0 . . . 52627 6
39 1.0 . . . 52627 6
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 4.51689001779e+12 . height 52627 6
1 4.68898132951e+13 . volume 52627 6
2 6.28899761357e+12 . height 52627 6
2 7.88630546022e+13 . volume 52627 6
3 4.62596499046e+12 . height 52627 6
3 6.63579471452e+13 . volume 52627 6
4 1.60867496755e+12 . height 52627 6
4 2.05330418319e+13 . volume 52627 6
5 6.33919451955e+12 . height 52627 6
5 8.06871544627e+13 . volume 52627 6
6 9.7392263168e+11 . height 52627 6
6 1.48618140385e+13 . volume 52627 6
7 1.77349869568e+11 . height 52627 6
7 2.83005594214e+12 . volume 52627 6
8 4.79651063398e+12 . height 52627 6
8 5.93401821266e+13 . volume 52627 6
9 2.57931083776e+12 . height 52627 6
9 3.85200141435e+13 . volume 52627 6
10 4.31133923738e+12 . height 52627 6
10 5.23606717481e+13 . volume 52627 6
11 3.88095279104e+12 . height 52627 6
11 5.30650449674e+13 . volume 52627 6
12 5.8529153024e+11 . height 52627 6
12 9.19444074086e+12 . volume 52627 6
13 6.75667142246e+12 . height 52627 6
13 7.76558898708e+13 . volume 52627 6
14 7.34563926016e+12 . height 52627 6
14 9.19674058179e+13 . volume 52627 6
15 4.02181508301e+12 . height 52627 6
15 5.11027847004e+13 . volume 52627 6
16 1.92684752896e+12 . height 52627 6
16 2.33683134874e+13 . volume 52627 6
17 5.11533226394e+12 . height 52627 6
17 5.11660026102e+13 . volume 52627 6
18 5.41808866099e+12 . height 52627 6
18 6.41848203674e+13 . volume 52627 6
19 9.68698940621e+12 . height 52627 6
19 1.14403901178e+14 . volume 52627 6
20 4.3958313943e+12 . height 52627 6
20 5.2809519956e+13 . volume 52627 6
21 3.77033955738e+12 . height 52627 6
21 4.32074692362e+13 . volume 52627 6
22 1.41448157594e+12 . height 52627 6
22 2.53279772221e+13 . volume 52627 6
23 4.91796824064e+12 . height 52627 6
23 5.85472909312e+13 . volume 52627 6
24 5.09241458688e+12 . height 52627 6
24 6.66671818998e+13 . volume 52627 6
25 3.83756428902e+12 . height 52627 6
25 4.89301194342e+13 . volume 52627 6
26 4.63927561421e+12 . height 52627 6
26 5.46104242831e+13 . volume 52627 6
27 5.58159101952e+12 . height 52627 6
27 7.69997024952e+13 . volume 52627 6
28 5.12463627878e+12 . height 52627 6
28 6.60958942986e+13 . volume 52627 6
29 4.29500085043e+12 . height 52627 6
29 5.20835534029e+13 . volume 52627 6
30 3.51915317658e+12 . height 52627 6
30 3.65287352238e+13 . volume 52627 6
31 4.38795658854e+12 . height 52627 6
31 6.09284537713e+13 . volume 52627 6
32 4.03338428416e+12 . height 52627 6
32 5.10473160622e+13 . volume 52627 6
33 5.9429748736e+11 . height 52627 6
33 7.57115591066e+12 . volume 52627 6
34 1.5498739712e+12 . height 52627 6
34 2.01978884137e+13 . volume 52627 6
35 1.93319324877e+12 . height 52627 6
35 2.59596834898e+13 . volume 52627 6
36 3.61239642112e+11 . height 52627 6
36 5.53031607091e+12 . volume 52627 6
37 5.11533226394e+12 . height 52627 6
37 5.11660026102e+13 . volume 52627 6
38 3.5977452585e+12 . height 52627 6
38 4.31937601618e+13 . volume 52627 6
39 1.77621876736e+11 . height 52627 6
39 3.14060340838e+12 . volume 52627 6
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 8.295 . 14.9275631028 . . . . . . . . . . . 52627 6
1 2 177.955 . 18.6733863651 . . . . . . . . . . . 52627 6
1 3 120.228 . 31.2640921137 . . . . . . . . . . . 52627 6
2 1 8.344 . 21.0835247235 . . . . . . . . . . . 52627 6
2 2 176.860 . 20.2320827421 . . . . . . . . . . . 52627 6
2 3 120.779 . 32.3890911068 . . . . . . . . . . . 52627 6
3 1 8.272 . 23.9746741152 . . . . . . . . . . . 52627 6
3 2 176.106 . 20.8277353812 . . . . . . . . . . . 52627 6
3 3 125.713 . 32.3235163290 . . . . . . . . . . . 52627 6
4 1 8.207 . 19.0020591307 . . . . . . . . . . . 52627 6
4 2 177.344 . 19.6480692150 . . . . . . . . . . . 52627 6
4 3 123.029 . 31.9007220433 . . . . . . . . . . . 52627 6
5 1 7.978 . 24.4408213393 . . . . . . . . . . . 52627 6
5 2 179.460 . 18.4041728624 . . . . . . . . . . . 52627 6
5 3 119.657 . 31.9397380607 . . . . . . . . . . . 52627 6
6 1 8.565 . 26.8624221547 . . . . . . . . . . . 52627 6
6 2 177.046 . 27.4163498923 . . . . . . . . . . . 52627 6
6 3 112.544 . 31.7315040021 . . . . . . . . . . . 52627 6
7 1 8.338 . 25.2338223153 . . . . . . . . . . . 52627 6
7 2 177.289 . 41.1224669085 . . . . . . . . . . . 52627 6
7 3 109.001 . 30.9429345533 . . . . . . . . . . . 52627 6
8 1 8.300 . 19.9314381340 . . . . . . . . . . . 52627 6
8 2 176.472 . 18.4063277850 . . . . . . . . . . . 52627 6
8 3 123.561 . 31.3191046982 . . . . . . . . . . . 52627 6
9 1 8.298 . 19.7148853757 . . . . . . . . . . . 52627 6
9 2 176.878 . 19.2871892716 . . . . . . . . . . . 52627 6
9 3 121.821 . 31.0763693328 . . . . . . . . . . . 52627 6
10 1 8.217 . 21.7571544334 . . . . . . . . . . . 52627 6
10 2 179.605 . 17.6092130825 . . . . . . . . . . . 52627 6
10 3 122.817 . 33.3964289389 . . . . . . . . . . . 52627 6
11 1 7.999 . 21.3723157244 . . . . . . . . . . . 52627 6
11 2 178.340 . 22.3831930488 . . . . . . . . . . . 52627 6
11 3 121.345 . 31.7519595427 . . . . . . . . . . . 52627 6
12 1 8.138 . 23.8405636561 . . . . . . . . . . . 52627 6
12 2 178.941 . 31.3888462721 . . . . . . . . . . . 52627 6
12 3 119.903 . 31.8430340747 . . . . . . . . . . . 52627 6
13 1 8.268 . 21.3634074210 . . . . . . . . . . . 52627 6
13 2 175.733 . 17.1471445554 . . . . . . . . . . . 52627 6
13 3 122.249 . 31.6684652655 . . . . . . . . . . . 52627 6
14 1 8.446 . 21.7837173745 . . . . . . . . . . . 52627 6
14 2 175.937 . 19.4639688269 . . . . . . . . . . . 52627 6
14 3 127.831 . 32.0932939578 . . . . . . . . . . . 52627 6
15 1 8.405 . 22.3778202299 . . . . . . . . . . . 52627 6
15 2 176.702 . 20.1264873207 . . . . . . . . . . . 52627 6
15 3 121.887 . 31.1095329476 . . . . . . . . . . . 52627 6
16 1 8.136 . 23.2973191149 . . . . . . . . . . . 52627 6
16 2 177.841 . 18.9160196785 . . . . . . . . . . . 52627 6
16 3 120.492 . 31.5158569003 . . . . . . . . . . . 52627 6
17 1 8.304 . 13.8311939021 . . . . . . . . . . . 52627 6
17 2 176.981 . 18.3596363910 . . . . . . . . . . . 52627 6
17 3 120.557 . 31.0463827366 . . . . . . . . . . . 52627 6
18 1 8.160 . 19.6518793749 . . . . . . . . . . . 52627 6
18 2 177.617 . 19.8916134153 . . . . . . . . . . . 52627 6
18 3 120.474 . 31.2332694600 . . . . . . . . . . . 52627 6
19 1 7.805 . 21.6342198458 . . . . . . . . . . . 52627 6
19 2 176.122 . 16.7435203951 . . . . . . . . . . . 52627 6
19 3 127.008 . 32.6454402754 . . . . . . . . . . . 52627 6
20 1 8.139 . 22.6486326547 . . . . . . . . . . . 52627 6
20 2 175.577 . 17.4023278677 . . . . . . . . . . . 52627 6
20 3 123.751 . 31.6110002456 . . . . . . . . . . . 52627 6
21 1 8.181 . 18.5606931871 . . . . . . . . . . . 52627 6
21 2 175.888 . 19.5524260777 . . . . . . . . . . . 52627 6
21 3 120.296 . 31.3592354590 . . . . . . . . . . . 52627 6
22 1 8.311 . 19.2451748302 . . . . . . . . . . . 52627 6
22 2 176.816 . 21.6274267132 . . . . . . . . . . . 52627 6
22 3 121.200 . 36.7989043420 . . . . . . . . . . . 52627 6
23 1 8.216 . 21.0841726002 . . . . . . . . . . . 52627 6
23 2 177.145 . 18.0394764711 . . . . . . . . . . . 52627 6
23 3 120.107 . 32.6392395155 . . . . . . . . . . . 52627 6
24 1 8.417 . 21.3221052868 . . . . . . . . . . . 52627 6
24 2 177.284 . 20.6476159068 . . . . . . . . . . . 52627 6
24 3 121.381 . 32.1864865022 . . . . . . . . . . . 52627 6
25 1 7.817 . 20.6018284608 . . . . . . . . . . . 52627 6
25 2 176.571 . 19.8895217488 . . . . . . . . . . . 52627 6
25 3 122.431 . 31.7917001433 . . . . . . . . . . . 52627 6
26 1 8.141 . 21.0075611905 . . . . . . . . . . . 52627 6
26 2 176.867 . 17.8053447700 . . . . . . . . . . . 52627 6
26 3 121.116 . 31.4653032892 . . . . . . . . . . . 52627 6
27 1 8.369 . 19.6034505980 . . . . . . . . . . . 52627 6
27 2 176.951 . 22.2846823042 . . . . . . . . . . . 52627 6
27 3 121.088 . 33.2041914475 . . . . . . . . . . . 52627 6
28 1 8.333 . 20.8702113483 . . . . . . . . . . . 52627 6
28 2 176.847 . 21.0126791832 . . . . . . . . . . . 52627 6
28 3 121.456 . 30.7456807168 . . . . . . . . . . . 52627 6
29 1 8.005 . 20.5891948668 . . . . . . . . . . . 52627 6
29 2 176.946 . 19.3797623822 . . . . . . . . . . . 52627 6
29 3 120.337 . 31.1975976726 . . . . . . . . . . . 52627 6
30 1 8.355 . 14.3580795588 . . . . . . . . . . . 52627 6
30 2 177.422 . 17.9490962366 . . . . . . . . . . . 52627 6
30 3 121.335 . 31.2984819462 . . . . . . . . . . . 52627 6
31 1 8.381 . 31.6431036922 . . . . . . . . . . . 52627 6
31 2 176.899 . 23.4635050566 . . . . . . . . . . . 52627 6
31 3 120.942 . 32.6764162064 . . . . . . . . . . . 52627 6
32 1 8.036 . 21.3855971950 . . . . . . . . . . . 52627 6
32 2 177.145 . 21.2243423378 . . . . . . . . . . . 52627 6
32 3 121.574 . 31.7427629100 . . . . . . . . . . . 52627 6
33 1 8.261 . 22.0062629916 . . . . . . . . . . . 52627 6
33 2 177.522 . 22.7590520232 . . . . . . . . . . . 52627 6
33 3 114.400 . 31.2055680876 . . . . . . . . . . . 52627 6
34 1 8.227 . 19.5088606123 . . . . . . . . . . . 52627 6
34 2 177.530 . 20.7177204709 . . . . . . . . . . . 52627 6
34 3 120.407 . 32.2354794726 . . . . . . . . . . . 52627 6
35 1 7.747 . 29.6727489387 . . . . . . . . . . . 52627 6
35 2 175.877 . 21.0977627783 . . . . . . . . . . . 52627 6
35 3 121.917 . 31.5199257135 . . . . . . . . . . . 52627 6
36 1 8.343 . 21.8462374678 . . . . . . . . . . . 52627 6
36 2 177.246 . 34.4331825133 . . . . . . . . . . . 52627 6
36 3 120.393 . 31.1663848587 . . . . . . . . . . . 52627 6
37 1 8.291 . 13.8311939021 . . . . . . . . . . . 52627 6
37 2 176.983 . 18.3596363910 . . . . . . . . . . . 52627 6
37 3 120.505 . 31.0463827366 . . . . . . . . . . . 52627 6
38 1 8.175 . 19.6970687688 . . . . . . . . . . . 52627 6
38 2 176.748 . 17.4942937203 . . . . . . . . . . . 52627 6
38 3 120.629 . 35.3116137587 . . . . . . . . . . . 52627 6
39 1 8.149 . 26.0684493638 . . . . . . . . . . . 52627 6
39 2 176.493 . 43.4669214197 . . . . . . . . . . . 52627 6
39 3 120.909 . 35.1379924813 . . . . . . . . . . . 52627 6
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 . . 8.295 . . 1 . 1 1 10 ARG H . . . . . . . . . . 49 . 52627 6
1 2 1 . . 177.955 . . 1 . 1 1 9 LEU C . . . . . . . . . . 94 . 52627 6
1 3 1 . . 120.228 . . 1 . 1 1 10 ARG N . . . . . . . . . . 50 . 52627 6
2 1 1 . . 8.344 . . 1 . 1 1 35 ASP H . . . . . . . . . . 3 . 52627 6
2 2 1 . . 176.860 . . 1 . 1 1 34 GLU C . . . . . . . . . . 142 . 52627 6
2 3 1 . . 120.779 . . 1 . 1 1 35 ASP N . . . . . . . . . . 4 . 52627 6
3 1 1 . . 8.272 . . 1 . 1 1 7 LEU H . . . . . . . . . . 7 . 52627 6
3 2 1 . . 176.106 . . 1 . 1 1 6 VAL C . . . . . . . . . . 100 . 52627 6
3 3 1 . . 125.713 . . 1 . 1 1 7 LEU N . . . . . . . . . . 8 . 52627 6
4 1 1 . . 8.207 . . 1 . 1 1 27 ARG H . . . . . . . . . . 9 . 52627 6
4 2 1 . . 177.344 . . 1 . 1 1 26 ILE C . . . . . . . . . . 103 . 52627 6
4 3 1 . . 123.029 . . 1 . 1 1 27 ARG N . . . . . . . . . . 10 . 52627 6
5 1 1 . . 7.978 . . 1 . 1 1 12 ILE H . . . . . . . . . . 11 . 52627 6
5 2 1 . . 179.460 . . 1 . 1 1 11 GLY C . . . . . . . . . . 92 . 52627 6
5 3 1 . . 119.657 . . 1 . 1 1 12 ILE N . . . . . . . . . . 12 . 52627 6
6 1 1 . . 8.565 . . 1 . 1 1 13 GLY H . . . . . . . . . . 37 . 52627 6
6 2 1 . . 177.046 . . 1 . 1 1 12 ILE C . . . . . . . . . . 87 . 52627 6
6 3 1 . . 112.544 . . 1 . 1 1 13 GLY N . . . . . . . . . . 38 . 52627 6
7 1 1 . . 8.338 . . 1 . 1 1 11 GLY H . . . . . . . . . . 59 . 52627 6
7 2 1 . . 177.289 . . 1 . 1 1 10 ARG C . . . . . . . . . . 75 . 52627 6
7 3 1 . . 109.001 . . 1 . 1 1 11 GLY N . . . . . . . . . . 60 . 52627 6
8 1 1 . . 8.300 . . 1 . 1 1 9 LEU H . . . . . . . . . . 39 . 52627 6
8 2 1 . . 176.472 . . 1 . 1 1 8 ASP C . . . . . . . . . . 97 . 52627 6
8 3 1 . . 123.561 . . 1 . 1 1 9 LEU N . . . . . . . . . . 40 . 52627 6
9 1 1 . . 8.298 . . 1 . 1 1 8 ASP H . . . . . . . . . . 65 . 52627 6
9 2 1 . . 176.878 . . 1 . 1 1 7 LEU C . . . . . . . . . . 81 . 52627 6
9 3 1 . . 121.821 . . 1 . 1 1 8 ASP N . . . . . . . . . . 66 . 52627 6
10 1 1 . . 8.217 . . 1 . 1 1 6 VAL H . . . . . . . . . . 41 . 52627 6
10 2 1 . . 179.605 . . 1 . 1 1 5 THR C . . . . . . . . . . 201 . 52627 6
10 3 1 . . 122.817 . . 1 . 1 1 6 VAL N . . . . . . . . . . 42 . 52627 6
11 1 1 . . 7.999 . . 1 . 1 1 26 ILE H . . . . . . . . . . 15 . 52627 6
11 2 1 . . 178.340 . . 1 . 1 1 25 LEU C . . . . . . . . . . 170 . 52627 6
11 3 1 . . 121.345 . . 1 . 1 1 26 ILE N . . . . . . . . . . 16 . 52627 6
12 1 1 . . 8.138 . . 1 . 1 1 14 GLN H . . . . . . . . . . 17 . 52627 6
12 2 1 . . 178.941 . . 1 . 1 1 13 GLY C . . . . . . . . . . 90 . 52627 6
12 3 1 . . 119.903 . . 1 . 1 1 14 GLN N . . . . . . . . . . 18 . 52627 6
13 1 1 . . 8.268 . . 1 . 1 1 15 VAL H . . . . . . . . . . 53 . 52627 6
13 2 1 . . 175.733 . . 1 . 1 1 14 GLN C . . . . . . . . . . 108 . 52627 6
13 3 1 . . 122.249 . . 1 . 1 1 15 VAL N . . . . . . . . . . 54 . 52627 6
14 1 1 . . 8.446 . . 1 . 1 1 16 LEU H . . . . . . . . . . 43 . 52627 6
14 2 1 . . 175.937 . . 1 . 1 1 15 VAL C . . . . . . . . . . 109 . 52627 6
14 3 1 . . 127.831 . . 1 . 1 1 16 LEU N . . . . . . . . . . 44 . 52627 6
15 1 1 . . 8.405 . . 1 . 1 1 43 GLU H . . . . . . . . . . 19 . 52627 6
15 2 1 . . 176.702 . . 1 . 1 1 42 GLU C . . . . . . . . . . 136 . 52627 6
15 3 1 . . 121.887 . . 1 . 1 1 43 GLU N . . . . . . . . . . 20 . 52627 6
16 1 1 . . 8.136 . . 1 . 1 1 21 MET H . . . . . . . . . . 21 . 52627 6
16 2 1 . . 177.841 . . 1 . 1 1 20 LEU C . . . . . . . . . . 177 . 52627 6
16 3 1 . . 120.492 . . 1 . 1 1 21 MET N . . . . . . . . . . 22 . 52627 6
17 1 1 . . 8.304 . . 1 . 1 1 29 GLN H . . . . . . . . . . 23 . 52627 6
17 2 1 . . 176.981 . . 1 . 1 1 28 GLN C . . . . . . . . . . 197 . 52627 6
17 3 1 . . 120.557 . . 1 . 1 1 29 GLN N . . . . . . . . . . 24 . 52627 6
18 1 1 . . 8.160 . . 1 . 1 1 40 GLU H . . . . . . . . . . 25 . 52627 6
18 1 2 . . 8.160 . . 1 . . . . . . . . . . . . . . . . 191 . 52627 6
18 2 1 . . 177.617 . . 1 . 1 1 39 LEU C . . . . . . . . . . 145 . 52627 6
18 3 1 . . 120.474 . . 1 . 1 1 40 GLU N . . . . . . . . . . 26 . 52627 6
19 1 1 . . 7.805 . . 1 . 1 1 47 LYS H . . . . . . . . . . 27 . 52627 6
19 2 1 . . 176.122 . . 1 . 1 1 46 LEU C . . . . . . . . . . 130 . 52627 6
19 3 1 . . 127.008 . . 1 . 1 1 47 LYS N . . . . . . . . . . 28 . 52627 6
20 1 1 . . 8.139 . . 1 . 1 1 46 LEU H . . . . . . . . . . 33 . 52627 6
20 2 1 . . 175.577 . . 1 . 1 1 45 PHE C . . . . . . . . . . 133 . 52627 6
20 3 1 . . 123.751 . . 1 . 1 1 46 LEU N . . . . . . . . . . 34 . 52627 6
21 1 1 . . 8.181 . . 1 . 1 1 45 PHE H . . . . . . . . . . 1 . 52627 6
21 2 1 . . 175.888 . . 1 . 1 1 44 ARG C . . . . . . . . . . 194 . 52627 6
21 3 1 . . 120.296 . . 1 . 1 1 45 PHE N . . . . . . . . . . 2 . 52627 6
22 1 1 . . 8.311 . . 1 . 1 1 42 GLU H . . . . . . . . . . 29 . 52627 6
22 2 1 . . 176.816 . . 1 . 1 1 41 LYS C . . . . . . . . . . 150 . 52627 6
22 3 1 . . 121.200 . . 1 . 1 1 42 GLU N . . . . . . . . . . 30 . 52627 6
23 1 1 . . 8.216 . . 1 . 1 1 32 MET H . . . . . . . . . . 35 . 52627 6
23 2 1 . . 177.145 . . 1 . 1 1 31 GLU C . . . . . . . . . . 167 . 52627 6
23 3 1 . . 120.107 . . 1 . 1 1 32 MET N . . . . . . . . . . 36 . 52627 6
24 1 1 . . 8.417 . . 1 . 1 1 34 GLU H . . . . . . . . . . 45 . 52627 6
24 2 1 . . 177.284 . . 1 . 1 1 33 GLU C . . . . . . . . . . 156 . 52627 6
24 3 1 . . 121.381 . . 1 . 1 1 34 GLU N . . . . . . . . . . 46 . 52627 6
25 1 1 . . 7.817 . . 1 . 1 1 39 LEU H . . . . . . . . . . 47 . 52627 6
25 2 1 . . 176.571 . . 1 . 1 1 38 TRP C . . . . . . . . . . 159 . 52627 6
25 3 1 . . 122.431 . . 1 . 1 1 39 LEU N . . . . . . . . . . 48 . 52627 6
26 1 1 . . 8.141 . . 1 . 1 1 41 LYS H . . . . . . . . . . 51 . 52627 6
26 2 1 . . 176.867 . . 1 . 1 1 40 GLU C . . . . . . . . . . 123 . 52627 6
26 3 1 . . 121.116 . . 1 . 1 1 41 LYS N . . . . . . . . . . 52 . 52627 6
27 1 1 . . 8.369 . . 1 . 1 1 22 GLU H . . . . . . . . . . 55 . 52627 6
27 2 1 . . 176.951 . . 1 . 1 1 21 MET C . . . . . . . . . . 118 . 52627 6
27 3 1 . . 121.088 . . 1 . 1 1 22 GLU N . . . . . . . . . . 56 . 52627 6
28 1 1 . . 8.333 . . 1 . 1 1 33 GLU H . . . . . . . . . . 57 . 52627 6
28 2 1 . . 176.847 . . 1 . 1 1 32 MET C . . . . . . . . . . 139 . 52627 6
28 3 1 . . 121.456 . . 1 . 1 1 33 GLU N . . . . . . . . . . 58 . 52627 6
29 1 1 . . 8.005 . . 1 . 1 1 38 TRP H . . . . . . . . . . 61 . 52627 6
29 2 1 . . 176.946 . . 1 . 1 1 37 ARG C . . . . . . . . . . 188 . 52627 6
29 3 1 . . 120.337 . . 1 . 1 1 38 TRP N . . . . . . . . . . 62 . 52627 6
30 1 1 . . 8.355 . . 1 . 1 1 23 GLU H . . . . . . . . . . 67 . 52627 6
30 2 1 . . 177.422 . . 1 . 1 1 22 GLU C . . . . . . . . . . 153 . 52627 6
30 3 1 . . 121.335 . . 1 . 1 1 23 GLU N . . . . . . . . . . 68 . 52627 6
31 1 1 . . 8.381 . . 1 . 1 1 31 GLU H . . . . . . . . . . 69 . 52627 6
31 2 1 . . 176.899 . . 1 . 1 1 30 GLN C . . . . . . . . . . 180 . 52627 6
31 3 1 . . 120.942 . . 1 . 1 1 31 GLU N . . . . . . . . . . 70 . 52627 6
32 1 1 . . 8.036 . . 1 . 1 1 25 LEU H . . . . . . . . . . 71 . 52627 6
32 2 1 . . 177.145 . . 1 . 1 1 24 ARG C . . . . . . . . . . 174 . 52627 6
32 3 1 . . 121.574 . . 1 . 1 1 25 LEU N . . . . . . . . . . 72 . 52627 6
33 1 1 . . 8.261 . . 1 . 1 1 18 THR H . . . . . . . . . . 5 . 52627 6
33 2 1 . . 177.522 . . 1 . 1 1 17 PRO C . . . . . . . . . . 199 . 52627 6
33 3 1 . . 114.400 . . 1 . 1 1 18 THR N . . . . . . . . . . 6 . 52627 6
34 1 1 . . 8.227 . . 1 . 1 1 24 ARG H . . . . . . . . . . 73 . 52627 6
34 2 1 . . 177.530 . . 1 . 1 1 23 GLU C . . . . . . . . . . 162 . 52627 6
34 3 1 . . 120.407 . . 1 . 1 1 24 ARG N . . . . . . . . . . 74 . 52627 6
35 1 1 . . 7.747 . . 1 . 1 1 20 LEU H . . . . . . . . . . 63 . 52627 6
35 2 1 . . 175.877 . . 1 . 1 1 19 HIS C . . . . . . . . . . 200 . 52627 6
35 3 1 . . 121.917 . . 1 . 1 1 20 LEU N . . . . . . . . . . 64 . 52627 6
36 1 1 . . 8.343 . . 1 . 1 1 30 GLN H . . . . . . . . . . 31 . 52627 6
36 2 1 . . 177.246 . . 1 . 1 1 29 GLN C . . . . . . . . . . 121 . 52627 6
36 3 1 . . 120.393 . . 1 . 1 1 30 GLN N . . . . . . . . . . 32 . 52627 6
37 1 1 . . 8.291 . . 1 . 1 1 36 GLN H . . . . . . . . . . 183 . 52627 6
37 2 1 . . 176.983 . . 1 . 1 1 35 ASP C . . . . . . . . . . 78 . 52627 6
37 3 1 . . 120.505 . . 1 . 1 1 36 GLN N . . . . . . . . . . 184 . 52627 6
38 1 1 . . 8.175 . . 1 . 1 1 37 ARG H . . . . . . . . . . 13 . 52627 6
38 2 1 . . 176.748 . . 1 . 1 1 36 GLN C . . . . . . . . . . 187 . 52627 6
38 3 1 . . 120.629 . . 1 . 1 1 37 ARG N . . . . . . . . . . 14 . 52627 6
39 1 1 . . 8.149 . . 1 . 1 1 44 ARG H . . . . . . . . . . 192 . 52627 6
39 2 1 . . 176.493 . . 1 . 1 1 43 GLU C . . . . . . . . . . 115 . 52627 6
39 3 1 . . 120.909 . . 1 . 1 1 44 ARG N . . . . . . . . . . 193 . 52627 6
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