Content for NMR-STAR saveframe, "peak_list_1_2_3"
save_peak_list_1_2_3
_Spectral_peak_list.Sf_category spectral_peak_list
_Spectral_peak_list.Sf_framecode peak_list_1_2_3
_Spectral_peak_list.Entry_ID 17701
_Spectral_peak_list.ID 3
_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.Experiment_ID 2
_Spectral_peak_list.Experiment_name '3D 1H-13C NOESY'
_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 'New 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 . . 14367.8160920 . . . . . . . 17701 3
2 . . C 13 13C . . 18115.9420290 . . . . . . . 17701 3
3 . . H 1 1H . . 10799.1360691 . . . . . . . 17701 3
stop_
loop_
_Peak.ID
_Peak.Figure_of_merit
_Peak.Restraint
_Peak.Details
_Peak.Entry_ID
_Peak.Spectral_peak_list_ID
1 1.0 . . 17701 3
2 1.0 . . 17701 3
3 1.0 . . 17701 3
4 1.0 . . 17701 3
5 1.0 . . 17701 3
6 1.0 . . 17701 3
7 1.0 . . 17701 3
8 1.0 . . 17701 3
9 1.0 . . 17701 3
10 1.0 . . 17701 3
11 1.0 . . 17701 3
12 1.0 . . 17701 3
13 1.0 . . 17701 3
14 1.0 . . 17701 3
15 1.0 . . 17701 3
16 1.0 . . 17701 3
17 1.0 . . 17701 3
18 1.0 . . 17701 3
19 1.0 . . 17701 3
20 1.0 . . 17701 3
21 1.0 . . 17701 3
22 1.0 . . 17701 3
23 1.0 . . 17701 3
24 1.0 . . 17701 3
25 1.0 . . 17701 3
26 1.0 . . 17701 3
27 1.0 . . 17701 3
28 1.0 . . 17701 3
29 1.0 . . 17701 3
30 1.0 . . 17701 3
31 1.0 . . 17701 3
32 1.0 . . 17701 3
33 1.0 . . 17701 3
34 1.0 . . 17701 3
35 1.0 . . 17701 3
36 1.0 . . 17701 3
37 1.0 . . 17701 3
38 1.0 . . 17701 3
39 1.0 . . 17701 3
40 1.0 . . 17701 3
41 1.0 . . 17701 3
42 1.0 . . 17701 3
43 1.0 . . 17701 3
44 1.0 . . 17701 3
45 1.0 . . 17701 3
46 1.0 . . 17701 3
47 1.0 . . 17701 3
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 299937.0 . height 17701 3
1 2426397.0 . volume 17701 3
2 141963.0 . height 17701 3
2 1253708.0 . volume 17701 3
3 124170.0 . height 17701 3
3 1658097.0 . volume 17701 3
4 94984.0 . height 17701 3
4 777805.0 . volume 17701 3
5 292480.0 . height 17701 3
5 3431653.0 . volume 17701 3
6 657798.0 . height 17701 3
6 7058003.0 . volume 17701 3
7 105995.0 . height 17701 3
7 1861085.0 . volume 17701 3
8 90446.0 . height 17701 3
8 2082511.0 . volume 17701 3
9 633392.0 . height 17701 3
9 10109257.0 . volume 17701 3
10 562362.0 . height 17701 3
10 9885231.0 . volume 17701 3
11 10591.0 . height 17701 3
11 2051150.0 . volume 17701 3
12 367452.0 . height 17701 3
12 4695304.0 . volume 17701 3
13 188530.0 . height 17701 3
13 2151048.0 . volume 17701 3
14 2603858.0 . height 17701 3
14 41374725.0 . volume 17701 3
15 1477690.0 . height 17701 3
15 16486284.0 . volume 17701 3
16 904792.0 . height 17701 3
16 23157595.0 . volume 17701 3
17 144284.0 . height 17701 3
17 2075464.0 . volume 17701 3
18 126786.0 . height 17701 3
18 2282897.0 . volume 17701 3
19 153541.0 . height 17701 3
19 2520884.0 . volume 17701 3
20 218332.0 . height 17701 3
20 3543362.0 . volume 17701 3
21 186003.0 . height 17701 3
21 2273564.0 . volume 17701 3
22 398253.0 . height 17701 3
22 4004261.0 . volume 17701 3
23 538288.0 . height 17701 3
23 5655194.0 . volume 17701 3
24 1055758.0 . height 17701 3
24 9108351.0 . volume 17701 3
25 340543.0 . height 17701 3
25 4536204.0 . volume 17701 3
26 462881.0 . height 17701 3
26 5956604.0 . volume 17701 3
27 661327.0 . height 17701 3
27 7888367.0 . volume 17701 3
28 867963.0 . height 17701 3
28 11799982.0 . volume 17701 3
29 582957.0 . height 17701 3
29 10468569.0 . volume 17701 3
30 605496.0 . height 17701 3
30 9227908.0 . volume 17701 3
31 739047.0 . height 17701 3
31 13595792.0 . volume 17701 3
32 756691.0 . height 17701 3
32 15063907.0 . volume 17701 3
33 1751235.0 . height 17701 3
33 26543964.0 . volume 17701 3
34 1414758.0 . height 17701 3
34 15583108.0 . volume 17701 3
35 1505027.0 . height 17701 3
35 16788213.0 . volume 17701 3
36 1875700.0 . height 17701 3
36 18481879.0 . volume 17701 3
37 1003882.0 . height 17701 3
37 12353236.0 . volume 17701 3
38 4113514.0 . height 17701 3
38 47603674.0 . volume 17701 3
39 540905.0 . height 17701 3
39 7675675.0 . volume 17701 3
40 1823563.0 . height 17701 3
40 21455444.0 . volume 17701 3
41 1324793.0 . height 17701 3
41 13122519.0 . volume 17701 3
42 1267098.0 . height 17701 3
42 12664799.0 . volume 17701 3
43 329896.0 . height 17701 3
43 4325116.0 . volume 17701 3
44 267666.0 . height 17701 3
44 2907353.0 . volume 17701 3
45 276971.0 . height 17701 3
45 2322316.0 . volume 17701 3
46 548621.0 . height 17701 3
46 5889662.0 . volume 17701 3
47 1398573.0 . height 17701 3
47 11913332.0 . volume 17701 3
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 4.350 . 28.1674765992 . . . . . . . . . . 1 17701 3
1 2 69.170 . 157.1408432460 . . . . . . . . . . 1 17701 3
1 3 0.871 . 64.0292919480 . . . . . . . . . . 1 17701 3
2 1 2.345 . 25.7190616652 . . . . . . . . . . 1 17701 3
2 2 45.365 . 178.0656368840 . . . . . . . . . . 1 17701 3
2 3 6.202 . 65.2583963670 . . . . . . . . . . 1 17701 3
3 1 3.088 . 36.6328776568 . . . . . . . . . . 1 17701 3
3 2 25.976 . 274.1576104920 . . . . . . . . . . 1 17701 3
3 3 6.201 . 85.2687569983 . . . . . . . . . . 1 17701 3
4 1 3.213 . 82.3075058817 . . . . . . . . . . 1 17701 3
4 2 25.976 . 169.0331576530 . . . . . . . . . . 1 17701 3
4 3 6.201 . 60.4359557768 . . . . . . . . . . 1 17701 3
5 1 1.192 . 33.1764933707 . . . . . . . . . . 1 17701 3
5 2 24.335 . 237.7782610880 . . . . . . . . . . 1 17701 3
5 3 6.506 . 84.2652619529 . . . . . . . . . . 1 17701 3
6 1 0.900 . 29.3039042374 . . . . . . . . . . 1 17701 3
6 2 24.335 . 196.7374397360 . . . . . . . . . . 1 17701 3
6 3 6.503 . 67.2447887404 . . . . . . . . . . 1 17701 3
7 1 3.310 . 57.6520788259 . . . . . . . . . . 1 17701 3
7 2 28.473 . 319.1591172980 . . . . . . . . . . 1 17701 3
7 3 6.500 . 108.5219707650 . . . . . . . . . . 1 17701 3
8 1 3.805 . 62.9000280095 . . . . . . . . . . 1 17701 3
8 2 28.473 . 317.9173538650 . . . . . . . . . . 1 17701 3
8 3 6.508 . 103.6341967900 . . . . . . . . . . 1 17701 3
9 1 3.807 . 48.7704729212 . . . . . . . . . . 1 17701 3
9 2 28.473 . 308.2585939460 . . . . . . . . . . 1 17701 3
9 3 0.794 . 53.6364561538 . . . . . . . . . . 1 17701 3
10 1 3.318 . 49.8195489248 . . . . . . . . . . 1 17701 3
10 2 28.473 . 324.8366756720 . . . . . . . . . . 1 17701 3
10 3 0.793 . 58.3391725116 . . . . . . . . . . 1 17701 3
12 1 3.080 . 43.1945269135 . . . . . . . . . . 1 17701 3
12 2 25.976 . 225.7309962010 . . . . . . . . . . 1 17701 3
12 3 0.762 . 77.8110959360 . . . . . . . . . . 1 17701 3
13 1 3.211 . 50.3393767894 . . . . . . . . . . 1 17701 3
13 2 25.976 . 210.7358929040 . . . . . . . . . . 1 17701 3
13 3 0.763 . 66.7816619379 . . . . . . . . . . 1 17701 3
14 1 4.678 . 88.3784444853 . . . . . . . . . . 1 17701 3
14 2 59.569 . 299.4366746020 . . . . . . . . . . 1 17701 3
14 3 0.764 . 68.6863071203 . . . . . . . . . . 1 17701 3
15 1 0.605 . 24.6562834444 . . . . . . . . . . 1 17701 3
15 2 24.412 . 243.0195825690 . . . . . . . . . . 1 17701 3
15 3 6.503 . 62.9240956729 . . . . . . . . . . 1 17701 3
16 1 0.776 . 36.2809019527 . . . . . . . . . . 1 17701 3
16 2 25.585 . 425.9734482010 . . . . . . . . . . 1 17701 3
16 3 6.503 . 75.9978531246 . . . . . . . . . . 1 17701 3
17 1 3.199 . 67.9492950439 . . . . . . . . . . 1 17701 3
17 2 25.976 . 258.1809741860 . . . . . . . . . . 1 17701 3
17 3 5.192 . 78.7814415299 . . . . . . . . . . 1 17701 3
18 1 3.080 . 109.2691873680 . . . . . . . . . . 1 17701 3
18 2 25.976 . 324.6617489970 . . . . . . . . . . 1 17701 3
18 3 5.194 . 79.6159709247 . . . . . . . . . . 1 17701 3
19 1 5.189 . 45.0186345769 . . . . . . . . . . 1 17701 3
19 2 56.371 . 278.1965810320 . . . . . . . . . . 1 17701 3
19 3 3.085 . 216.1923546510 . . . . . . . . . . 1 17701 3
20 1 5.191 . 56.8016849715 . . . . . . . . . . 1 17701 3
20 2 56.371 . 314.0981214630 . . . . . . . . . . 1 17701 3
20 3 3.200 . 92.8802572625 . . . . . . . . . . 1 17701 3
21 1 3.204 . 36.5703612909 . . . . . . . . . . 1 17701 3
21 2 25.976 . 196.6532157820 . . . . . . . . . . 1 17701 3
21 3 0.610 . 72.5129768091 . . . . . . . . . . 1 17701 3
22 1 0.753 . 27.8942886440 . . . . . . . . . . 1 17701 3
22 2 17.350 . 161.6549232730 . . . . . . . . . . 1 17701 3
22 3 3.203 . 154.3206736030 . . . . . . . . . . 1 17701 3
23 1 0.754 . 20.4831019215 . . . . . . . . . . 1 17701 3
23 2 17.324 . 182.0328011030 . . . . . . . . . . 1 17701 3
23 3 3.087 . 74.1743114546 . . . . . . . . . . 1 17701 3
24 1 1.352 . 21.7171578572 . . . . . . . . . . 1 17701 3
24 2 21.159 . 174.1038716360 . . . . . . . . . . 1 17701 3
24 3 6.502 . 68.7117324277 . . . . . . . . . . 1 17701 3
25 1 3.328 . 63.6819107779 . . . . . . . . . . 1 17701 3
25 2 39.218 . 251.9915933190 . . . . . . . . . . 1 17701 3
25 3 0.496 . 68.2653412706 . . . . . . . . . . 1 17701 3
26 1 2.247 . 51.8123651373 . . . . . . . . . . 1 17701 3
26 2 39.218 . 241.1385809170 . . . . . . . . . . 1 17701 3
26 3 0.496 . 64.0634069175 . . . . . . . . . . 1 17701 3
27 1 0.495 . 27.4857912941 . . . . . . . . . . 1 17701 3
27 2 24.965 . 226.4674159060 . . . . . . . . . . 1 17701 3
27 3 3.329 . 84.9436992703 . . . . . . . . . . 1 17701 3
28 1 0.497 . 27.3496255107 . . . . . . . . . . 1 17701 3
28 2 24.965 . 283.9902172920 . . . . . . . . . . 1 17701 3
28 3 2.254 . 195.0996483380 . . . . . . . . . . 1 17701 3
29 1 4.190 . 53.4617695315 . . . . . . . . . . 1 17701 3
29 2 44.547 . 321.3289639220 . . . . . . . . . . 1 17701 3
29 3 0.630 . 65.6623047320 . . . . . . . . . . 1 17701 3
30 1 3.485 . 48.1230431590 . . . . . . . . . . 1 17701 3
30 2 44.547 . 301.1492283450 . . . . . . . . . . 1 17701 3
30 3 0.626 . 51.3526842352 . . . . . . . . . . 1 17701 3
31 1 0.630 . 52.3690177106 . . . . . . . . . . 1 17701 3
31 2 18.850 . 538.5959925860 . . . . . . . . . . 1 17701 3
31 3 3.485 . 76.1343130025 . . . . . . . . . . 1 17701 3
32 1 0.630 . 37.8386727695 . . . . . . . . . . 1 17701 3
32 2 18.850 . 330.4192121480 . . . . . . . . . . 1 17701 3
32 3 4.194 . 76.6202903978 . . . . . . . . . . 1 17701 3
33 1 0.909 . 24.8772316966 . . . . . . . . . . 1 17701 3
33 2 20.284 . 725.5969272140 . . . . . . . . . . 1 17701 3
33 3 1.263 . 61.9959110318 . . . . . . . . . . 1 17701 3
34 1 1.259 . 25.4775600872 . . . . . . . . . . 1 17701 3
34 2 22.077 . 186.7666192680 . . . . . . . . . . 1 17701 3
34 3 1.899 . 703.3566934240 . . . . . . . . . . 1 17701 3
35 1 0.759 . 25.0938980059 . . . . . . . . . . 1 17701 3
35 2 17.307 . 196.6434976330 . . . . . . . . . . 1 17701 3
35 3 4.678 . 59.3568284877 . . . . . . . . . . 1 17701 3
36 1 0.655 . 27.0567406183 . . . . . . . . . . 1 17701 3
36 2 17.824 . 184.2517783680 . . . . . . . . . . 1 17701 3
36 3 -0.256 . 68.2582608052 . . . . . . . . . . 1 17701 3
37 1 -0.250 . 29.5051555524 . . . . . . . . . . 1 17701 3
37 2 8.316 . 277.0255441250 . . . . . . . . . . 1 17701 3
37 3 0.657 . 70.1571128796 . . . . . . . . . . 1 17701 3
38 1 -0.250 . 29.6627310501 . . . . . . . . . . 1 17701 3
38 2 8.327 . 275.8626056750 . . . . . . . . . . 1 17701 3
38 3 0.779 . 57.2790337433 . . . . . . . . . . 1 17701 3
40 1 0.495 . 24.6511451129 . . . . . . . . . . 1 17701 3
40 2 26.150 . 215.7558565550 . . . . . . . . . . 1 17701 3
40 3 1.766 . 108.9715803160 . . . . . . . . . . 1 17701 3
41 1 0.496 . 22.3346140193 . . . . . . . . . . 1 17701 3
41 2 26.162 . 196.8249030740 . . . . . . . . . . 1 17701 3
41 3 -0.247 . 141.7412613690 . . . . . . . . . . 1 17701 3
42 1 0.495 . 20.1302698289 . . . . . . . . . . 1 17701 3
42 2 26.166 . 204.4763254080 . . . . . . . . . . 1 17701 3
42 3 -0.167 . 143.8634699420 . . . . . . . . . . 1 17701 3
43 1 -0.170 . 42.5830654714 . . . . . . . . . . 1 17701 3
43 2 25.011 . 214.3640017160 . . . . . . . . . . 1 17701 3
43 3 0.494 . 109.9860178990 . . . . . . . . . . 1 17701 3
44 1 4.393 . 45.6138246361 . . . . . . . . . . 1 17701 3
44 2 44.844 . 217.9915706320 . . . . . . . . . . 1 17701 3
44 3 12.373 . 75.2466801176 . . . . . . . . . . 1 17701 3
45 1 3.961 . 41.1820137638 . . . . . . . . . . 1 17701 3
45 2 44.926 . 161.0469990880 . . . . . . . . . . 1 17701 3
45 3 12.383 . 65.1113157911 . . . . . . . . . . 1 17701 3
46 1 0.384 . 26.3433689359 . . . . . . . . . . 1 17701 3
46 2 17.989 . 201.5392849410 . . . . . . . . . . 1 17701 3
46 3 6.964 . 81.0169375483 . . . . . . . . . . 1 17701 3
47 1 0.384 . 25.0724882915 . . . . . . . . . . 1 17701 3
47 2 17.976 . 178.7307901660 . . . . . . . . . . 1 17701 3
47 3 6.841 . 55.1912619795 . . . . . . . . . . 1 17701 3
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 . . 4.350 . . 1 . 1 1 91 THR HB . . . . . . . . . . 963 . 17701 3
1 2 1 . . 69.170 . . 1 . 1 1 91 THR CB . . . . . . . . . . 462 . 17701 3
1 3 1 . . 0.871 . . 1 . 1 1 65 ILE MG . . . . . . . . . . 1127 . 17701 3
2 1 1 . . 2.345 . . 1 . 1 1 124 GLY HA2 . . . . . . . . . . 1291 . 17701 3
2 2 1 . . 45.365 . . 1 . 1 1 124 GLY CA . . . . . . . . . . 375 . 17701 3
2 3 1 . . 6.202 . . 1 . 1 1 126 HIS HD2 . . . . . . . . . . 1889 . 17701 3
3 1 1 . . 3.088 . . 1 . 1 1 142 CYS HB2 . . . . . . . . . . 1628 . 17701 3
3 2 1 . . 25.976 . . 1 . 1 1 142 CYS CB . . . . . . . . . . 308 . 17701 3
3 3 1 . . 6.201 . . 1 . 1 1 126 HIS HD2 . . . . . . . . . . 1889 . 17701 3
4 1 1 . . 3.213 . . 1 . 1 1 142 CYS HB3 . . . . . . . . . . 1629 . 17701 3
4 2 1 . . 25.976 . . 1 . 1 1 142 CYS CB . . . . . . . . . . 308 . 17701 3
4 3 1 . . 6.201 . . 1 . 1 1 126 HIS HD2 . . . . . . . . . . 1889 . 17701 3
5 1 1 . . 1.192 . . 1 . 1 1 120 LYS HG2 . . . . . . . . . . 1513 . 17701 3
5 2 1 . . 24.335 . . 1 . 1 1 120 LYS CG . . . . . . . . . . 1514 . 17701 3
5 3 1 . . 6.506 . . 1 . 1 1 123 TYR QE . . . . . . . . . . 1822 . 17701 3
6 1 1 . . 0.900 . . 1 . 1 1 120 LYS HG3 . . . . . . . . . . 1515 . 17701 3
6 2 1 . . 24.335 . . 1 . 1 1 120 LYS CG . . . . . . . . . . 1514 . 17701 3
6 3 1 . . 6.503 . . 1 . 1 1 123 TYR QE . . . . . . . . . . 1822 . 17701 3
7 1 1 . . 3.310 . . 1 . 1 1 122 HIS HB3 . . . . . . . . . . 1622 . 17701 3
7 2 1 . . 28.473 . . 1 . 1 1 122 HIS CB . . . . . . . . . . 653 . 17701 3
7 3 1 . . 6.500 . . 1 . 1 1 123 TYR QE . . . . . . . . . . 1822 . 17701 3
8 1 1 . . 3.805 . . 1 . 1 1 122 HIS HB2 . . . . . . . . . . 1621 . 17701 3
8 2 1 . . 28.473 . . 1 . 1 1 122 HIS CB . . . . . . . . . . 653 . 17701 3
8 3 1 . . 6.508 . . 1 . 1 1 123 TYR QE . . . . . . . . . . 1822 . 17701 3
9 1 1 . . 3.807 . . 1 . 1 1 122 HIS HB2 . . . . . . . . . . 1621 . 17701 3
9 2 1 . . 28.473 . . 1 . 1 1 122 HIS CB . . . . . . . . . . 653 . 17701 3
9 3 1 . . 0.794 . . 1 . 1 1 89 ILE MD . . . . . . . . . . 1171 . 17701 3
10 1 1 . . 3.318 . . 1 . 1 1 122 HIS HB3 . . . . . . . . . . 1622 . 17701 3
10 2 1 . . 28.473 . . 1 . 1 1 122 HIS CB . . . . . . . . . . 653 . 17701 3
10 3 1 . . 0.793 . . 1 . 1 1 89 ILE MD . . . . . . . . . . 1171 . 17701 3
12 1 1 . . 3.080 . . 1 . 1 1 142 CYS HB2 . . . . . . . . . . 1628 . 17701 3
12 2 1 . . 25.976 . . 1 . 1 1 142 CYS CB . . . . . . . . . . 308 . 17701 3
12 3 3 . . 0.762 . . 1 . 1 1 89 ILE MG . . . . . . . . . . 1111 . 17701 3
13 1 1 . . 3.211 . . 1 . 1 1 142 CYS HB3 . . . . . . . . . . 1629 . 17701 3
13 2 1 . . 25.976 . . 1 . 1 1 142 CYS CB . . . . . . . . . . 308 . 17701 3
13 3 2 . . 0.763 . . 1 . 1 1 90 LEU MD2 . . . . . . . . . . 1279 . 17701 3
14 1 1 . . 4.678 . . 1 . 1 1 142 CYS HA . . . . . . . . . . 1627 . 17701 3
14 2 1 . . 59.569 . . 1 . 1 1 142 CYS CA . . . . . . . . . . 1626 . 17701 3
14 3 3 . . 0.764 . . 1 . 1 1 89 ILE MG . . . . . . . . . . 1111 . 17701 3
15 1 1 . . 0.605 . . 1 . 1 1 90 LEU MD1 . . . . . . . . . . 1278 . 17701 3
15 2 1 . . 24.412 . . 1 . 1 1 90 LEU CD1 . . . . . . . . . . 1281 . 17701 3
15 3 1 . . 6.503 . . 1 . 1 1 123 TYR QE . . . . . . . . . . 1822 . 17701 3
16 1 1 . . 0.776 . . 1 . 1 1 90 LEU MD2 . . . . . . . . . . 1279 . 17701 3
16 2 1 . . 25.585 . . 1 . 1 1 90 LEU CD2 . . . . . . . . . . 1280 . 17701 3
16 3 1 . . 6.503 . . 1 . 1 1 123 TYR QE . . . . . . . . . . 1822 . 17701 3
17 1 1 . . 3.199 . . 1 . 1 1 142 CYS HB3 . . . . . . . . . . 1629 . 17701 3
17 2 1 . . 25.976 . . 1 . 1 1 142 CYS CB . . . . . . . . . . 308 . 17701 3
17 3 1 . . 5.192 . . 1 . 1 1 123 TYR HA . . . . . . . . . . 1639 . 17701 3
18 1 1 . . 3.080 . . 1 . 1 1 142 CYS HB2 . . . . . . . . . . 1628 . 17701 3
18 2 1 . . 25.976 . . 1 . 1 1 142 CYS CB . . . . . . . . . . 308 . 17701 3
18 3 1 . . 5.194 . . 1 . 1 1 123 TYR HA . . . . . . . . . . 1639 . 17701 3
19 1 1 . . 5.189 . . 1 . 1 1 123 TYR HA . . . . . . . . . . 1639 . 17701 3
19 2 1 . . 56.371 . . 1 . 1 1 123 TYR CA . . . . . . . . . . 651 . 17701 3
19 3 1 . . 3.085 . . 1 . 1 1 142 CYS HB2 . . . . . . . . . . 1628 . 17701 3
20 1 1 . . 5.191 . . 1 . 1 1 123 TYR HA . . . . . . . . . . 1639 . 17701 3
20 2 1 . . 56.371 . . 1 . 1 1 123 TYR CA . . . . . . . . . . 651 . 17701 3
20 3 1 . . 3.200 . . 1 . 1 1 142 CYS HB3 . . . . . . . . . . 1629 . 17701 3
21 1 1 . . 3.204 . . 1 . 1 1 142 CYS HB3 . . . . . . . . . . 1629 . 17701 3
21 2 1 . . 25.976 . . 1 . 1 1 142 CYS CB . . . . . . . . . . 308 . 17701 3
21 3 1 . . 0.610 . . 1 . 1 1 90 LEU MD1 . . . . . . . . . . 1278 . 17701 3
22 1 1 . . 0.753 . . 1 . 1 1 89 ILE MG . . . . . . . . . . 1111 . 17701 3
22 2 1 . . 17.350 . . 1 . 1 1 89 ILE CG2 . . . . . . . . . . 1112 . 17701 3
22 3 1 . . 3.203 . . 1 . 1 1 142 CYS HB3 . . . . . . . . . . 1629 . 17701 3
23 1 1 . . 0.754 . . 1 . 1 1 89 ILE MG . . . . . . . . . . 1111 . 17701 3
23 2 1 . . 17.324 . . 1 . 1 1 89 ILE CG2 . . . . . . . . . . 1112 . 17701 3
23 3 1 . . 3.087 . . 1 . 1 1 142 CYS HB2 . . . . . . . . . . 1628 . 17701 3
24 1 1 . . 1.352 . . 1 . 1 1 93 THR MG . . . . . . . . . . 937 . 17701 3
24 2 1 . . 21.159 . . 1 . 1 1 93 THR CG2 . . . . . . . . . . 938 . 17701 3
24 3 1 . . 6.502 . . 1 . 1 1 123 TYR QE . . . . . . . . . . 1822 . 17701 3
25 1 1 . . 3.328 . . 1 . 1 1 123 TYR HB2 . . . . . . . . . . 1640 . 17701 3
25 2 1 . . 39.218 . . 1 . 1 1 123 TYR CB . . . . . . . . . . 649 . 17701 3
25 3 1 . . 0.496 . . 1 . 1 1 118 LEU MD2 . . . . . . . . . . 1189 . 17701 3
26 1 1 . . 2.247 . . 1 . 1 1 123 TYR HB3 . . . . . . . . . . 1641 . 17701 3
26 2 1 . . 39.218 . . 1 . 1 1 123 TYR CB . . . . . . . . . . 649 . 17701 3
26 3 1 . . 0.496 . . 1 . 1 1 118 LEU MD2 . . . . . . . . . . 1189 . 17701 3
27 1 1 . . 0.495 . . 1 . 1 1 118 LEU MD2 . . . . . . . . . . 1189 . 17701 3
27 2 1 . . 24.965 . . 1 . 1 1 118 LEU CD2 . . . . . . . . . . 1190 . 17701 3
27 3 1 . . 3.329 . . 1 . 1 1 123 TYR HB2 . . . . . . . . . . 1640 . 17701 3
28 1 1 . . 0.497 . . 1 . 1 1 118 LEU MD2 . . . . . . . . . . 1189 . 17701 3
28 2 1 . . 24.965 . . 1 . 1 1 118 LEU CD2 . . . . . . . . . . 1190 . 17701 3
28 3 1 . . 2.254 . . 1 . 1 1 123 TYR HB3 . . . . . . . . . . 1641 . 17701 3
29 1 1 . . 4.190 . . 1 . 1 1 87 GLY HA3 . . . . . . . . . . 1301 . 17701 3
29 2 1 . . 44.547 . . 1 . 1 1 87 GLY CA . . . . . . . . . . 479 . 17701 3
29 3 1 . . 0.630 . . 1 . 1 1 138 VAL MG1 . . . . . . . . . . 1011 . 17701 3
30 1 1 . . 3.485 . . 1 . 1 1 87 GLY HA2 . . . . . . . . . . 1300 . 17701 3
30 2 1 . . 44.547 . . 1 . 1 1 87 GLY CA . . . . . . . . . . 479 . 17701 3
30 3 1 . . 0.626 . . 1 . 1 1 138 VAL MG1 . . . . . . . . . . 1011 . 17701 3
31 1 1 . . 0.630 . . 1 . 1 1 138 VAL MG1 . . . . . . . . . . 1011 . 17701 3
31 2 1 . . 18.850 . . 1 . 1 1 138 VAL CG1 . . . . . . . . . . 1012 . 17701 3
31 3 1 . . 3.485 . . 1 . 1 1 87 GLY HA2 . . . . . . . . . . 1300 . 17701 3
32 1 1 . . 0.630 . . 1 . 1 1 138 VAL MG1 . . . . . . . . . . 1011 . 17701 3
32 2 1 . . 18.850 . . 1 . 1 1 138 VAL CG1 . . . . . . . . . . 1012 . 17701 3
32 3 1 . . 4.194 . . 1 . 1 1 87 GLY HA3 . . . . . . . . . . 1301 . 17701 3
33 1 1 . . 0.909 . . 1 . 1 1 86 VAL MG1 . . . . . . . . . . 1016 . 17701 3
33 2 1 . . 20.284 . . 1 . 1 1 86 VAL CG1 . . . . . . . . . . 1017 . 17701 3
33 3 1 . . 1.263 . . 1 . 1 1 91 THR MG . . . . . . . . . . 951 . 17701 3
34 1 1 . . 1.259 . . 1 . 1 1 91 THR MG . . . . . . . . . . 951 . 17701 3
34 2 1 . . 22.077 . . 1 . 1 1 91 THR CG2 . . . . . . . . . . 952 . 17701 3
34 3 1 . . 1.899 . . 1 . 1 1 86 VAL HB . . . . . . . . . . 1015 . 17701 3
35 1 1 . . 0.759 . . 1 . 1 1 89 ILE MG . . . . . . . . . . 1111 . 17701 3
35 2 1 . . 17.307 . . 1 . 1 1 89 ILE CG2 . . . . . . . . . . 1112 . 17701 3
35 3 1 . . 4.678 . . 1 . 1 1 142 CYS HA . . . . . . . . . . 1627 . 17701 3
36 1 1 . . 0.655 . . 1 . 1 1 18 ILE MG . . . . . . . . . . 1166 . 17701 3
36 2 1 . . 17.824 . . 1 . 1 1 18 ILE CG2 . . . . . . . . . . 1167 . 17701 3
36 3 1 . . -0.256 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 1148 . 17701 3
37 1 1 . . -0.250 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 1148 . 17701 3
37 2 1 . . 8.316 . . 1 . 1 1 48 ILE CD1 . . . . . . . . . . 1149 . 17701 3
37 3 1 . . 0.657 . . 1 . 1 1 18 ILE MG . . . . . . . . . . 1166 . 17701 3
38 1 1 . . -0.250 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 1148 . 17701 3
38 2 1 . . 8.327 . . 1 . 1 1 48 ILE CD1 . . . . . . . . . . 1149 . 17701 3
38 3 1 . . 0.779 . . 1 . 1 1 46 ILE MD . . . . . . . . . . 1156 . 17701 3
40 1 3 . . 0.495 . . 1 . 1 1 5 LEU MD2 . . . . . . . . . . 1275 . 17701 3
40 2 1 . . 26.150 . . 1 . 1 1 5 LEU CD2 . . . . . . . . . . 1868 . 17701 3
40 3 1 . . 1.766 . . 1 . 1 1 48 ILE HB . . . . . . . . . . 1150 . 17701 3
41 1 1 . . 0.496 . . 1 . 1 1 5 LEU MD2 . . . . . . . . . . 1275 . 17701 3
41 2 1 . . 26.162 . . 1 . 1 1 5 LEU CD2 . . . . . . . . . . 1868 . 17701 3
41 3 1 . . -0.247 . . 1 . 1 1 48 ILE MD . . . . . . . . . . 1148 . 17701 3
42 1 1 . . 0.495 . . 1 . 1 1 5 LEU MD2 . . . . . . . . . . 1275 . 17701 3
42 2 1 . . 26.166 . . 1 . 1 1 5 LEU CD2 . . . . . . . . . . 1868 . 17701 3
42 3 1 . . -0.167 . . 1 . 1 1 48 ILE HG13 . . . . . . . . . . 1898 . 17701 3
43 1 1 . . -0.170 . . 1 . 1 1 48 ILE HG13 . . . . . . . . . . 1898 . 17701 3
43 2 1 . . 25.011 . . 1 . 1 1 48 ILE CG1 . . . . . . . . . . 1899 . 17701 3
43 3 1 . . 0.494 . . 1 . 1 1 5 LEU MD2 . . . . . . . . . . 1275 . 17701 3
44 1 1 . . 4.393 . . 1 . 1 1 141 GLY HA2 . . . . . . . . . . 1285 . 17701 3
44 2 1 . . 44.844 . . 1 . 1 1 141 GLY CA . . . . . . . . . . 313 . 17701 3
44 3 1 . . 12.373 . . 1 . 1 1 142 CYS H . . . . . . . . . . 1950 . 17701 3
45 1 1 . . 3.961 . . 1 . 1 1 141 GLY HA3 . . . . . . . . . . 1286 . 17701 3
45 2 1 . . 44.926 . . 1 . 1 1 141 GLY CA . . . . . . . . . . 313 . 17701 3
45 3 1 . . 12.383 . . 1 . 1 1 142 CYS H . . . . . . . . . . 1950 . 17701 3
46 1 1 . . 0.384 . . 1 . 1 1 156 ILE MG . . . . . . . . . . 1063 . 17701 3
46 2 1 . . 17.989 . . 1 . 1 1 156 ILE CG2 . . . . . . . . . . 1064 . 17701 3
46 3 1 . . 6.964 . . 1 . 1 1 59 TYR QD . . . . . . . . . . 1807 . 17701 3
47 1 1 . . 0.384 . . 1 . 1 1 156 ILE MG . . . . . . . . . . 1063 . 17701 3
47 2 1 . . 17.976 . . 1 . 1 1 156 ILE CG2 . . . . . . . . . . 1064 . 17701 3
47 3 1 . . 6.841 . . 1 . 1 1 59 TYR QE . . . . . . . . . . 1955 . 17701 3
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