NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
582397 |
4ca9   |
19541 | cing | 2-parsed | STAR | distance | general distance | ambi |
data_4ca9_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_4ca9
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project" NMR . parsed_4ca9 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_4ca9
_Entry.Title "Original constraint list(s)"
_Entry.Version_type original
_Entry.Submission_date .
_Entry.Accession_date .
_Entry.Last_release_date .
_Entry.Original_release_date .
_Entry.Origination .
_Entry.NMR_STAR_version 3.1
_Entry.Original_NMR_STAR_version .
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype .
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 4ca9 "Master copy" parsed_4ca9
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_4ca9
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 4ca9.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_4ca9 1
1 4ca9.mr . . XPLOR/CNS 2 distance "general distance" ambi 0 parsed_4ca9 1
1 4ca9.mr . . "MR format" 3 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_4ca9 1
stop_
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_4ca9
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1
;
data_/ebi/msd/pdbdeposit/deposit/autodep4Entries/EBI-58449/origFilesMod/EBI-58449.nmr
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 1
_Entry.NMR_STAR_version 3.1
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype solution
save_
save_assembly
_Assembly.Sf_category assembly
_Assembly.Sf_framecode assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name MS1
_Assembly.Number_of_components 5
_Assembly.Organic_ligands 0
_Assembly.Metal_ions 0
_Assembly.Non_standard_bonds no
_Assembly.Paramagnetic no
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 54052.132
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.PDB_chain_ID
_Entity_assembly.Experimental_data_reported
_Entity_assembly.Physical_state
_Entity_assembly.Conformational_isomer
_Entity_assembly.Chemical_exchange_state
_Entity_assembly.Magnetic_equivalence_group_code
_Entity_assembly.Role
_Entity_assembly.Details
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1 "dm fkbp39" 1 $dm_fkbp39 A . yes . . . . . . 1 1
2 "dm fkbp39" 1 $dm_fkbp39 B . yes . . . . . . 1 1
3 "dm fkbp39" 1 $dm_fkbp39 C . no . . . . . . 1 1
4 "dm fkbp39" 1 $dm_fkbp39 D . no . . . . . . 1 1
5 "dm fkbp39" 1 $dm_fkbp39 E . yes . . . . . . 1 1
stop_
save_
save_dm_fkbp39
_Entity.Sf_category entity
_Entity.Sf_framecode dm_fkbp39
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name dm_fkbp39
_Entity.Type polymer
_Entity.Polymer_type polypeptide(L)
_Entity.Polymer_strand_ID "A,B,C,D,E"
_Entity.Polymer_seq_one_letter_code
;FQGAMAMFWGLNMKPERKYS
QTIIKSFHISGVALDKGQEA
KLYLAAEKQEYIVATVTKAI
PQVALDLNFSKGDRIMFYTA
GDASVSLLGYLHDIDSGS
;
_Entity.Ambiguous_conformational_states no
_Entity.Ambiguous_chem_comp_sites no
_Entity.Nstd_monomer no
_Entity.Nstd_chirality no
_Entity.Nstd_linkage no
_Entity.Number_of_monomers 98
_Entity.Paramagnetic no
_Entity.Thiol_state "not present"
_Entity.Parent_entity_ID 1
_Entity.Formula_weight 10810.4264
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Comp_label
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
1 . PHE . 1 1
2 . GLN . 1 1
3 . GLY . 1 1
4 . ALA . 1 1
5 . MET . 1 1
6 . ALA . 1 1
7 . MET . 1 1
8 . PHE . 1 1
9 . TRP . 1 1
10 . GLY . 1 1
11 . LEU . 1 1
12 . ASN . 1 1
13 . MET . 1 1
14 . LYS . 1 1
15 . PRO . 1 1
16 . GLU . 1 1
17 . ARG . 1 1
18 . LYS . 1 1
19 . TYR . 1 1
20 . SER . 1 1
21 . GLN . 1 1
22 . THR . 1 1
23 . ILE . 1 1
24 . ILE . 1 1
25 . LYS . 1 1
26 . SER . 1 1
27 . PHE . 1 1
28 . HIS . 1 1
29 . ILE . 1 1
30 . SER . 1 1
31 . GLY . 1 1
32 . VAL . 1 1
33 . ALA . 1 1
34 . LEU . 1 1
35 . ASP . 1 1
36 . LYS . 1 1
37 . GLY . 1 1
38 . GLN . 1 1
39 . GLU . 1 1
40 . ALA . 1 1
41 . LYS . 1 1
42 . LEU . 1 1
43 . TYR . 1 1
44 . LEU . 1 1
45 . ALA . 1 1
46 . ALA . 1 1
47 . GLU . 1 1
48 . LYS . 1 1
49 . GLN . 1 1
50 . GLU . 1 1
51 . TYR . 1 1
52 . ILE . 1 1
53 . VAL . 1 1
54 . ALA . 1 1
55 . THR . 1 1
56 . VAL . 1 1
57 . THR . 1 1
58 . LYS . 1 1
59 . ALA . 1 1
60 . ILE . 1 1
61 . PRO . 1 1
62 . GLN . 1 1
63 . VAL . 1 1
64 . ALA . 1 1
65 . LEU . 1 1
66 . ASP . 1 1
67 . LEU . 1 1
68 . ASN . 1 1
69 . PHE . 1 1
70 . SER . 1 1
71 . LYS . 1 1
72 . GLY . 1 1
73 . ASP . 1 1
74 . ARG . 1 1
75 . ILE . 1 1
76 . MET . 1 1
77 . PHE . 1 1
78 . TYR . 1 1
79 . THR . 1 1
80 . ALA . 1 1
81 . GLY . 1 1
82 . ASP . 1 1
83 . ALA . 1 1
84 . SER . 1 1
85 . VAL . 1 1
86 . SER . 1 1
87 . LEU . 1 1
88 . LEU . 1 1
89 . GLY . 1 1
90 . TYR . 1 1
91 . LEU . 1 1
92 . HIS . 1 1
93 . ASP . 1 1
94 . ILE . 1 1
95 . ASP . 1 1
96 . SER . 1 1
97 . GLY . 1 1
98 . SER . 1 1
stop_
loop_
_Entity_poly_seq.Hetero
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
. PHE 1 1 1 1
. GLN 2 2 1 1
. GLY 3 3 1 1
. ALA 4 4 1 1
. MET 5 5 1 1
. ALA 6 6 1 1
. MET 7 7 1 1
. PHE 8 8 1 1
. TRP 9 9 1 1
. GLY 10 10 1 1
. LEU 11 11 1 1
. ASN 12 12 1 1
. MET 13 13 1 1
. LYS 14 14 1 1
. PRO 15 15 1 1
. GLU 16 16 1 1
. ARG 17 17 1 1
. LYS 18 18 1 1
. TYR 19 19 1 1
. SER 20 20 1 1
. GLN 21 21 1 1
. THR 22 22 1 1
. ILE 23 23 1 1
. ILE 24 24 1 1
. LYS 25 25 1 1
. SER 26 26 1 1
. PHE 27 27 1 1
. HIS 28 28 1 1
. ILE 29 29 1 1
. SER 30 30 1 1
. GLY 31 31 1 1
. VAL 32 32 1 1
. ALA 33 33 1 1
. LEU 34 34 1 1
. ASP 35 35 1 1
. LYS 36 36 1 1
. GLY 37 37 1 1
. GLN 38 38 1 1
. GLU 39 39 1 1
. ALA 40 40 1 1
. LYS 41 41 1 1
. LEU 42 42 1 1
. TYR 43 43 1 1
. LEU 44 44 1 1
. ALA 45 45 1 1
. ALA 46 46 1 1
. GLU 47 47 1 1
. LYS 48 48 1 1
. GLN 49 49 1 1
. GLU 50 50 1 1
. TYR 51 51 1 1
. ILE 52 52 1 1
. VAL 53 53 1 1
. ALA 54 54 1 1
. THR 55 55 1 1
. VAL 56 56 1 1
. THR 57 57 1 1
. LYS 58 58 1 1
. ALA 59 59 1 1
. ILE 60 60 1 1
. PRO 61 61 1 1
. GLN 62 62 1 1
. VAL 63 63 1 1
. ALA 64 64 1 1
. LEU 65 65 1 1
. ASP 66 66 1 1
. LEU 67 67 1 1
. ASN 68 68 1 1
. PHE 69 69 1 1
. SER 70 70 1 1
. LYS 71 71 1 1
. GLY 72 72 1 1
. ASP 73 73 1 1
. ARG 74 74 1 1
. ILE 75 75 1 1
. MET 76 76 1 1
. PHE 77 77 1 1
. TYR 78 78 1 1
. THR 79 79 1 1
. ALA 80 80 1 1
. GLY 81 81 1 1
. ASP 82 82 1 1
. ALA 83 83 1 1
. SER 84 84 1 1
. VAL 85 85 1 1
. SER 86 86 1 1
. LEU 87 87 1 1
. LEU 88 88 1 1
. GLY 89 89 1 1
. TYR 90 90 1 1
. LEU 91 91 1 1
. HIS 92 92 1 1
. ASP 93 93 1 1
. ILE 94 94 1 1
. ASP 95 95 1 1
. SER 96 96 1 1
. GLY 97 97 1 1
. SER 98 98 1 1
stop_
save_
save_conformer_statistics
_Conformer_stat_list.Sf_category conformer_statistics
_Conformer_stat_list.Sf_framecode conformer_statistics
_Conformer_stat_list.Entry_ID 1
_Conformer_stat_list.ID 1
save_
save_constraint_statistics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Sf_framecode constraint_statistics
_Constraint_stat_list.Entry_ID 1
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 11 1 1
2 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 109 1 1
3 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 24 1 1
4 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 3 1 1
5 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 4 1 1
6 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 8 1 1
7 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 11 1 1
8 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 311 1 1
9 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 8 1 1
10 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 240 1 1
11 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 34 1 1
12 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 111 1 1
13 "From CCPN project: 'deposit_run62'" . . . . distance "general distance" . 166 1 1
stop_
save_
save_ARIA2_REJECT_f5_run62_Dists_69|4_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_REJECT_f5_run62_Dists_69|4_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 1
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 *INACTIVE* DistanceConstraints list run51_c13_d2o_69|4 69|4, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-13C NOESY" . . . . 1 1 1
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 1
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 77 77 PHE QE H . . . 1 1 11 11 LEU MD1 H . . . . . 2.72727489036 1.79752134941 3.65702843131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
2 1 . . 1 1 78 78 TYR QE H . . . 1 1 80 80 ALA MB H . . . . . 2.53067679741 1.73013616579 3.33121742902 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
3 1 OR . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET HG2 H . . . . . 3.16758496675 1.91338565155 4.42178428196 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
3 2 OR . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET HG3 H . . . . . 3.16758496675 1.91338565155 4.42178428196 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
4 1 . . 1 1 57 57 THR H H . . . 1 1 34 34 LEU MD2 H . . . . . 2.79751297799 1.81925312024 3.77577283575 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
5 1 . . 1 1 19 19 TYR QE H . . . 1 1 17 17 ARG HG3 H . . . . . 2.68406936919 1.78354082186 3.58459791651 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
6 1 . . 1 1 83 83 ALA H H . . . 1 1 40 40 ALA HA H . . . . . 2.67773030958 1.78145035822 3.57401026093 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
7 1 . . 1 1 77 77 PHE QE H . . . 1 1 11 11 LEU MD1 H . . . . . 2.70151815942 1.78924311371 3.61379320513 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
8 1 . . 1 1 77 77 PHE QD H . . . 1 1 44 44 LEU MD1 H . . . . . 2.51753579289 1.72528748433 3.30978410146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
9 1 . . 1 1 69 69 PHE QE H . . . 1 1 67 67 LEU MD2 H . . . . . 2.16623288668 1.57966227176 2.75280350159 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
10 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HB3 H . . . . . 2.73762263657 1.80080042404 3.67444484911 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
11 1 . . 1 1 32 32 VAL MG1 H . . . 1 1 86 86 SER H H . . . . . 2.31886099622 1.64672145625 2.99100053620 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1
stop_
save_
save_ARIA2_f5_run62_Dists_69|2_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_f5_run62_Dists_69|2_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 2
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 DistanceConstraints list run51_n15_69|2 69|2, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-15N NOESY" . . . . 1 1 2
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 2
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 29 29 ILE H H . . . 1 1 68 68 ASN HA H . . . . . 2.54444277527 1.73516914569 4.78823407527 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
2 1 . . 2 1 51 51 TYR QE H . . . 1 1 12 12 ASN H H . . . . . 3.30756910844 1.94006743255 4.67507078432 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
3 1 . . 1 1 51 51 TYR H H . . . 1 1 45 45 ALA HA H . . . . . 3.72696979681 1.99068181352 5.46325778010 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
4 1 . . 1 1 60 60 ILE H H . . . 1 1 57 57 THR HG1 H . . . . . 2.85742269134 1.83681463672 3.87803074596 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
5 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 39 39 GLU H H . . . . . 3.20890003323 1.92177010532 5.50950861253 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
6 1 . . 1 1 13 13 MET ME H . . . 1 1 19 19 TYR H H . . . . . 3.22085613994 1.92411685567 4.51759542422 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
7 1 . . 1 1 85 85 VAL H H . . . 1 1 13 13 MET H H . . . . . 3.67511873145 1.98680652017 5.36343094272 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
8 1 . . 1 1 32 32 VAL HA H . . . 1 1 88 88 LEU H H . . . . . 3.66848719471 1.98626240749 5.35071198192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
9 1 . . 1 1 76 76 MET H H . . . 1 1 45 45 ALA H H . . . . . 3.55051025640 1.97474487130 5.12627564149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
10 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE HB H . . . . . 2.50553311803 1.72082109234 3.29024514373 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
11 1 . . 1 1 57 57 THR HA H . . . 1 1 60 60 ILE H H . . . . . 3.62718697586 1.98262630613 5.27174764559 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
12 1 . . 1 1 27 27 PHE QD H . . . 1 1 90 90 TYR H H . . . . . 3.33639297427 1.94495321442 5.78445451281 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
13 1 . . 1 1 87 87 LEU H H . . . 1 1 11 11 LEU H H . . . . . 4.24325733648 1.99260323353 6.49391143943 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
14 1 . . 1 1 9 9 TRP HE3 H . . . 1 1 89 89 GLY H H . . . . . 2.63171583686 1.76597480611 3.49745686760 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
15 1 . . 1 1 51 51 TYR QD H . . . 1 1 46 46 ALA H H . . . . . 3.03186922513 1.88284035034 4.18089809993 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
16 1 . . 1 1 62 62 GLN H H . . . 1 1 56 56 VAL MG1 H . . . . . 2.34133307083 1.65610300226 4.08464863608 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
17 1 . . 1 1 37 37 GLY HA3 H . . . 1 1 84 84 SER H H . . . . . 2.91860707408 1.85382366747 3.98339048068 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
18 1 . . 1 1 29 29 ILE H H . . . 1 1 69 69 PHE H H . . . . . 3.48281167830 1.96656452999 4.99905882661 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
19 1 . . 1 1 86 86 SER H H . . . 2 1 52 52 ILE MG H . . . . . 2.62906323077 1.76506654685 3.49305991469 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
20 1 . . 1 1 78 78 TYR QD H . . . 1 1 45 45 ALA H H . . . . . 3.55590913375 1.97534791281 5.13647035469 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
21 1 . . 1 1 43 43 TYR H H . . . 1 1 78 78 TYR H H . . . . . 3.44013344465 1.96081868003 4.91944820928 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
22 1 . . 1 1 9 9 TRP H H . . . 1 1 90 90 TYR HA H . . . . . 4.01015952515 1.99998709801 6.02033195229 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
23 1 . . 1 1 41 41 LYS H H . . . 1 1 80 80 ALA H H . . . . . 3.58102398967 1.97805738785 5.18399059149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
24 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL H H . . . . . 4.42366772416 1.97756320744 6.86977224088 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
25 1 OR . 1 1 36 36 LYS H H . . . 1 1 84 84 SER HB2 H . . . . . 3.33450772934 1.94464000471 4.72437545396 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
25 2 OR . 1 1 36 36 LYS H H . . . 1 1 84 84 SER HB3 H . . . . . 3.33450772934 1.94464000471 4.72437545396 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
26 1 . . 1 1 85 85 VAL HA H . . . 1 1 35 35 ASP H H . . . . . 3.41678313832 1.95748226153 4.87608401511 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
27 1 . . 1 1 69 69 PHE QE H . . . 1 1 29 29 ILE H H . . . . . 3.32968276172 1.94383435001 4.71553117342 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
28 1 . . 1 1 77 77 PHE HA H . . . 1 1 45 45 ALA H H . . . . . 4.12368914947 1.99808762429 6.24929067466 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
29 1 . . 1 1 63 63 VAL H H . . . 1 1 33 33 ALA MB H . . . . . 2.74785173069 1.80401558896 3.69168787243 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
30 1 . . 1 1 83 83 ALA HA H . . . 1 1 38 38 GLN H H . . . . . 2.76609708392 1.80968544921 3.72250871864 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
31 1 . . 1 1 84 84 SER H H . . . 1 1 37 37 GLY H H . . . . . 3.83178306155 1.99646288270 5.66710324041 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
32 1 . . 1 1 67 67 LEU H H . . . 1 1 28 28 HIS HE1 H . . . . . 3.43405322110 1.95996303043 4.90814341178 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
33 1 OR . 1 1 44 44 LEU MD1 H . . . 1 1 78 78 TYR H H . . . . . 3.32218517118 1.94257088223 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
33 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 78 78 TYR H H . . . . . 3.32218517118 1.94257088223 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
34 1 . . 1 1 51 51 TYR H H . . . 1 1 44 44 LEU MD1 H . . . . . 4.10394164849 1.99864951671 6.20923378027 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
35 1 . . 1 1 83 83 ALA MB H . . . 1 1 37 37 GLY H H . . . . . 2.75662451191 1.80675217445 4.75624110425 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
36 1 . . 1 1 79 79 THR HB H . . . 1 1 41 41 LYS H H . . . . . 3.51793932773 1.97095218853 5.06492646693 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
37 1 . . 1 1 29 29 ILE H H . . . 1 1 69 69 PHE H H . . . . . 4.27256964666 1.99071322346 6.55442606986 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
38 1 . . 1 1 89 89 GLY H H . . . 1 1 9 9 TRP H H . . . . . 3.57507580401 1.97742992846 5.17272167956 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
39 1 . . 1 1 42 42 LEU MD2 H . . . 1 1 54 54 ALA H H . . . . . 2.65184638180 1.77281022772 3.53088253589 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
40 1 OR . 1 1 83 83 ALA H H . . . 1 1 81 81 GLY HA2 H . . . . . 2.37894050980 1.67152076615 4.35149793706 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
40 2 OR . 1 1 83 83 ALA H H . . . 1 1 40 40 ALA HA H . . . . . 2.37894050980 1.67152076615 4.35149793706 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
41 1 OR . 1 1 43 43 TYR QD H . . . 1 1 80 80 ALA H H . . . . . 2.87985195215 1.84315854386 3.91654536044 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
41 2 OR . 1 1 43 43 TYR QE H . . . 1 1 80 80 ALA H H . . . . . 2.87985195215 1.84315854386 3.91654536044 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
42 1 . . 1 1 46 46 ALA H H . . . 1 1 49 49 GLN H H . . . . . 3.11317237907 1.90169209635 4.32465266180 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
43 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 21 21 GLN HE22 H . . . . . 2.39688585224 1.67875312865 3.11501857582 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
44 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 35 35 ASP H H . . . . . 3.06743394956 1.89129007020 4.24357782893 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
45 1 . . 1 1 76 76 MET H H . . . 1 1 45 45 ALA H H . . . . . 3.28618172498 1.93630793378 4.63605551618 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
46 1 . . 1 1 19 19 TYR QE H . . . 1 1 13 13 MET H H . . . . . 3.67019752016 1.98640379054 5.35399124978 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
47 1 OR . 1 1 64 64 ALA MB H . . . 1 1 32 32 VAL H H . . . . . 2.98035178339 1.87003968930 4.09066387749 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
47 2 OR . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL HB H . . . . . 2.98035178339 1.87003968930 4.09066387749 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
48 1 OR . 1 1 40 40 ALA H H . . . 1 1 56 56 VAL MG1 H . . . . . 2.66453568908 1.77706688428 3.55200449387 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
48 2 OR . 1 1 40 40 ALA H H . . . 1 1 56 56 VAL MG2 H . . . . . 2.66453568908 1.77706688428 3.55200449387 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
49 1 . . 1 1 83 83 ALA H H . . . 1 1 38 38 GLN HB2 H . . . . . 3.34335606115 1.94610234220 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
50 1 . . 1 1 85 85 VAL H H . . . 1 1 13 13 MET H H . . . . . 3.13152692256 1.90571931422 4.35733453089 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
51 1 . . 1 1 23 23 ILE MD H . . . 1 1 73 73 ASP H H . . . . . 2.81467620780 1.82437593846 3.80497647715 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
52 1 . . 1 1 78 78 TYR QE H . . . 1 1 45 45 ALA H H . . . . . 3.48924070331 1.96739061761 5.01109078902 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
53 1 . . 1 1 51 51 TYR H H . . . 1 1 44 44 LEU H H . . . . . 4.00983033002 1.99998792058 6.01967273946 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
54 1 . . 1 1 19 19 TYR QD H . . . 1 1 21 21 GLN HE22 H . . . . . 3.28786768696 1.93660844609 4.63912692783 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
55 1 . . 1 1 46 46 ALA MB H . . . 1 1 49 49 GLN H H . . . . . 3.07042542165 1.89198638791 5.29461403037 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
56 1 . . 1 1 9 9 TRP HZ3 H . . . 1 1 89 89 GLY H H . . . . . 4.07638935736 1.99927058326 6.15350813145 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
57 1 . . 1 1 35 35 ASP H H . . . 2 1 52 52 ILE MG H . . . . . 3.34456780626 1.94630107993 4.74283453260 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
58 1 . . 1 1 32 32 VAL H H . . . 1 1 65 65 LEU H H . . . . . 3.23483052122 1.92681445859 5.62278956103 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
59 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE MG H . . . . . 2.20280972747 1.59626339054 4.00842717824 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
60 1 . . 1 1 62 62 GLN HE21 H . . . 2 1 60 60 ILE MG H . . . . . 2.74191383081 1.80215239886 3.68167526276 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
61 1 . . 1 1 76 76 MET HA H . . . 1 1 21 21 GLN H H . . . . . 2.41958440897 1.68778581995 3.15138299799 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
62 1 . . 1 1 36 36 LYS H H . . . 1 1 84 84 SER H H . . . . . 3.39634267584 1.95444972937 4.83823562231 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
63 1 . . 1 1 29 29 ILE H H . . . 1 1 67 67 LEU H H . . . . . 3.42753387971 1.95903531764 4.89603244177 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
64 1 . . 1 1 37 37 GLY HA2 H . . . 1 1 84 84 SER H H . . . . . 3.24149945725 1.92808461583 4.55491429867 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
65 1 OR . 1 1 62 62 GLN HE22 H . . . 2 1 60 60 ILE MD H . . . . . 3.00669646165 1.87666851009 4.13672441321 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
65 2 OR . 1 1 62 62 GLN HE22 H . . . 2 1 60 60 ILE MG H . . . . . 3.00669646165 1.87666851009 4.13672441321 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
66 1 . . 1 1 39 39 GLU H H . . . 1 1 82 82 ASP H H . . . . . 3.04240734538 1.88537703848 4.19943765228 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
67 1 . . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET H H . . . . . 3.03790863241 1.88429752505 4.19151973977 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
68 1 . . 1 1 33 33 ALA H H . . . 1 1 86 86 SER H H . . . . . 3.25751914391 1.93109027229 4.58394801553 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
69 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 33 33 ALA H H . . . . . 3.08729281048 1.89587069828 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
70 1 . . 1 1 45 45 ALA HA H . . . 1 1 50 50 GLU H H . . . . . 3.63780872805 1.98360218532 5.29201527078 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
71 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL H H . . . . . 3.24184414893 1.92814996319 4.55553833467 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
72 1 . . 1 1 11 11 LEU H H . . . 1 1 88 88 LEU HA H . . . . . 3.55576270727 1.97533165347 5.13619376108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
73 1 . . 1 1 40 40 ALA H H . . . 1 1 58 58 LYS H H . . . . . 3.52034029784 1.97124082127 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
74 1 . . 1 1 39 39 GLU H H . . . 1 1 82 82 ASP H H . . . . . 2.56383066783 1.74217720617 3.38548412950 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
75 1 . . 1 1 16 16 GLU HG2 H . . . 1 1 81 81 GLY H H . . . . . 2.47438566841 1.70906261391 3.23970872292 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
76 1 . . 1 1 57 57 THR HA H . . . 1 1 40 40 ALA H H . . . . . 2.98442917468 1.87107698735 4.09778136202 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
77 1 . . 1 1 40 40 ALA H H . . . 1 1 58 58 LYS H H . . . . . 3.77832190557 1.99385735281 5.56278645833 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
78 1 . . 1 1 29 29 ILE H H . . . 1 1 67 67 LEU H H . . . . . 3.56116058598 1.97592749609 5.14639367588 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
79 1 . . 1 1 20 20 SER HA H . . . 1 1 77 77 PHE H H . . . . . 3.28485087027 1.93607021528 4.63363152526 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
80 1 . . 1 1 83 83 ALA H H . . . 1 1 39 39 GLU H H . . . . . 2.87791880333 1.84261672351 3.91322088316 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
81 1 OR . 1 1 56 56 VAL MG2 H . . . 1 1 63 63 VAL H H . . . . . 2.33720723501 1.65439002759 4.11818925786 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
81 2 OR . 1 1 56 56 VAL MG1 H . . . 1 1 63 63 VAL H H . . . . . 2.33720723501 1.65439002759 4.11818925786 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
82 1 . . 1 1 83 83 ALA MB H . . . 1 1 38 38 GLN H H . . . . . 2.66171754027 1.77612500725 3.54731007329 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
83 1 . . 1 1 45 45 ALA HA H . . . 1 1 49 49 GLN H H . . . . . 3.08082626780 1.89438995626 4.26726257935 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
84 1 . . 1 1 19 19 TYR QE H . . . 1 1 14 14 LYS H H . . . . . 3.08718857005 1.89584691167 4.27853022843 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
85 1 . . 1 1 87 87 LEU H H . . . 1 1 11 11 LEU H H . . . . . 3.21784504585 1.92352920346 4.51216088823 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
86 1 . . 1 1 80 80 ALA MB H . . . 1 1 41 41 LYS H H . . . . . 2.26191833390 1.62238401524 4.50185688745 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
87 1 . . 1 1 83 83 ALA H H . . . 1 1 38 38 GLN H H . . . . . 3.49104256180 1.96762029076 5.01446483284 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
88 1 . . 1 1 45 45 ALA MB H . . . 1 1 51 51 TYR H H . . . . . 3.13780890965 1.90707831546 4.36853950383 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
89 1 . . 1 1 83 83 ALA MB H . . . 1 1 39 39 GLU H H . . . . . 2.25440082991 1.61911044217 2.88969121766 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
90 1 . . 1 1 84 84 SER H H . . . 1 1 38 38 GLN H H . . . . . 3.63609335371 1.98344649410 5.28874021332 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
91 1 . . 1 1 69 69 PHE H H . . . 1 1 27 27 PHE H H . . . . . 3.24081201816 1.92795420103 4.55366983529 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
92 1 . . 1 1 84 84 SER H H . . . 1 1 37 37 GLY H H . . . . . 3.44853752996 1.96198614302 4.93508891691 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
93 1 . . 1 1 16 16 GLU H H . . . 1 1 79 79 THR H H . . . . . 4.74613779280 1.93040979927 7.56186578633 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
94 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 21 21 GLN HE22 H . . . . . 2.49849799030 1.71818646436 3.27880951625 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
95 1 . . 1 1 34 34 LEU MD2 H . . . 1 1 37 37 GLY H H . . . . . 2.55422709902 1.73871758985 4.47055210448 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
96 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE H H . . . . . 3.33961934822 1.94548717434 4.73375152210 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
97 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE H H . . . . . 2.90448019177 1.84997954372 3.95898083981 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
98 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 33 33 ALA H H . . . . . 2.84832617522 1.83420592516 4.89028823172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
99 1 . . 1 1 69 69 PHE H H . . . 1 1 27 27 PHE H H . . . . . 4.16313472124 1.99667338284 6.32959605964 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
100 1 . . 1 1 51 51 TYR H H . . . 1 1 46 46 ALA H H . . . . . 4.36404299458 1.98343408726 6.74465190190 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
101 1 . . 1 1 34 34 LEU MD2 H . . . 1 1 59 59 ALA H H . . . . . 3.01616263392 1.87900800464 5.29239608435 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
102 1 . . 1 1 9 9 TRP HE3 H . . . 1 1 90 90 TYR H H . . . . . 3.38846082134 1.95325247912 4.82366916356 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
103 1 . . 1 1 75 75 ILE HA H . . . 1 1 47 47 GLU H H . . . . . 4.25701608795 1.99174284132 6.52228933457 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
104 1 . . 1 1 51 51 TYR QE H . . . 1 1 46 46 ALA H H . . . . . 2.93877518062 1.85922523534 4.01832512589 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
105 1 . . 1 1 46 46 ALA HA H . . . 1 1 76 76 MET H H . . . . . 3.30934786007 1.94037495270 4.67832076743 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
106 1 . . 1 1 89 89 GLY H H . . . 1 1 10 10 GLY H H . . . . . 3.50446626671 1.96930578990 5.03962674351 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
107 1 . . 1 1 42 42 LEU MD1 H . . . 1 1 78 78 TYR H H . . . . . 2.55426896468 1.73873272169 3.36980520766 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
108 1 . . 1 1 44 44 LEU HA H . . . 1 1 78 78 TYR H H . . . . . 2.79586455986 1.81875723022 3.77297188949 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
109 1 . . 1 1 32 32 VAL H H . . . 1 1 65 65 LEU H H . . . . . 3.39136637802 1.95369563927 4.82903711676 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 2
stop_
save_
save_ARIA2_f5_run62_Dists_69|9_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_f5_run62_Dists_69|9_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 3
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 DistanceConstraints list run51_2D_69|9 69|9, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "2D 1H-1H NOESY" . . . . 1 1 3
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 3
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 OR . 1 1 77 77 PHE QD H . . . 1 1 69 69 PHE HZ H . . . . . 2.52207733436 1.72696807430 4.73512091855 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
1 2 OR . 5 1 8 8 PHE QD H . . . 1 1 69 69 PHE HZ H . . . . . 2.52207733436 1.72696807430 4.73512091855 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
2 1 . . 1 1 69 69 PHE QD H . . . 5 1 8 8 PHE QE H . . . . . 3.63839598189 1.98365531676 5.29313664702 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
3 1 OR . 1 1 27 27 PHE QE H . . . 1 1 69 69 PHE QE H . . . . . 2.91646894985 1.85324505792 3.97969284177 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
3 2 OR . 1 1 27 27 PHE QE H . . . 1 1 77 77 PHE QE H . . . . . 2.91646894985 1.85324505792 3.97969284177 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
4 1 OR . 1 1 27 27 PHE QE H . . . 1 1 77 77 PHE HZ H . . . . . 3.41000531288 1.95648828365 4.86352234211 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
4 2 OR . 1 1 27 27 PHE QE H . . . 1 1 9 9 TRP HZ2 H . . . . . 3.41000531288 1.95648828365 4.86352234211 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
5 1 . . 1 1 77 77 PHE QD H . . . 1 1 9 9 TRP HH2 H . . . . . 3.30734429778 1.94002850977 4.67466008579 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
6 1 . . 1 1 27 27 PHE QE H . . . 1 1 9 9 TRP HH2 H . . . . . 3.10071357236 1.89891049013 4.30251665460 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
7 1 OR . 1 1 8 8 PHE HZ H . . . 2 1 51 51 TYR QE H . . . . . 2.99504419228 1.87375797807 5.66885682624 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
7 2 OR . 1 1 8 8 PHE HZ H . . . 2 1 69 69 PHE QD H . . . . . 2.99504419228 1.87375797807 5.66885682624 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
8 1 . . 1 1 8 8 PHE QE H . . . 2 1 51 51 TYR QD H . . . . . 3.76888918328 1.99332347380 5.54445489276 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
9 1 . . 1 1 27 27 PHE QE H . . . 1 1 9 9 TRP HH2 H . . . . . 3.17920199279 1.91578632892 4.44261765665 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
10 1 . . 1 1 51 51 TYR QD H . . . 5 1 8 8 PHE HZ H . . . . . 2.71562820091 1.79379863521 3.63745776660 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
11 1 . . 1 1 51 51 TYR QD H . . . 5 1 8 8 PHE QE H . . . . . 2.88799067968 1.84542940894 3.93055195042 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
12 1 . . 1 1 27 27 PHE QE H . . . 1 1 69 69 PHE QD H . . . . . 2.66862585398 1.77843036041 3.55882134754 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
13 1 . . 1 1 69 69 PHE HZ H . . . 1 1 77 77 PHE HZ H . . . . . 3.26230928599 1.93197655131 4.59264202067 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
14 1 . . 1 1 77 77 PHE QD H . . . 1 1 27 27 PHE QE H . . . . . 4.20344868930 1.99482607885 6.41207129974 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
15 1 . . 1 1 27 27 PHE QE H . . . 1 1 69 69 PHE QD H . . . . . 2.92732307804 1.85617052764 3.99847562845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
16 1 OR . 1 1 69 69 PHE QE H . . . 1 1 27 27 PHE HZ H . . . . . 2.99835542928 1.87458851924 4.12212233932 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
16 2 OR . 1 1 77 77 PHE QE H . . . 1 1 27 27 PHE HZ H . . . . . 2.99835542928 1.87458851924 4.12212233932 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
17 1 . . 1 1 77 77 PHE QD H . . . 1 1 69 69 PHE HZ H . . . . . 2.71250998078 1.79279618130 4.83084425216 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
18 1 . . 1 1 69 69 PHE HZ H . . . 1 1 77 77 PHE HZ H . . . . . 2.94008894350 1.85957356904 4.02060431797 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
19 1 . . 5 1 8 8 PHE QD H . . . 1 1 69 69 PHE QD H . . . . . 2.82155484653 1.82640837753 3.81670131552 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
20 1 . . 1 1 27 27 PHE QE H . . . 1 1 9 9 TRP HZ2 H . . . . . 3.16861469289 1.91359980889 4.42362957689 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
21 1 . . 1 1 43 43 TYR QE H . . . 1 1 78 78 TYR QE H . . . . . 3.81393645920 1.99567254485 5.63220037355 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
22 1 . . 1 1 27 27 PHE QE H . . . 1 1 9 9 TRP HE3 H . . . . . 3.74034472465 1.99157239225 5.48911705705 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
23 1 OR . 1 1 27 27 PHE QE H . . . 1 1 69 69 PHE QE H . . . . . 3.31696909937 1.94168359860 4.69225460015 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
23 2 OR . 1 1 27 27 PHE QE H . . . 1 1 77 77 PHE QE H . . . . . 3.31696909937 1.94168359860 4.69225460015 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
24 1 OR . 1 1 69 69 PHE QD H . . . 5 1 8 8 PHE HZ H . . . . . 3.08212547365 1.89468829424 4.26956265307 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
24 2 OR . 1 1 51 51 TYR QE H . . . 5 1 8 8 PHE HZ H . . . . . 3.08212547365 1.89468829424 4.26956265307 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 3
stop_
save_
save_ARIA2_REJECT_f5_run62_Dists_69|9_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_REJECT_f5_run62_Dists_69|9_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 4
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 *INACTIVE* DistanceConstraints list run51_2D_69|9 69|9, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "2D 1H-1H NOESY" . . . . 1 1 4
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 4
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 69 69 PHE QD H . . . 1 1 77 77 PHE HZ H . . . . . 2.45550489566 1.70181685908 4.62166604219 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 4
2 1 . . 1 1 27 27 PHE QD H . . . 1 1 69 69 PHE QE H . . . . . 3.15505772711 1.91075906944 4.39935638479 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 4
3 1 . . 2 1 51 51 TYR QE H . . . 1 1 8 8 PHE QD H . . . . . 2.56638191880 1.74309239966 3.38967143794 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 4
stop_
save_
save_ARIA2_REJECT_f5_run62_Dists_69|2_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_REJECT_f5_run62_Dists_69|2_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 5
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 *INACTIVE* DistanceConstraints list run51_n15_69|2 69|2, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-15N NOESY" . . . . 1 1 5
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 5
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 83 83 ALA H H . . . 1 1 38 38 GLN HB3 H . . . . . 3.59091892645 1.97908158441 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 5
2 1 . . 1 1 77 77 PHE QD H . . . 1 1 21 21 GLN HE22 H . . . . . 2.67830831060 1.78164138477 3.57497523642 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 5
3 1 . . 1 1 36 36 LYS H H . . . 1 1 84 84 SER H H . . . . . 3.08203138112 1.89466670184 4.26939606039 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 5
4 1 . . 1 1 83 83 ALA H H . . . 1 1 39 39 GLU H H . . . . . 2.51578176985 1.72463703066 3.30692650904 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 5
stop_
save_
save_ARIA2_REJECT_f5_run62_Dists_69|3_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_REJECT_f5_run62_Dists_69|3_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 6
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 *INACTIVE* DistanceConstraints list run51_m0_69|3 69|3, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-13C NOESY" . . . . 1 1 6
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 6
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 67 67 LEU MD1 H . . . 5 1 30 30 SER HG H . . . . . 3.22514963260 2.58011970608 3.87017955912 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
2 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 21 21 GLN HE22 H . . . . . 3.40434379089 1.95564921007 4.85303837171 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
3 1 . . 1 1 34 34 LEU MD2 H . . . 1 1 37 37 GLY H H . . . . . 2.82822950816 1.82836923931 3.82808977702 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
4 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 35 35 ASP H H . . . . . 2.73962818825 1.80143286202 3.67782351449 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
5 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 37 37 GLY H H . . . . . 2.74797233126 1.80405333959 3.69189132294 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
6 1 . . 1 1 23 23 ILE MD H . . . 1 1 75 75 ILE H H . . . . . 2.70993664011 1.79196706593 3.62790621428 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
7 1 . . 1 1 65 65 LEU MD1 H . . . 5 1 62 62 GLN HE22 H . . . . . 4.19979298464 1.99501034541 6.40457562387 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
8 1 . . 1 1 56 56 VAL MG1 H . . . 5 1 62 62 GLN HE22 H . . . . . 3.11672687672 1.90247857371 4.33097517973 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 6
stop_
save_
save_ARIA2_REJECT_f5_run62_Dists_69|5_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_REJECT_f5_run62_Dists_69|5_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 7
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 *INACTIVE* DistanceConstraints list run51_S3_nnoe_69|5 69|5, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-15N NOESY" . . . . 1 1 7
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 7
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 36 36 LYS H H . . . 1 1 84 84 SER H H . . . . . 2.51283352277 1.72354198363 3.30212506192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
2 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL H H . . . . . 2.38422985129 1.67366085332 3.09479884926 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
3 1 . . 1 1 36 36 LYS H H . . . 1 1 84 84 SER H H . . . . . 2.51756183666 1.72529713648 3.30982653684 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
4 1 . . 1 1 19 19 TYR QE H . . . 1 1 14 14 LYS H H . . . . . 2.32078289139 1.64752873777 2.99403704502 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
5 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 58 58 LYS H H . . . . . 3.18453380174 1.91687685994 4.45219074354 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
6 1 . . 1 1 42 42 LEU H H . . . 1 1 53 53 VAL H H . . . . . 3.46493248991 1.96421284496 4.96565213486 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
7 1 . . 1 1 78 78 TYR QD H . . . 1 1 16 16 GLU H H . . . . . 3.73305748272 1.99109271156 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
8 1 . . 1 1 67 67 LEU H H . . . 5 1 90 90 TYR QE H . . . . . 4.44738052569 3.55790442055 5.33685663082 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
9 1 . . 1 1 83 83 ALA H H . . . 1 1 39 39 GLU H H . . . . . 2.76338642079 1.80884835696 3.71792448461 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
10 1 . . 5 1 90 90 TYR QD H . . . 1 1 66 66 ASP H H . . . . . 4.13688182500 1.99765792075 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
11 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL H H . . . . . 2.38394889347 1.67354735263 3.09435043430 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 7
stop_
save_
save_ARIA2_f5_run62_Dists_69|4_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_f5_run62_Dists_69|4_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 8
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 DistanceConstraints list run51_c13_d2o_69|4 69|4, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-13C NOESY" . . . . 1 1 8
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 8
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 78 78 TYR QD H . . . 1 1 45 45 ALA MB H . . . . . 2.52082532949 1.72650528677 4.84932005574 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
2 1 . . 1 1 79 79 THR MG H . . . 1 1 43 43 TYR H H . . . . . 2.78074528926 1.81417724379 3.74731333473 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
3 1 . . 1 1 29 29 ILE MD H . . . 1 1 77 77 PHE QD H . . . . . 3.04732780744 1.88655196169 4.20810365319 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
4 1 . . 1 1 52 52 ILE MG H . . . 1 1 43 43 TYR QE H . . . . . 3.02977313729 1.88233247936 4.17721379523 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
5 1 . . 1 1 51 51 TYR QD H . . . 1 1 46 46 ALA MB H . . . . . 2.85374969163 1.83576377882 3.87173560444 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
6 1 OR . 1 1 76 76 MET HB2 H . . . 1 1 20 20 SER HB2 H . . . . . 2.69358801570 1.78666096591 3.60051506549 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
6 2 OR . 1 1 76 76 MET HB3 H . . . 1 1 20 20 SER HB3 H . . . . . 2.69358801570 1.78666096591 3.60051506549 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
6 3 OR . 1 1 76 76 MET HB3 H . . . 1 1 20 20 SER HB2 H . . . . . 2.69358801570 1.78666096591 3.60051506549 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
6 4 OR . 1 1 76 76 MET HB2 H . . . 1 1 20 20 SER HB3 H . . . . . 2.69358801570 1.78666096591 3.60051506549 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
7 1 . . 1 1 58 58 LYS HG3 H . . . 1 1 38 38 GLN HA H . . . . . 3.18254243059 1.91647039028 4.44861447090 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
8 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE QE H . . . . . 2.49011166189 1.71502965081 3.26519367298 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
9 1 . . 1 1 51 51 TYR H H . . . 1 1 44 44 LEU MD1 H . . . . . 3.49739840759 1.96842395491 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
10 1 OR . 1 1 87 87 LEU MD2 H . . . 1 1 77 77 PHE QE H . . . . . 2.46041226109 1.70370869927 4.99764744716 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
10 2 OR . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HZ2 H . . . . . 2.46041226109 1.70370869927 4.99764744716 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
11 1 . . 1 1 83 83 ALA HA H . . . 1 1 37 37 GLY HA3 H . . . . . 2.68421127618 1.78358750428 3.58483504807 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
12 1 . . 1 1 75 75 ILE MG H . . . 5 1 8 8 PHE QD H . . . . . 2.96869310365 1.86705076069 4.07033544661 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
13 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 69 69 PHE HZ H . . . . . 2.56080317204 1.74108906130 3.38051728278 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
14 1 . . 1 1 28 28 HIS H H . . . 1 1 91 91 LEU MD2 H . . . . . 2.79646975969 1.81893937008 4.84351298816 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
15 1 . . 1 1 9 9 TRP HB3 H . . . 1 1 9 9 TRP HD1 H . . . . . 3.64222900988 1.98399998983 5.30045802994 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
16 1 OR . 1 1 91 91 LEU MD2 H . . . 1 1 25 25 LYS HG2 H . . . . . 2.26526631925 1.62383738211 2.90669525639 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
16 2 OR . 1 1 91 91 LEU MD2 H . . . 1 1 25 25 LYS HG3 H . . . . . 2.26526631925 1.62383738211 2.90669525639 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
17 1 . . 1 1 45 45 ALA MB H . . . 1 1 50 50 GLU HA H . . . . . 2.12377854229 1.55997413020 2.68758295437 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
18 1 . . 1 1 43 43 TYR QD H . . . 1 1 52 52 ILE MD H . . . . . 2.21045510517 1.59969113367 3.94358670751 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
19 1 OR . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HD2 H . . . . . 2.54772228761 1.73636118076 4.59373660742 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
19 2 OR . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HD3 H . . . . . 2.54772228761 1.73636118076 4.59373660742 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
20 1 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HG3 H . . . . . 2.41941455788 1.68771870752 4.23592077300 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
20 2 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HG2 H . . . . . 2.41941455788 1.68771870752 4.23592077300 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
20 3 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HG2 H . . . . . 2.41941455788 1.68771870752 4.23592077300 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
20 4 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HG3 H . . . . . 2.41941455788 1.68771870752 4.23592077300 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
21 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 32 32 VAL HA H . . . . . 2.59526533701 1.75334006582 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
22 1 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET ME H . . . . . 2.09399360024 1.54589245051 5.52473723874 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
22 2 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET ME H . . . . . 2.09399360024 1.54589245051 5.52473723874 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
23 1 . . 1 1 59 59 ALA MB H . . . 1 1 57 57 THR H H . . . . . 3.37282453804 1.95083136749 4.79481770858 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
24 1 . . 1 1 75 75 ILE MG H . . . 1 1 69 69 PHE QD H . . . . . 3.33419909911 1.94458864505 4.72380955316 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
25 1 OR . 1 1 76 76 MET HG3 H . . . 1 1 78 78 TYR QE H . . . . . 3.24608219159 1.92895099227 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
25 2 OR . 1 1 76 76 MET HG2 H . . . 1 1 78 78 TYR QE H . . . . . 3.24608219159 1.92895099227 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
26 1 . . 1 1 17 17 ARG HB3 H . . . 1 1 19 19 TYR QE H . . . . . 2.38651835967 1.67458462454 4.72628333773 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
27 1 . . 1 1 79 79 THR MG H . . . 1 1 13 13 MET ME H . . . . . 2.14120261808 1.56810903662 2.71429619953 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
28 1 OR . 1 1 91 91 LEU MD2 H . . . 1 1 25 25 LYS HE2 H . . . . . 2.98315390364 1.87075300204 4.09555480524 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
28 2 OR . 1 1 91 91 LEU MD2 H . . . 1 1 25 25 LYS HE3 H . . . . . 2.98315390364 1.87075300204 4.09555480524 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
29 1 . . 1 1 56 56 VAL HA H . . . 1 1 60 60 ILE MG H . . . . . 2.57649650163 1.74670472377 3.40628827949 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
30 1 OR . 1 1 80 80 ALA HA H . . . 1 1 16 16 GLU HG3 H . . . . . 2.52623774645 1.72850310250 3.32397239040 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
30 2 OR . 1 1 80 80 ALA HA H . . . 1 1 16 16 GLU HG2 H . . . . . 2.52623774645 1.72850310250 3.32397239040 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
31 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 54 54 ALA MB H . . . . . 2.52118914867 1.72663980825 3.31573848910 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
32 1 . . 1 1 9 9 TRP HZ2 H . . . 1 1 11 11 LEU MD2 H . . . . . 3.36796515875 1.95006649493 4.78586382258 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
33 1 OR . 2 1 70 70 SER HB2 H . . . 1 1 7 7 MET ME H . . . . . 2.49669166280 1.71750800541 3.27587532018 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
33 2 OR . 2 1 70 70 SER HB3 H . . . 1 1 7 7 MET ME H . . . . . 2.49669166280 1.71750800541 3.27587532018 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
34 1 . . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD2 H . . . . . 2.39167873543 1.67666283874 4.43353296349 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
35 1 . . 1 1 58 58 LYS HA H . . . 1 1 34 34 LEU MD2 H . . . . . 2.47022601438 1.70747394411 3.23297808464 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
36 1 . . 1 1 64 64 ALA MB H . . . 1 1 32 32 VAL H H . . . . . 3.16842071500 1.91355948660 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
37 1 OR . 1 1 58 58 LYS HD2 H . . . 1 1 38 38 GLN HG3 H . . . . . 2.59326926587 1.75263858021 3.43389995153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
37 2 OR . 1 1 58 58 LYS HD3 H . . . 1 1 38 38 GLN HG3 H . . . . . 2.59326926587 1.75263858021 3.43389995153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
38 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 8 8 PHE QE H . . . . . 2.59368475037 1.75278467733 3.43458482340 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
39 1 . . 1 1 9 9 TRP HZ3 H . . . 1 1 87 87 LEU HB2 H . . . . . 2.92402880848 1.85528574938 3.99277186758 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
40 1 . . 1 1 13 13 MET ME H . . . 1 1 78 78 TYR HA H . . . . . 2.37097821397 1.66828600258 3.07367042537 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
41 1 OR . 1 1 18 18 LYS HD3 H . . . 1 1 78 78 TYR QE H . . . . . 3.32521700680 1.94308348901 5.75172504042 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
41 2 OR . 1 1 18 18 LYS HD2 H . . . 1 1 78 78 TYR QE H . . . . . 3.32521700680 1.94308348901 5.75172504042 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
42 1 . . 1 1 27 27 PHE QD H . . . 1 1 23 23 ILE MG H . . . . . 2.55217059712 1.73797375252 3.36636744173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
43 1 OR . 1 1 29 29 ILE MD H . . . 1 1 9 9 TRP HZ3 H . . . . . 3.40764015716 1.50000000000 4.85914158724 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
43 2 OR . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HZ3 H . . . . . 3.40764015716 1.50000000000 4.85914158724 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
44 1 . . 1 1 17 17 ARG HB3 H . . . 1 1 19 19 TYR QE H . . . . . 2.97175239832 1.86783835870 4.07566643793 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
45 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL MG2 H . . . . . 3.39038398511 1.95354603930 4.82722193093 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
46 1 OR . 1 1 76 76 MET HB2 H . . . 1 1 20 20 SER HA H . . . . . 2.41714460300 1.68682109902 3.14746810698 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
46 2 OR . 1 1 76 76 MET HB3 H . . . 1 1 20 20 SER HA H . . . . . 2.41714460300 1.68682109902 3.14746810698 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
46 3 OR . 1 1 76 76 MET ME H . . . 1 1 20 20 SER HA H . . . . . 2.41714460300 1.68682109902 3.14746810698 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
47 1 . . 1 1 9 9 TRP HZ2 H . . . 1 1 11 11 LEU MD2 H . . . . . 2.47826884880 1.71054178793 4.40123514781 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
48 1 OR . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET HG2 H . . . . . 2.94294274678 1.86032874543 5.25781374801 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
48 2 OR . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET HG3 H . . . . . 2.94294274678 1.86032874543 5.25781374801 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
49 1 . . 1 1 63 63 VAL HB H . . . 1 1 32 32 VAL MG2 H . . . . . 2.45682754083 1.70232734516 3.21132773650 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
50 1 . . 1 1 46 46 ALA MB H . . . 1 1 75 75 ILE MD H . . . . . 2.32166445938 1.64789872664 4.09993392775 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
51 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 32 32 VAL HA H . . . . . 2.61754332351 1.76110169220 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
52 1 . . 1 1 16 16 GLU HG2 H . . . 1 1 80 80 ALA MB H . . . . . 2.90983729726 1.85144316019 5.22358431291 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
53 1 . . 1 1 58 58 LYS HG2 H . . . 1 1 38 38 GLN HA H . . . . . 2.88869573209 1.84562535302 3.93176611117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
54 1 OR . 1 1 76 76 MET HG3 H . . . 1 1 20 20 SER HA H . . . . . 2.58351127715 1.74919496225 3.41782759205 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
54 2 OR . 1 1 76 76 MET HG2 H . . . 1 1 20 20 SER HA H . . . . . 2.58351127715 1.74919496225 3.41782759205 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
55 1 . . 1 1 13 13 MET ME H . . . 1 1 11 11 LEU MD2 H . . . . . 1.90103462846 1.44929304613 5.55922277832 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
56 1 OR . 1 1 52 52 ILE MG H . . . 1 1 43 43 TYR QE H . . . . . 2.91682666027 1.85334193951 3.98031138102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
56 2 OR . 1 1 52 52 ILE MG H . . . 1 1 43 43 TYR QD H . . . . . 2.91682666027 1.85334193951 3.98031138102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
57 1 . . 1 1 38 38 GLN HG3 H . . . 1 1 83 83 ALA MB H . . . . . 2.97916237682 1.86973631839 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
58 1 . . 1 1 77 77 PHE QD H . . . 1 1 87 87 LEU MD1 H . . . . . 2.69782655556 1.78804304007 3.60761007104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
59 1 . . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HE3 H . . . . . 3.02605435459 1.88142873497 4.17067997421 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
60 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 8 8 PHE HZ H . . . . . 3.42350810745 1.95845713723 4.88855907768 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
61 1 OR . 1 1 77 77 PHE QD H . . . 1 1 42 42 LEU MD1 H . . . . . 2.48725111189 1.71394885019 3.26055337360 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
61 2 OR . 1 1 42 42 LEU MD1 H . . . 1 1 54 54 ALA H H . . . . . 2.48725111189 1.71394885019 3.26055337360 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
62 1 OR . 1 1 92 92 HIS HD2 H . . . 1 1 26 26 SER HB2 H . . . . . 2.94028153108 1.85962459583 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
62 2 OR . 1 1 92 92 HIS HD2 H . . . 1 1 26 26 SER HB3 H . . . . . 2.94028153108 1.85962459583 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
63 1 OR . 1 1 58 58 LYS HD3 H . . . 1 1 38 38 GLN HG2 H . . . . . 2.49817576641 1.71806549643 3.27828603640 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
63 2 OR . 1 1 58 58 LYS HD2 H . . . 1 1 38 38 GLN HG2 H . . . . . 2.49817576641 1.71806549643 3.27828603640 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
64 1 OR . 1 1 19 19 TYR QE H . . . 1 1 17 17 ARG HD3 H . . . . . 2.73113478564 1.79874763347 3.66352193780 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
64 2 OR . 1 1 19 19 TYR QE H . . . 1 1 17 17 ARG HD2 H . . . . . 2.73113478564 1.79874763347 3.66352193780 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
65 1 . . 1 1 80 80 ALA HA H . . . 1 1 16 16 GLU HG2 H . . . . . 2.53412857861 1.73140262200 3.33685453523 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
66 1 . . 1 1 43 43 TYR QE H . . . 1 1 80 80 ALA MB H . . . . . 2.07406968802 1.53634905418 2.61179032187 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
67 1 . . 1 1 46 46 ALA HA H . . . 1 1 75 75 ILE HA H . . . . . 2.89884265176 1.84843156180 3.94925374172 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
68 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 9 9 TRP HD1 H . . . . . 2.59817650979 1.75436136279 3.44199165679 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
69 1 . . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD2 H . . . . . 3.49825444520 1.96853142478 5.02797746562 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
70 1 . . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET ME H . . . . . 1.73743619440 1.36010062820 2.11477176060 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
71 1 . . 1 1 45 45 ALA MB H . . . 1 1 78 78 TYR QE H . . . . . 2.10833730683 1.55270153191 2.66397308175 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
72 1 . . 1 1 43 43 TYR QD H . . . 1 1 50 50 GLU HG3 H . . . . . 2.44148975042 1.69638072524 3.18659877559 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
73 1 . . 1 1 78 78 TYR QE H . . . 1 1 18 18 LYS HE2 H . . . . . 2.73788924171 1.80088455423 4.99658172472 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
74 1 . . 1 1 45 45 ALA MB H . . . 1 1 50 50 GLU HG2 H . . . . . 2.56850098727 1.74385132207 4.43470517314 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
75 1 OR . 1 1 63 63 VAL MG2 H . . . 1 1 54 54 ALA HA H . . . . . 2.82273236282 1.82675511381 3.81870961184 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
75 2 OR . 1 1 63 63 VAL MG1 H . . . 1 1 54 54 ALA HA H . . . . . 2.82273236282 1.82675511381 3.81870961184 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
76 1 . . 1 1 37 37 GLY HA2 H . . . 1 1 83 83 ALA MB H . . . . . 2.35036786078 1.65983922566 3.04089649590 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
77 1 . . 1 1 27 27 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 2.84226523470 1.83245627665 3.85207419276 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
78 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE HB H . . . . . 3.02256025889 1.88057644406 4.16454407371 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
79 1 OR . 1 1 91 91 LEU MD1 H . . . 1 1 25 25 LYS HE2 H . . . . . 2.43382357799 1.69338642689 3.17426072909 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
79 2 OR . 1 1 91 91 LEU MD1 H . . . 1 1 25 25 LYS HE3 H . . . . . 2.43382357799 1.69338642689 3.17426072909 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
80 1 . . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HE2 H . . . . . 2.61277720282 1.75945161387 4.93281876822 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
81 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 75 75 ILE MD H . . . . . 2.85313876114 1.83558866235 3.87068885993 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
82 1 . . 1 1 57 57 THR HA H . . . 1 1 40 40 ALA H H . . . . . 3.20507619548 1.92101201813 4.48914037283 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
83 1 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET ME H . . . . . 2.29518232424 1.63669958655 4.95392431588 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
83 2 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET ME H . . . . . 2.29518232424 1.63669958655 4.95392431588 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
84 1 . . 1 1 54 54 ALA MB H . . . 1 1 42 42 LEU MD2 H . . . . . 2.01014642064 1.50506034159 2.51523249969 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
85 1 . . 1 1 44 44 LEU HB3 H . . . 1 1 69 69 PHE QE H . . . . . 3.31878827565 1.94199382333 4.69558272797 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
86 1 . . 1 1 43 43 TYR QD H . . . 1 1 80 80 ALA MB H . . . . . 2.82870582067 1.82850874318 3.82890289816 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
87 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 27 27 PHE HB3 H . . . . . 2.67713942943 1.78125498885 3.57302387000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
88 1 . . 1 1 9 9 TRP HZ3 H . . . 1 1 87 87 LEU HB3 H . . . . . 3.29477070258 1.93783145476 4.65170995040 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
89 1 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HG3 H . . . . . 2.50168584505 1.71938183663 3.28398985346 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
89 2 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HG2 H . . . . . 2.50168584505 1.71938183663 3.28398985346 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
90 1 OR . 1 1 40 40 ALA MB H . . . 1 1 83 83 ALA H H . . . . . 3.29851171333 1.93848927296 4.65853415369 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
90 2 OR . 1 1 40 40 ALA MB H . . . 1 1 85 85 VAL H H . . . . . 3.29851171333 1.93848927296 4.65853415369 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
91 1 OR . 1 1 70 70 SER HB2 H . . . 5 1 7 7 MET HG3 H . . . . . 2.92480308422 1.85549394904 3.99411221941 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
91 2 OR . 1 1 70 70 SER HB2 H . . . 5 1 7 7 MET HG2 H . . . . . 2.92480308422 1.85549394904 3.99411221941 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
92 1 . . 1 1 80 80 ALA HA H . . . 1 1 16 16 GLU HG3 H . . . . . 2.60432336497 1.75651084130 3.45213588863 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
93 1 . . 1 1 46 46 ALA MB H . . . 1 1 75 75 ILE MG H . . . . . 1.78350705267 1.38589487681 2.18111922854 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
94 1 OR . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HD2 H . . . . . 2.47843566685 1.71060524751 4.43478840484 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
94 2 OR . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HG2 H . . . . . 2.47843566685 1.71060524751 4.43478840484 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
94 3 OR . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HD3 H . . . . . 2.47843566685 1.71060524751 4.43478840484 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
95 1 . . 1 1 77 77 PHE QD H . . . 1 1 87 87 LEU MD2 H . . . . . 2.66182671803 1.77616153343 4.60856652995 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
96 1 . . 1 1 13 13 MET ME H . . . 1 1 19 19 TYR QD H . . . . . 2.22004749510 1.60397113504 2.83612385516 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
97 1 OR . 1 1 46 46 ALA MB H . . . 1 1 51 51 TYR QE H . . . . . 2.29223205105 1.63544107907 2.94902302303 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
97 2 OR . 1 1 46 46 ALA MB H . . . 1 1 69 69 PHE QD H . . . . . 2.29223205105 1.63544107907 2.94902302303 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
98 1 OR . 1 1 70 70 SER HB3 H . . . 5 1 7 7 MET HG2 H . . . . . 2.58368240331 1.74925555816 3.41810924845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
98 2 OR . 1 1 70 70 SER HB3 H . . . 5 1 7 7 MET HG3 H . . . . . 2.58368240331 1.74925555816 3.41810924845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
99 1 . . 1 1 23 23 ILE MG H . . . 1 1 75 75 ILE MD H . . . . . 3.46687471024 1.96447217818 4.96927724231 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
100 1 OR . 1 1 51 51 TYR QD H . . . 5 1 88 88 LEU MD1 H . . . . . 3.11132544109 1.90128219104 4.32136869114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
100 2 OR . 1 1 51 51 TYR QD H . . . 5 1 88 88 LEU MD2 H . . . . . 3.11132544109 1.90128219104 4.32136869114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
101 1 OR . 1 1 38 38 GLN HG3 H . . . 1 1 83 83 ALA MB H . . . . . 3.32813713903 1.94357503701 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
101 2 OR . 1 1 38 38 GLN HG2 H . . . 1 1 83 83 ALA MB H . . . . . 3.32813713903 1.94357503701 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
102 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HH2 H . . . . . 2.41469078020 1.68584933470 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
103 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HA H . . . . . 2.83898683201 1.83150605297 3.84646761106 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
104 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE QE H . . . . . 2.00660604094 1.50329756550 3.53785571742 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
105 1 OR . 1 1 87 87 LEU HB2 H . . . 1 1 29 29 ILE MG H . . . . . 2.29064485639 1.63476312413 4.05741551514 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
105 2 OR . 1 1 11 11 LEU MD1 H . . . 1 1 87 87 LEU HB2 H . . . . . 2.29064485639 1.63476312413 4.05741551514 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
105 3 OR . 1 1 87 87 LEU HB2 H . . . 1 1 32 32 VAL MG1 H . . . . . 2.29064485639 1.63476312413 4.05741551514 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
106 1 . . 1 1 45 45 ALA MB H . . . 1 1 78 78 TYR QE H . . . . . 2.66671518817 1.77779395132 3.55563642502 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
107 1 OR . 1 1 42 42 LEU MD2 H . . . 1 1 54 54 ALA H H . . . . . 2.67366919899 1.78010582579 3.56723257219 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
107 2 OR . 1 1 77 77 PHE QD H . . . 1 1 42 42 LEU MD2 H . . . . . 2.67366919899 1.78010582579 3.56723257219 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
108 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 27 27 PHE QD H . . . . . 2.76232055483 1.80851869888 3.71612241079 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
109 1 . . 1 1 23 23 ILE MG H . . . 1 1 70 70 SER HA H . . . . . 2.78635097468 1.81588200542 4.78220650974 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
110 1 . . 1 1 75 75 ILE MD H . . . 1 1 23 23 ILE MD H . . . . . 2.48811169542 1.71427421931 3.26194917153 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
111 1 . . 1 1 37 37 GLY HA3 H . . . 1 1 83 83 ALA MB H . . . . . 3.03227065936 1.88293749041 4.18160382831 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
112 1 OR . 1 1 19 19 TYR QE H . . . 1 1 13 13 MET ME H . . . . . 2.17126744089 1.58196715341 3.92799751478 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
112 2 OR . 1 1 77 77 PHE QD H . . . 1 1 13 13 MET ME H . . . . . 2.17126744089 1.58196715341 3.92799751478 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
113 1 . . 1 1 19 19 TYR QE H . . . 1 1 13 13 MET ME H . . . . . 2.78536498793 1.81558272343 3.75514725243 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
114 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 19 19 TYR QD H . . . . . 2.49527091596 1.71697379796 3.27356803397 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
115 1 OR . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HB3 H . . . . . 2.26257980831 1.62267138469 2.90248823193 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
115 2 OR . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HG2 H . . . . . 2.26257980831 1.62267138469 2.90248823193 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
116 1 . . 1 1 75 75 ILE MD H . . . 1 1 74 74 ARG HA H . . . . . 2.74325770488 1.80257485046 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
117 1 OR . 1 1 76 76 MET HG3 H . . . 1 1 78 78 TYR QE H . . . . . 3.13096039139 1.90559626983 5.39837334274 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
117 2 OR . 1 1 76 76 MET HG2 H . . . 1 1 78 78 TYR QE H . . . . . 3.13096039139 1.90559626983 5.39837334274 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
118 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 34 34 LEU HA H . . . . . 2.36886830623 1.66742617470 3.07031043776 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
119 1 . . 1 1 40 40 ALA MB H . . . 1 1 85 85 VAL MG1 H . . . . . 2.01228525834 1.50612376322 2.51844675345 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
120 1 . . 1 1 19 19 TYR QE H . . . 1 1 17 17 ARG HG2 H . . . . . 2.50527873266 1.72072604162 3.28983142371 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
121 1 . . 1 1 77 77 PHE QD H . . . 1 1 87 87 LEU MD2 H . . . . . 2.68305328262 1.78320641795 4.60856652995 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
122 1 . . 1 1 20 20 SER HA H . . . 1 1 77 77 PHE H H . . . . . 3.08655089191 1.89570134087 4.27740044296 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
123 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 32 32 VAL HB H . . . . . 2.84017297987 1.83185016042 5.78761994601 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
124 1 OR . 1 1 53 53 VAL MG1 H . . . 1 1 44 44 LEU HA H . . . . . 2.74686999480 1.80370814876 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
124 2 OR . 1 1 43 43 TYR HA H . . . 1 1 53 53 VAL MG1 H . . . . . 2.74686999480 1.80370814876 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
125 1 . . 1 1 69 69 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 3.44261140035 1.96116474362 4.92405805709 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
126 1 . . 1 1 57 57 THR HA H . . . 1 1 39 39 GLU HA H . . . . . 3.26824761616 1.93306730609 4.60342792623 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
127 1 . . 1 1 40 40 ALA MB H . . . 1 1 79 79 THR HB H . . . . . 2.52354216285 1.72750903189 3.31957529381 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
128 1 . . 1 1 27 27 PHE QD H . . . 1 1 23 23 ILE MG H . . . . . 2.66754640109 1.77807092584 3.55702187633 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
129 1 OR . 1 1 76 76 MET HG3 H . . . 1 1 20 20 SER HA H . . . . . 2.32132463928 1.64775612916 4.22068344414 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
129 2 OR . 1 1 76 76 MET HG2 H . . . 1 1 20 20 SER HA H . . . . . 2.32132463928 1.64775612916 4.22068344414 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
130 1 OR . 1 1 77 77 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 2.97644401426 1.86904164301 4.08384638552 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
130 2 OR . 1 1 75 75 ILE MD H . . . 1 1 69 69 PHE QE H . . . . . 2.97644401426 1.86904164301 4.08384638552 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
131 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE MG H . . . . . 2.62275388954 1.76289914390 3.48260863518 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
132 1 . . 1 1 58 58 LYS HG2 H . . . 1 1 38 38 GLN HA H . . . . . 2.41109013427 1.68442067982 3.13775958871 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
133 1 OR . 1 1 18 18 LYS HD2 H . . . 1 1 76 76 MET ME H . . . . . 1.77748406519 1.38255286494 3.50537499629 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
133 2 OR . 1 1 76 76 MET ME H . . . 1 1 18 18 LYS HG2 H . . . . . 1.77748406519 1.38255286494 3.50537499629 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
133 3 OR . 1 1 18 18 LYS HD3 H . . . 1 1 76 76 MET ME H . . . . . 1.77748406519 1.38255286494 3.50537499629 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
134 1 OR . 1 1 16 16 GLU HG2 H . . . 1 1 80 80 ALA MB H . . . . . 2.74554099997 1.80329157716 3.68779042278 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
134 2 OR . 1 1 16 16 GLU HG3 H . . . 1 1 80 80 ALA MB H . . . . . 2.74554099997 1.80329157716 3.68779042278 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
135 1 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HA H . . . . . 2.62210640384 1.76267615471 4.91551071055 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
135 2 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HA H . . . . . 2.62210640384 1.76267615471 4.91551071055 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
136 1 OR . 1 1 76 76 MET HB2 H . . . 1 1 20 20 SER HA H . . . . . 2.37980798271 1.67187222839 3.08774373703 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
136 2 OR . 1 1 76 76 MET HB3 H . . . 1 1 20 20 SER HA H . . . . . 2.37980798271 1.67187222839 3.08774373703 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
137 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE MD H . . . . . 3.06329538906 1.89032305898 5.24114102972 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
138 1 . . 1 1 51 51 TYR QE H . . . 1 1 49 49 GLN HG2 H . . . . . 3.06974909516 1.89182915676 4.24766903357 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
139 1 . . 1 1 43 43 TYR QD H . . . 1 1 50 50 GLU HG2 H . . . . . 2.71178325814 1.79256220325 4.68725824180 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
140 1 . . 1 1 62 62 GLN H H . . . 1 1 56 56 VAL MG1 H . . . . . 2.58315703612 1.74906950196 3.41724457028 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
141 1 . . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE MG H . . . . . 2.66303986056 1.77656719819 3.54951252293 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
142 1 OR . 1 1 87 87 LEU MD1 H . . . 1 1 9 9 TRP HZ3 H . . . . . 2.51855020764 1.72566331409 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
142 2 OR . 1 1 87 87 LEU MD1 H . . . 1 1 27 27 PHE QD H . . . . . 2.51855020764 1.72566331409 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
143 1 . . 1 1 19 19 TYR QE H . . . 1 1 13 13 MET HA H . . . . . 3.31115862023 1.94068719419 4.68163004627 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
144 1 . . 1 1 52 52 ILE MG H . . . 5 1 86 86 SER H H . . . . . 2.38696333325 1.67476408896 3.09916257753 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
145 1 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HG3 H . . . . . 2.49514660723 1.71692703328 3.27336618117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
145 2 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HG2 H . . . . . 2.49514660723 1.71692703328 3.27336618117 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
146 1 OR . 1 1 91 91 LEU MD2 H . . . 1 1 7 7 MET HG2 H . . . . . 2.76676929385 1.80989275318 3.72364583452 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
146 2 OR . 1 1 91 91 LEU MD2 H . . . 1 1 9 9 TRP HB3 H . . . . . 2.76676929385 1.80989275318 3.72364583452 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
146 3 OR . 1 1 91 91 LEU MD2 H . . . 1 1 7 7 MET HG3 H . . . . . 2.76676929385 1.80989275318 3.72364583452 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
147 1 . . 1 1 23 23 ILE MG H . . . 1 1 70 70 SER HA H . . . . . 2.84041577025 1.83192055176 3.84891098874 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
148 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 32 32 VAL H H . . . . . 3.19431460542 1.91885888062 5.78095739281 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
149 1 OR . 1 1 76 76 MET HG3 H . . . 1 1 20 20 SER HA H . . . . . 2.54091166985 1.73388265560 4.38166110137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
149 2 OR . 1 1 76 76 MET HG2 H . . . 1 1 20 20 SER HA H . . . . . 2.54091166985 1.73388265560 4.38166110137 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
150 1 . . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HG2 H . . . . . 3.34833324922 1.94691630574 4.74975019269 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
151 1 . . 1 1 46 46 ALA MB H . . . 1 1 75 75 ILE HA H . . . . . 2.85139608214 1.83508862999 3.86770353430 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
152 1 . . 1 1 56 56 VAL HA H . . . 1 1 60 60 ILE MG H . . . . . 2.82801386671 1.82830606292 3.82772167050 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
153 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HB2 H . . . . . 2.66477565890 1.77714699487 3.55240432294 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
154 1 . . 1 1 13 13 MET ME H . . . 1 1 11 11 LEU MD2 H . . . . . 2.59634582392 1.75371936925 5.55922277832 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
155 1 . . 1 1 63 63 VAL HB H . . . 1 1 32 32 VAL MG2 H . . . . . 2.43723167490 1.69471939526 3.17974395455 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
156 1 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HG3 H . . . . . 2.19943194621 1.59474433546 2.80411955697 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
156 2 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HG2 H . . . . . 2.19943194621 1.59474433546 2.80411955697 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
157 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HG3 H . . . . . 2.36633887750 1.66639391710 3.06628383790 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
158 1 . . 1 1 79 79 THR MG H . . . 1 1 13 13 MET ME H . . . . . 1.91737108084 1.45783209813 3.41356436317 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
159 1 . . 1 1 75 75 ILE MG H . . . 1 1 69 69 PHE QE H . . . . . 2.67940743051 1.78200440818 3.57681045284 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
160 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 19 19 TYR QD H . . . . . 2.57844948886 1.74739926804 3.40949970969 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
161 1 . . 1 1 76 76 MET ME H . . . 1 1 78 78 TYR QE H . . . . . 2.18559221258 1.58849054762 2.78269387754 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
162 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 27 27 PHE QD H . . . . . 2.88229658283 1.84384238391 3.92075078176 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
163 1 . . 1 1 75 75 ILE MG H . . . 1 1 46 46 ALA HA H . . . . . 2.71407513912 1.79329965652 3.63485062173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
164 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 9 9 TRP HH2 H . . . . . 2.36572466853 1.66614301762 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
165 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HZ3 H . . . . . 2.62559992437 1.76387805401 5.20147591541 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
166 1 . . 1 1 40 40 ALA MB H . . . 1 1 79 79 THR HB H . . . . . 2.41437319220 1.68572345330 3.14302293111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
167 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 91 91 LEU HA H . . . . . 2.77145533047 1.81133474937 3.73157591157 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
168 1 . . 1 1 9 9 TRP HZ3 H . . . 1 1 29 29 ILE MG H . . . . . 2.82106230223 1.82626323810 3.81586136636 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
169 1 . . 1 1 13 13 MET ME H . . . 1 1 78 78 TYR H H . . . . . 2.63970146172 1.76869848584 3.51070443759 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
170 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HG2 H . . . . . 2.42720809184 1.69079070170 3.16362548198 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
171 1 . . 1 1 17 17 ARG HB2 H . . . 1 1 19 19 TYR QE H . . . . . 2.81631329160 1.82486072204 3.80776586115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
172 1 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HG3 H . . . . . 2.57913383888 1.74764241902 4.94203496859 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
172 2 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HG2 H . . . . . 2.57913383888 1.74764241902 4.94203496859 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
172 3 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HG2 H . . . . . 2.57913383888 1.74764241902 4.94203496859 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
172 4 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HG3 H . . . . . 2.57913383888 1.74764241902 4.94203496859 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
173 1 . . 1 1 58 58 LYS HA H . . . 1 1 34 34 LEU MD2 H . . . . . 2.15986952896 1.57673998119 2.74299907673 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
174 1 . . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET ME H . . . . . 2.15418530134 1.57412101228 2.73424959041 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
175 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 9 9 TRP HD1 H . . . . . 2.08251172229 1.54040483811 2.62461860648 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
176 1 . . 1 1 40 40 ALA MB H . . . 1 1 85 85 VAL MG1 H . . . . . 2.00770511147 1.50384513464 2.51156508830 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
177 1 . . 1 1 63 63 VAL MG1 H . . . 1 1 54 54 ALA HA H . . . . . 2.62435923825 1.76345156183 4.80649432701 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
178 1 . . 1 1 23 23 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 2.21895978481 1.60348696898 3.90601555964 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
179 1 . . 1 1 9 9 TRP HE3 H . . . 1 1 89 89 GLY H H . . . . . 3.01797393482 1.87945310091 4.15649476873 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
180 1 OR . 2 1 70 70 SER HB2 H . . . 1 1 7 7 MET ME H . . . . . 2.34234305989 1.65652168361 4.41640128564 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
180 2 OR . 2 1 70 70 SER HB3 H . . . 1 1 7 7 MET ME H . . . . . 2.34234305989 1.65652168361 4.41640128564 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
181 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 25 25 LYS HB3 H . . . . . 2.39728897986 1.67891467324 4.25246121363 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
182 1 . . 1 1 76 76 MET ME H . . . 1 1 78 78 TYR QE H . . . . . 2.73848401261 1.80107217670 3.67589584853 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
183 1 . . 1 1 51 51 TYR H H . . . 1 1 45 45 ALA HA H . . . . . 3.05620549857 1.88865649238 4.22375450476 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
184 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 19 19 TYR QD H . . . . . 2.77995124187 1.81393512847 3.74596735526 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
185 1 . . 1 1 79 79 THR MG H . . . 1 1 85 85 VAL MG2 H . . . . . 2.02514275367 1.51249235708 2.53779315026 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
186 1 . . 1 1 80 80 ALA MB H . . . 1 1 41 41 LYS H H . . . . . 2.60872363590 1.75804375984 4.50213884630 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
187 1 . . 1 1 70 70 SER HB3 H . . . 5 1 7 7 MET ME H . . . . . 3.04611967186 1.88626403995 4.20597530378 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
188 1 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HG3 H . . . . . 2.22816023865 1.60757298251 3.96704092586 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
188 2 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HG2 H . . . . . 2.22816023865 1.60757298251 3.96704092586 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
188 3 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HG2 H . . . . . 2.22816023865 1.60757298251 3.96704092586 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
188 4 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HG3 H . . . . . 2.22816023865 1.60757298251 3.96704092586 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
189 1 . . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HG3 H . . . . . 3.21135423503 1.92225473217 4.50045373788 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
190 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 69 69 PHE QE H . . . . . 2.30128141983 1.63929439817 2.96326844149 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
191 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE HZ H . . . . . 2.35170663877 1.66039112442 3.04302215313 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
192 1 . . 1 1 77 77 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 2.67216511028 1.77960681320 3.56472340735 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
193 1 . . 1 1 70 70 SER HB2 H . . . 5 1 7 7 MET ME H . . . . . 3.26624239171 1.93269997153 4.59978481189 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
194 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 77 77 PHE QE H . . . . . 2.49018338275 1.71505672278 4.57117618718 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
195 1 . . 1 1 88 88 LEU MD2 H . . . 2 1 51 51 TYR QE H . . . . . 2.75157355327 1.80517892589 3.69796818066 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
196 1 . . 1 1 9 9 TRP HZ2 H . . . 1 1 11 11 LEU MD1 H . . . . . 3.40404464423 1.95560465174 4.85248463671 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
197 1 . . 1 1 51 51 TYR QE H . . . 1 1 49 49 GLN HB2 H . . . . . 2.99397868724 1.87349013978 5.15958906764 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
198 1 . . 1 1 46 46 ALA MB H . . . 1 1 75 75 ILE MD H . . . . . 2.57398833672 1.74581134202 5.13287126883 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
199 1 . . 1 1 20 20 SER HA H . . . 1 1 76 76 MET HA H . . . . . 2.56060758569 1.74101868470 3.38019648667 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
200 1 OR . 1 1 88 88 LEU MD2 H . . . 1 1 10 10 GLY HA3 H . . . . . 2.11222098915 1.55453630077 2.66990567752 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
200 2 OR . 1 1 88 88 LEU MD2 H . . . 1 1 10 10 GLY HA2 H . . . . . 2.11222098915 1.55453630077 2.66990567752 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
201 1 . . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET ME H . . . . . 2.41011514674 1.68403326917 3.13619702431 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
202 1 . . 2 1 70 70 SER HB2 H . . . 1 1 7 7 MET HG2 H . . . . . 2.49800280361 1.71800055275 4.35907549357 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
203 1 . . 1 1 56 56 VAL MG1 H . . . 1 1 63 63 VAL H H . . . . . 2.45101526835 1.70008078764 4.21423464440 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
204 1 . . 1 1 29 29 ILE H H . . . 1 1 67 67 LEU MD2 H . . . . . 3.52595638907 1.97191033187 5.08000244628 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
205 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 3.58107060965 1.97806227074 5.18407894856 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
206 1 . . 1 1 43 43 TYR H H . . . 1 1 79 79 THR HA H . . . . . 3.17627113506 1.91518384463 4.43735842548 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
207 1 OR . 1 1 52 52 ILE MD H . . . 1 1 55 55 THR H H . . . . . 2.45598532975 1.70200233726 4.55508250090 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
207 2 OR . 1 1 52 52 ILE MD H . . . 1 1 42 42 LEU H H . . . . . 2.45598532975 1.70200233726 4.55508250090 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
208 1 . . 1 1 79 79 THR MG H . . . 1 1 41 41 LYS H H . . . . . 3.20710139766 1.92141397580 4.49278881952 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
209 1 OR . 1 1 29 29 ILE MD H . . . 1 1 9 9 TRP HH2 H . . . . . 3.30111811155 1.93894551325 4.66329070986 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
209 2 OR . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HH2 H . . . . . 3.30111811155 1.93894551325 4.66329070986 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
210 1 OR . 1 1 87 87 LEU MD1 H . . . 1 1 77 77 PHE QE H . . . . . 2.38823315750 1.67527595568 4.25029406544 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
210 2 OR . 1 1 87 87 LEU MD1 H . . . 1 1 69 69 PHE QE H . . . . . 2.38823315750 1.67527595568 4.25029406544 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
211 1 . . 1 1 75 75 ILE MG H . . . 1 1 46 46 ALA HA H . . . . . 2.51107529008 1.72288790102 3.29926267913 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
212 1 . . 1 1 46 46 ALA MB H . . . 1 1 51 51 TYR QE H . . . . . 3.39841036058 1.95476123822 4.84205948293 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
213 1 . . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET ME H . . . . . 1.78999805711 1.38948642655 2.19050968766 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
214 1 . . 1 1 67 67 LEU MD1 H . . . 1 1 53 53 VAL HA H . . . . . 2.66236456997 1.77634143204 5.14737891759 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
215 1 . . 1 1 54 54 ALA MB H . . . 1 1 63 63 VAL MG2 H . . . . . 1.37803163509 1.14066023667 2.93594288015 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
216 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE QE H . . . . . 2.85703813517 1.83670477194 3.87737149840 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
217 1 OR . 1 1 45 45 ALA MB H . . . 1 1 50 50 GLU HG3 H . . . . . 2.22417951046 1.60580769861 4.37184466915 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
217 2 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HB2 H . . . . . 2.22417951046 1.60580769861 4.37184466915 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
217 3 OR . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET HB3 H . . . . . 2.22417951046 1.60580769861 4.37184466915 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
218 1 . . 1 1 46 46 ALA MB H . . . 1 1 75 75 ILE MG H . . . . . 2.29211233493 1.63538996544 2.94883470442 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
219 1 . . 1 1 40 40 ALA MB H . . . 1 1 79 79 THR HA H . . . . . 3.09022669366 1.89653906638 5.71871102766 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
220 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 9 9 TRP HD1 H . . . . . 2.52752937806 1.72897878344 3.32607997268 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
221 1 . . 1 1 88 88 LEU MD2 H . . . 2 1 51 51 TYR QD H . . . . . 2.22802145469 1.60751150437 2.84853140501 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
222 1 OR . 1 1 75 75 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 2.51466961841 1.72422420719 3.30511502963 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
222 2 OR . 1 1 69 69 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 2.51466961841 1.72422420719 3.30511502963 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
223 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HG3 H . . . . . 2.17431977750 1.58336146565 2.76527808935 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
224 1 OR . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE QE H . . . . . 2.61082577602 1.75877437193 3.46287718011 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
224 2 OR . 1 1 88 88 LEU MD1 H . . . 1 1 8 8 PHE QE H . . . . . 2.61082577602 1.75877437193 3.46287718011 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
225 1 OR . 1 1 58 58 LYS HD3 H . . . 1 1 38 38 GLN HG2 H . . . . . 2.68226266609 1.78294603985 3.58157929232 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
225 2 OR . 1 1 58 58 LYS HD2 H . . . 1 1 38 38 GLN HG3 H . . . . . 2.68226266609 1.78294603985 3.58157929232 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
225 3 OR . 1 1 58 58 LYS HD3 H . . . 1 1 38 38 GLN HG3 H . . . . . 2.68226266609 1.78294603985 3.58157929232 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
225 4 OR . 1 1 58 58 LYS HD2 H . . . 1 1 38 38 GLN HG2 H . . . . . 2.68226266609 1.78294603985 3.58157929232 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
226 1 . . 1 1 83 83 ALA HA H . . . 1 1 37 37 GLY HA2 H . . . . . 2.77087838075 1.50000000000 3.73059925586 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
227 1 . . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD1 H . . . . . 3.16614599486 1.91308593726 4.41920605245 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
228 1 . . 1 1 46 46 ALA MB H . . . 1 1 75 75 ILE HA H . . . . . 3.28481691407 1.93606414420 4.63356968394 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
229 1 OR . 1 1 20 20 SER HB3 H . . . 1 1 76 76 MET HA H . . . . . 3.20026507949 1.92005300712 5.55613576409 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
229 2 OR . 1 1 20 20 SER HB2 H . . . 1 1 76 76 MET HA H . . . . . 3.20026507949 1.92005300712 5.55613576409 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
230 1 OR . 1 1 77 77 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 2.10907281803 1.55304929906 2.66509633700 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
230 2 OR . 1 1 75 75 ILE MD H . . . 1 1 69 69 PHE QE H . . . . . 2.10907281803 1.55304929906 2.66509633700 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
231 1 . . 1 1 69 69 PHE HZ H . . . 1 1 75 75 ILE MD H . . . . . 2.49147919303 1.71554562187 4.64355441296 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
232 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HA H . . . . . 2.38708671084 1.67481384021 3.09935958147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
233 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 53 53 VAL MG1 H . . . . . 2.17324435429 1.58287047636 4.68413296295 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
234 1 OR . 1 1 13 13 MET ME H . . . 1 1 11 11 LEU MD1 H . . . . . 1.86269588285 1.42899138885 3.44030852475 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
234 2 OR . 1 1 13 13 MET ME H . . . 1 1 42 42 LEU MD1 H . . . . . 1.86269588285 1.42899138885 3.44030852475 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
235 1 . . 1 1 45 45 ALA MB H . . . 1 1 76 76 MET H H . . . . . 2.79234414516 1.81769591703 3.76699237329 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
236 1 . . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE MG H . . . . . 2.66987907805 1.77884729162 3.56091086448 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
237 1 . . 1 1 75 75 ILE MG H . . . 1 1 23 23 ILE MD H . . . . . 3.02409224278 1.88095050617 4.16723397938 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
238 1 . . 1 1 17 17 ARG HB2 H . . . 1 1 19 19 TYR QE H . . . . . 2.39450951564 1.67780003808 4.79134897492 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
239 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.30766753223 1.64200135232 5.49250521331 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
240 1 . . 1 1 45 45 ALA MB H . . . 1 1 51 51 TYR H H . . . . . 2.89467562894 1.84728225434 3.94206900354 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
241 1 OR . 1 1 18 18 LYS HD2 H . . . 1 1 76 76 MET ME H . . . . . 2.41217339642 1.68485083462 4.18056763930 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
241 2 OR . 1 1 18 18 LYS HD3 H . . . 1 1 76 76 MET ME H . . . . . 2.41217339642 1.68485083462 4.18056763930 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
242 1 . . 1 1 79 79 THR MG H . . . 1 1 85 85 VAL MG2 H . . . . . 2.16762528171 1.58030036147 2.75495020194 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
243 1 . . 1 1 51 51 TYR QE H . . . 1 1 49 49 GLN HB3 H . . . . . 2.95815821416 1.86432071166 4.05199571666 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
244 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 34 34 LEU HA H . . . . . 2.91128699260 1.85183799844 3.97073598676 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
245 1 . . 1 1 16 16 GLU HG3 H . . . 1 1 80 80 ALA MB H . . . . . 3.01672257434 1.87914568802 4.15429946065 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
246 1 . . 1 1 13 13 MET ME H . . . 1 1 19 19 TYR QD H . . . . . 2.69772301469 1.78800933169 3.60743669769 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
247 1 . . 2 1 70 70 SER HB3 H . . . 1 1 7 7 MET HG2 H . . . . . 2.56962811809 1.74425453493 3.39500170125 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
248 1 . . 1 1 76 76 MET ME H . . . 1 1 18 18 LYS HE3 H . . . . . 2.65915660982 1.77526737538 3.54304584427 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
249 1 OR . 1 1 40 40 ALA MB H . . . 1 1 56 56 VAL MG1 H . . . . . 1.85113705253 1.42279850413 3.51482360621 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
249 2 OR . 1 1 40 40 ALA MB H . . . 1 1 56 56 VAL MG2 H . . . . . 1.85113705253 1.42279850413 3.51482360621 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
250 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 27 27 PHE HB2 H . . . . . 2.79583611771 1.81874866807 3.77292356734 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
251 1 OR . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET HG2 H . . . . . 2.97842890730 1.86954906282 5.25781374801 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
251 2 OR . 1 1 78 78 TYR QD H . . . 1 1 76 76 MET HG3 H . . . . . 2.97842890730 1.86954906282 5.25781374801 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
252 1 OR . 1 1 29 29 ILE MD H . . . 1 1 69 69 PHE QE H . . . . . 2.12484761313 1.56047544075 2.68921978551 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
252 2 OR . 1 1 29 29 ILE MD H . . . 1 1 77 77 PHE QE H . . . . . 2.12484761313 1.56047544075 2.68921978551 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
253 1 . . 1 1 9 9 TRP HB2 H . . . 1 1 9 9 TRP HD1 H . . . . . 3.89376734034 1.99858932775 5.78894535292 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
254 1 . . 1 1 79 79 THR MG H . . . 1 1 42 42 LEU MD1 H . . . . . 1.96044993481 1.48002944145 2.44087042817 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
255 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 83 83 ALA MB H . . . . . 1.82351226848 1.40786264432 2.23916189265 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
256 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 77 77 PHE HA H . . . . . 2.88895144192 1.84569638770 5.27972780018 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
257 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE QD H . . . . . 3.16023213540 1.91184874170 4.40861552910 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
258 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 9 9 TRP HH2 H . . . . . 3.12048204678 1.90330602125 4.33765807232 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
259 1 . . 1 1 63 63 VAL MG2 H . . . 1 1 54 54 ALA HA H . . . . . 2.95966998273 1.86471418190 4.05462578357 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
260 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 75 75 ILE MD H . . . . . 2.91243498662 1.85215029271 3.97271968052 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
261 1 . . 1 1 34 34 LEU HA H . . . 1 1 85 85 VAL HA H . . . . . 3.44412751154 1.96137572207 4.92687930101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
262 1 . . 1 1 88 88 LEU MD1 H . . . 2 1 53 53 VAL HA H . . . . . 2.22292148111 1.60524899221 2.84059397000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
263 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 33 33 ALA H H . . . . . 3.18332958110 1.91663117836 4.45002798383 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
264 1 . . 1 1 29 29 ILE MD H . . . 1 1 75 75 ILE MD H . . . . . 3.12397227250 1.90407192758 4.34387261741 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
265 1 . . 1 1 75 75 ILE MG H . . . 1 1 69 69 PHE QD H . . . . . 2.78681442378 1.81602259471 3.75760625285 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
266 1 . . 1 1 87 87 LEU HB3 H . . . 1 1 29 29 ILE MG H . . . . . 2.32257514981 1.64828073400 4.82210298840 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
267 1 . . 1 1 44 44 LEU HA H . . . 1 1 77 77 PHE HA H . . . . . 3.73819952919 1.99143256419 5.48496649419 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
268 1 . . 1 1 57 57 THR HA H . . . 1 1 39 39 GLU HA H . . . . . 2.82551285607 1.82757249359 3.82345321855 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
269 1 . . 1 1 77 77 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 4.30304332853 1.98852059263 6.61756606443 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
270 1 . . 1 1 29 29 ILE H H . . . 1 1 68 68 ASN HA H . . . . . 2.83114586783 1.82922250221 3.83306923345 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
271 1 . . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HE2 H . . . . . 3.34177736161 1.94584286979 4.73771185342 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
272 1 . . 1 1 40 40 ALA H H . . . 1 1 57 57 THR MG H . . . . . 2.53203749863 1.73063576182 3.33343923545 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
273 1 . . 1 1 43 43 TYR QE H . . . 1 1 52 52 ILE HB H . . . . . 2.76239434387 1.80854152999 3.71624715775 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
274 1 OR . 1 1 91 91 LEU MD1 H . . . 1 1 9 9 TRP HB3 H . . . . . 2.35176486709 1.66041511833 4.65279839314 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
274 2 OR . 1 1 91 91 LEU MD1 H . . . 1 1 7 7 MET HG3 H . . . . . 2.35176486709 1.66041511833 4.65279839314 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
274 3 OR . 1 1 91 91 LEU MD1 H . . . 1 1 7 7 MET HG2 H . . . . . 2.35176486709 1.66041511833 4.65279839314 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
275 1 . . 1 1 83 83 ALA MB H . . . 1 1 39 39 GLU H H . . . . . 2.59767822252 1.75418670405 3.44116974098 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
276 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 9 9 TRP HH2 H . . . . . 2.73325722232 1.79942034190 3.66709410273 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
277 1 . . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE MD H . . . . . 2.89554163699 1.84752146555 3.94356180844 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
278 1 . . 1 1 43 43 TYR QE H . . . 1 1 80 80 ALA MB H . . . . . 1.80663731959 1.39864501902 3.27256269729 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
279 1 OR . 1 1 76 76 MET HG3 H . . . 1 1 78 78 TYR QE H . . . . . 3.45717347581 1.96316742058 4.95117953105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
279 2 OR . 1 1 76 76 MET HG2 H . . . 1 1 78 78 TYR QE H . . . . . 3.45717347581 1.96316742058 4.95117953105 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
280 1 . . 1 1 57 57 THR MG H . . . 1 1 39 39 GLU HB2 H . . . . . 2.22221623634 1.60493561121 2.83949686147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
281 1 . . 1 1 50 50 GLU HA H . . . 1 1 45 45 ALA HA H . . . . . 2.74713366744 1.80379074409 3.69047659078 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
282 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 69 69 PHE QD H . . . . . 2.91904057215 1.85394083942 3.98414030488 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
283 1 . . 1 1 32 32 VAL MG2 H . . . 1 1 63 63 VAL H H . . . . . 2.51808372011 1.72549051742 3.31067692279 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
284 1 . . 1 1 63 63 VAL H H . . . 1 1 33 33 ALA MB H . . . . . 2.59160813504 1.75205404434 4.53684312240 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
285 1 . . 1 1 46 46 ALA HA H . . . 1 1 75 75 ILE HA H . . . . . 2.91090734103 1.85173464752 3.97008003455 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
286 1 . . 1 1 69 69 PHE QE H . . . 1 1 67 67 LEU MD1 H . . . . . 2.47947522327 1.71100055042 3.24794989611 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
287 1 . . 1 1 50 50 GLU HA H . . . 1 1 45 45 ALA HA H . . . . . 2.51079375579 1.72278309527 3.29880441630 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
288 1 . . 1 1 88 88 LEU MD2 H . . . 2 1 51 51 TYR HA H . . . . . 2.81326237717 1.82395672682 5.20090928255 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
289 1 . . 1 1 76 76 MET ME H . . . 1 1 45 45 ALA H H . . . . . 3.01988133190 1.87992092456 4.15984173925 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
290 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE HZ H . . . . . 2.50699335118 1.72136639332 3.29262030904 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
291 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 13 13 MET ME H . . . . . 2.68085053883 1.78248058739 5.26026576315 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
292 1 . . 1 1 29 29 ILE MG H . . . 1 1 88 88 LEU H H . . . . . 2.90886858786 1.85117903018 3.96655814554 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
293 1 . . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE MD H . . . . . 2.23520371528 1.61068675918 2.85972067138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
294 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 19 19 TYR QD H . . . . . 3.28268103352 1.93568168754 4.62968037950 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
295 1 . . 1 1 7 7 MET HG2 H . . . 2 1 70 70 SER HA H . . . . . 2.73647125972 1.80043689031 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
296 1 . . 1 1 51 51 TYR QE H . . . 1 1 49 49 GLN HG3 H . . . . . 2.90405822619 1.84986395355 3.95825249883 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
297 1 OR . 1 1 58 58 LYS HD2 H . . . 1 1 38 38 GLN HG3 H . . . . . 2.92673446807 1.85601263725 3.99745629890 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
297 2 OR . 1 1 58 58 LYS HD3 H . . . 1 1 38 38 GLN HG3 H . . . . . 2.92673446807 1.85601263725 3.99745629890 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
298 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 13 13 MET ME H . . . . . 2.62199231312 1.76263685186 5.52116034778 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
299 1 OR . 1 1 77 77 PHE QD H . . . 1 1 44 44 LEU MD1 H . . . . . 2.36410659063 1.66548159415 3.06273158711 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
299 2 OR . 1 1 77 77 PHE QD H . . . 1 1 44 44 LEU MD2 H . . . . . 2.36410659063 1.66548159415 3.06273158711 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
300 1 . . 1 1 75 75 ILE MD H . . . 1 1 23 23 ILE MD H . . . . . 2.15808603478 1.57591911809 2.74025295147 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
301 1 OR . 1 1 77 77 PHE QD H . . . 1 1 11 11 LEU MD1 H . . . . . 2.53490163108 1.73168584618 3.33811741599 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
301 2 OR . 1 1 77 77 PHE QD H . . . 1 1 42 42 LEU MD1 H . . . . . 2.53490163108 1.73168584618 3.33811741599 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
302 1 . . 1 1 67 67 LEU MD1 H . . . 5 1 89 89 GLY H H . . . . . 3.12501994990 1.90430123899 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
303 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 40 40 ALA MB H . . . . . 2.53859551053 1.73303711477 3.34415390630 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
304 1 . . 1 1 43 43 TYR QE H . . . 1 1 52 52 ILE MD H . . . . . 2.77627650731 1.81281260168 3.73974041294 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
305 1 OR . 1 1 19 19 TYR QE H . . . 1 1 17 17 ARG HD3 H . . . . . 2.45898102997 1.70315756675 3.21480449318 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
305 2 OR . 1 1 19 19 TYR QE H . . . 1 1 17 17 ARG HD2 H . . . . . 2.45898102997 1.70315756675 3.21480449318 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
306 1 . . 1 1 78 78 TYR QE H . . . 1 1 18 18 LYS HE3 H . . . . . 3.30976948021 1.94044772869 4.67909123173 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
307 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 69 69 PHE QD H . . . . . 2.88934440601 1.84580551894 3.93288329308 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
308 1 . . 1 1 19 19 TYR QE H . . . 1 1 13 13 MET HA H . . . . . 3.07573251519 1.89321620207 4.25824882832 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
309 1 . . 1 1 69 69 PHE HZ H . . . 1 1 75 75 ILE MD H . . . . . 3.75878328341 1.99272681195 5.52483975486 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
310 1 OR . 1 1 38 38 GLN HA H . . . 1 1 58 58 LYS HD2 H . . . . . 2.11235460339 1.55459935708 2.67010984970 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
310 2 OR . 1 1 38 38 GLN HA H . . . 1 1 58 58 LYS HD3 H . . . . . 2.11235460339 1.55459935708 2.67010984970 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
311 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 25 25 LYS HB3 H . . . . . 2.42517292230 1.68998995942 4.34568113636 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 8
stop_
save_
save_ARIA2_REJECT_f5_run62_Dists_69|1_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_REJECT_f5_run62_Dists_69|1_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 9
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 *INACTIVE* DistanceConstraints list run51_S2_cnoe_69|1 69|1, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-13C NOESY" . . . . 1 1 9
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 9
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 9 9 TRP HE3 H . . . . . 3.63078166504 1.98295972764 5.27860360243 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
2 1 . . 1 1 65 65 LEU MD1 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.30545645595 1.64106527217 2.96984763974 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
3 1 OR . 1 1 87 87 LEU MD2 H . . . 1 1 77 77 PHE HZ H . . . . . 3.04711694491 1.88650173542 4.20773215441 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
3 2 OR . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HZ2 H . . . . . 3.04711694491 1.88650173542 4.20773215441 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
4 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 69 69 PHE HZ H . . . . . 3.44072504935 1.96090144120 5.92528705007 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
5 1 . . 1 1 67 67 LEU MD2 H . . . 5 1 8 8 PHE QE H . . . . . 3.35501837990 1.94799983872 4.76203692108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
6 1 . . 1 1 69 69 PHE QE H . . . 1 1 53 53 VAL MG2 H . . . . . 3.32488308922 1.94302714460 4.70673903384 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
7 1 . . 1 1 29 29 ILE MD H . . . 1 1 69 69 PHE HZ H . . . . . 2.51411603059 1.72401860368 3.30421345750 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
8 1 OR . 1 1 87 87 LEU MD1 H . . . 1 1 32 32 VAL MG1 H . . . . . 2.00277342798 1.50138575250 2.50416110345 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
8 2 OR . 1 1 87 87 LEU MD1 H . . . 1 1 32 32 VAL MG2 H . . . . . 2.00277342798 1.50138575250 2.50416110345 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
8 3 OR . 1 1 87 87 LEU MD1 H . . . 1 1 11 11 LEU MD1 H . . . . . 2.00277342798 1.50138575250 2.50416110345 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 9
stop_
save_
save_ARIA2_f5_run62_Dists_69|5_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_f5_run62_Dists_69|5_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 10
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 DistanceConstraints list run51_S3_nnoe_69|5 69|5, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-15N NOESY" . . . . 1 1 10
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 10
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 32 32 VAL MG2 H . . . 1 1 56 56 VAL H H . . . . . 2.86245215398 1.83824811225 5.24778295485 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
2 1 . . 2 1 51 51 TYR QD H . . . 1 1 87 87 LEU H H . . . . . 3.59939988666 1.97993994365 5.21885982967 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
3 1 . . 1 1 63 63 VAL H H . . . 1 1 33 33 ALA H H . . . . . 5.10048435986 1.84861677171 8.35235194800 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
4 1 . . 5 1 88 88 LEU MD2 H . . . 1 1 53 53 VAL H H . . . . . 3.65887495884 1.98545421329 5.33229570439 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
5 1 . . 1 1 41 41 LYS H H . . . 1 1 80 80 ALA H H . . . . . 2.29045625013 1.63468252091 2.94622997935 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
6 1 . . 1 1 32 32 VAL H H . . . 1 1 64 64 ALA H H . . . . . 4.53359668345 1.96440932243 7.10278404447 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
7 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 33 33 ALA H H . . . . . 3.44820708233 1.96194057200 4.93447359265 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
8 1 . . 1 1 83 83 ALA H H . . . 1 1 38 38 GLN H H . . . . . 3.32217039222 1.94256837785 4.70177240658 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
9 1 . . 1 1 57 57 THR H H . . . 1 1 62 62 GLN H H . . . . . 3.66372263583 1.98586469179 5.34158057987 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
10 1 . . 1 1 43 43 TYR H H . . . 1 1 78 78 TYR H H . . . . . 2.51832282038 1.72557909193 4.36747245339 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
11 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 31 31 GLY H H . . . . . 4.67749423098 1.94262519587 7.41236326609 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
12 1 . . 1 1 52 52 ILE H H . . . 5 1 86 86 SER HG H . . . . . 2.35562573357 1.66200415899 3.04924730815 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
13 1 . . 1 1 85 85 VAL MG2 H . . . 1 1 13 13 MET H H . . . . . 2.75765029072 1.80707089998 3.70822968146 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
14 1 . . 1 1 78 78 TYR QE H . . . 1 1 45 45 ALA H H . . . . . 3.29505286763 1.93788119257 4.65222454269 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
15 1 . . 1 1 69 69 PHE QD H . . . 1 1 29 29 ILE H H . . . . . 4.00098479700 1.99999987877 6.00196971523 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
16 1 . . 1 1 17 17 ARG H H . . . 1 1 14 14 LYS H H . . . . . 3.78613112358 1.99428251296 5.57797973420 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
17 1 . . 1 1 86 86 SER HG H . . . 1 1 12 12 ASN H H . . . . . 4.20670905656 1.99465892074 6.41875919238 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
18 1 . . 1 1 62 62 GLN HE22 H . . . 2 1 55 55 THR H H . . . . . 3.50996250105 1.96998290620 5.04994209589 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
19 1 . . 1 1 77 77 PHE H H . . . 1 1 19 19 TYR H H . . . . . 2.78821658230 1.81644761857 3.75998554603 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
20 1 . . 1 1 27 27 PHE QD H . . . 1 1 69 69 PHE H H . . . . . 4.09031793248 1.99898033388 6.18165553108 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
21 1 . . 1 1 85 85 VAL H H . . . 1 1 13 13 MET H H . . . . . 2.48198792770 1.71195491854 4.29922108110 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
22 1 . . 1 1 84 84 SER H H . . . 1 1 35 35 ASP H H . . . . . 3.77534447326 1.99369123679 5.55699770974 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
23 1 . . 1 1 33 33 ALA H H . . . 1 1 86 86 SER H H . . . . . 2.32942525705 1.65114750353 3.00770301057 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
24 1 . . 1 1 43 43 TYR H H . . . 1 1 54 54 ALA H H . . . . . 3.90062601830 1.99876560147 5.80248643513 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
25 1 . . 1 1 92 92 HIS H H . . . 1 1 26 26 SER H H . . . . . 4.37973113391 1.98197553324 6.77748673458 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
26 1 . . 1 1 62 62 GLN H H . . . 1 1 34 34 LEU H H . . . . . 4.03043464310 1.99988421656 6.06098506963 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
27 1 OR . 1 1 56 56 VAL MG1 H . . . 1 1 42 42 LEU H H . . . . . 3.00558003460 1.87639111655 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
27 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 42 42 LEU H H . . . . . 3.00558003460 1.87639111655 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
28 1 . . 1 1 55 55 THR H H . . . 5 1 62 62 GLN HE22 H . . . . . 2.77511759368 1.81245788634 3.73777730102 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
29 1 . . 1 1 38 38 GLN H H . . . 1 1 82 82 ASP H H . . . . . 3.52572331091 1.97188270277 5.07956391905 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
30 1 . . 1 1 30 30 SER H H . . . 1 1 30 30 SER HG H . . . . . 3.85121441741 3.08097153393 4.62145730089 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
31 1 . . 1 1 73 73 ASP H H . . . 1 1 70 70 SER H H . . . . . 2.89446134027 1.84722303398 4.95604073742 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
32 1 . . 1 1 13 13 MET H H . . . 1 1 87 87 LEU H H . . . . . 4.02877276601 1.99989651599 6.05764901604 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
33 1 . . 1 1 29 29 ILE H H . . . 1 1 67 67 LEU MD2 H . . . . . 4.60028442167 1.95495732664 7.24561151671 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
34 1 . . 1 1 42 42 LEU H H . . . 1 1 53 53 VAL H H . . . . . 3.27502135278 1.93430074513 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
35 1 . . 1 1 9 9 TRP HZ3 H . . . 1 1 89 89 GLY H H . . . . . 3.60102413634 1.98010228253 5.22194599016 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
36 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE H H . . . . . 2.47735897355 1.71019553807 3.24452240902 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
37 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 21 21 GLN HE22 H . . . . . 3.85087771173 1.99722031789 5.70453510557 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
38 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 21 21 GLN HE21 H . . . . . 3.38763464136 1.95312608344 4.82214319929 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
39 1 . . 1 1 42 42 LEU H H . . . 1 1 55 55 THR HG1 H . . . . . 4.72979544203 1.93342482660 7.52616605746 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
40 1 . . 1 1 21 21 GLN HE22 H . . . 1 1 21 21 GLN HE21 H . . . . . 2.44953730780 1.69950818001 3.19956643559 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
41 1 OR . 1 1 19 19 TYR QE H . . . 1 1 21 21 GLN HE22 H . . . . . 3.36153520143 1.94904533762 4.77402506524 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
41 2 OR . 1 1 77 77 PHE QD H . . . 1 1 21 21 GLN HE22 H . . . . . 3.36153520143 1.94904533762 4.77402506524 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
42 1 . . 1 1 51 51 TYR QD H . . . 1 1 46 46 ALA H H . . . . . 2.72931113853 1.79816872717 3.66045354988 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
43 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 87 87 LEU H H . . . . . 3.84801824411 1.99711269323 5.69892379499 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
44 1 . . 1 1 86 86 SER HG H . . . 1 1 12 12 ASN HD22 H . . . . . 3.58862906269 1.97884674399 5.19841138139 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
45 1 . . 1 1 77 77 PHE H H . . . 1 1 20 20 SER H H . . . . . 4.94923352094 1.88736946534 8.01109757654 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
46 1 . . 1 1 32 32 VAL MG2 H . . . 1 1 42 42 LEU H H . . . . . 3.89656590693 1.99866267355 5.79446914031 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
47 1 . . 1 1 77 77 PHE H H . . . 1 1 20 20 SER H H . . . . . 4.42693940042 1.97721534355 6.87666345730 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
48 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 31 31 GLY H H . . . . . 4.73343923197 1.93275836163 7.53412010232 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
49 1 . . 2 1 55 55 THR H H . . . 1 1 62 62 GLN HE21 H . . . . . 3.30120738822 1.93896111071 4.66345366572 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
50 1 . . 1 1 85 85 VAL MG2 H . . . 1 1 41 41 LYS H H . . . . . 3.32312404803 1.94272986821 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
51 1 . . 1 1 17 17 ARG H H . . . 1 1 14 14 LYS H H . . . . . 4.00508264266 1.99999677084 6.01016851447 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
52 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 11 11 LEU H H . . . . . 3.46461934670 1.96417094451 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
53 1 . . 1 1 77 77 PHE H H . . . 1 1 21 21 GLN HE22 H . . . . . 4.25413297813 1.99192705368 6.51633890259 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
54 1 OR . 1 1 40 40 ALA H H . . . 1 1 58 58 LYS H H . . . . . 3.91586709244 1.99911520673 5.83261897814 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
54 2 OR . 1 1 40 40 ALA H H . . . 1 1 83 83 ALA H H . . . . . 3.91586709244 1.99911520673 5.83261897814 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
55 1 . . 2 1 51 51 TYR QD H . . . 1 1 11 11 LEU H H . . . . . 3.09868000344 1.89845278298 4.29890722391 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
56 1 . . 1 1 78 78 TYR QD H . . . 1 1 45 45 ALA H H . . . . . 3.58255301185 1.97821725151 5.18688877219 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
57 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 77 77 PHE H H . . . . . 5.02277280605 1.86924197340 8.17630363869 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
58 1 . . 1 1 16 16 GLU H H . . . 1 1 81 81 GLY H H . . . . . 3.76745654512 1.99324044270 5.54167264754 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
59 1 . . 1 1 27 27 PHE QE H . . . 1 1 9 9 TRP HE1 H . . . . . 3.93858516641 1.99952852728 5.87764180555 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
60 1 . . 1 1 9 9 TRP H H . . . 1 1 91 91 LEU H H . . . . . 3.68260702481 1.98740771241 5.37780633721 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
61 1 . . 1 1 29 29 ILE H H . . . 1 1 67 67 LEU H H . . . . . 2.46668207106 1.70611701610 4.25838093330 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
62 1 . . 1 1 63 63 VAL MG1 H . . . 1 1 56 56 VAL H H . . . . . 3.06881892429 1.89161272553 4.24602512305 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
63 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 35 35 ASP H H . . . . . 3.23424495402 1.92670240119 4.54178750685 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
64 1 . . 1 1 87 87 LEU H H . . . 1 1 11 11 LEU H H . . . . . 2.43645644270 1.69441644306 3.17849644235 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
65 1 . . 1 1 56 56 VAL MG1 H . . . 1 1 63 63 VAL H H . . . . . 2.51890589276 1.72579503069 3.31201675484 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
66 1 . . 2 1 51 51 TYR QD H . . . 1 1 12 12 ASN H H . . . . . 3.28126849674 1.93542812828 4.62710886521 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
67 1 . . 1 1 88 88 LEU H H . . . 1 1 30 30 SER H H . . . . . 3.17787149725 1.91551309062 4.44022990389 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
68 1 . . 1 1 43 43 TYR H H . . . 1 1 78 78 TYR H H . . . . . 2.62913950279 1.76509268715 3.49318631843 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
69 1 OR . 1 1 65 65 LEU MD1 H . . . 1 1 54 54 ALA H H . . . . . 3.54497299597 1.97411880320 5.11582718874 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
69 2 OR . 1 1 32 32 VAL MG2 H . . . 1 1 54 54 ALA H H . . . . . 3.54497299597 1.97411880320 5.11582718874 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
70 1 . . 1 1 19 19 TYR QD H . . . 1 1 14 14 LYS H H . . . . . 3.34058739871 1.94564687766 5.77777576735 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
71 1 . . 1 1 28 28 HIS H H . . . 1 1 92 92 HIS H H . . . . . 3.93151427753 1.99941371323 5.86361484183 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
72 1 . . 1 1 51 51 TYR H H . . . 5 1 86 86 SER HG H . . . . . 4.65978663279 1.94558519990 7.37398806569 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
73 1 . . 1 1 77 77 PHE H H . . . 1 1 19 19 TYR H H . . . . . 2.68329963106 1.78328751731 3.58331174482 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
74 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 21 21 GLN HE22 H . . . . . 3.18613497519 1.91720296517 4.45506698520 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
75 1 . . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS H H . . . . . 4.32394889856 1.98688213889 6.66101565824 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
76 1 . . 1 1 17 17 ARG H H . . . 1 1 79 79 THR H H . . . . . 3.22640868378 1.92519455943 4.52762280813 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
77 1 . . 1 1 19 19 TYR QD H . . . 1 1 21 21 GLN HE22 H . . . . . 4.54021251957 1.96352130421 7.11690373492 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
78 1 . . 1 1 42 42 LEU MD2 H . . . 1 1 54 54 ALA H H . . . . . 4.02236542449 1.99993747347 6.04479337551 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
79 1 . . 1 1 63 63 VAL MG1 H . . . 1 1 54 54 ALA H H . . . . . 3.87494071209 1.99804502181 5.75183640238 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
80 1 . . 1 1 28 28 HIS H H . . . 1 1 92 92 HIS H H . . . . . 3.89004903869 1.99848884826 5.78160922912 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
81 1 . . 1 1 76 76 MET H H . . . 1 1 45 45 ALA H H . . . . . 2.44811718673 1.69895746674 3.19727690673 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
82 1 OR . 1 1 54 54 ALA H H . . . 1 1 67 67 LEU MD1 H . . . . . 3.65980808733 1.98553368282 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
82 2 OR . 1 1 54 54 ALA H H . . . 5 1 88 88 LEU MD2 H . . . . . 3.65980808733 1.98553368282 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
83 1 . . 1 1 60 60 ILE H H . . . 1 1 57 57 THR HG1 H . . . . . 2.44698368516 1.69851754073 3.19544982960 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
84 1 . . 1 1 17 17 ARG H H . . . 1 1 79 79 THR HG1 H . . . . . 3.87276610847 1.99797644211 5.74755577484 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
85 1 . . 1 1 54 54 ALA H H . . . 1 1 44 44 LEU H H . . . . . 4.17277976374 1.99626839416 6.34929113332 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
86 1 . . 1 1 47 47 GLU H H . . . 1 1 74 74 ARG H H . . . . . 3.94653197785 1.99964264633 5.89342130936 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
87 1 . . 1 1 43 43 TYR H H . . . 1 1 79 79 THR H H . . . . . 5.20847253876 1.81744926538 8.59949581214 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
88 1 . . 1 1 16 16 GLU H H . . . 1 1 79 79 THR H H . . . . . 3.00163512765 1.87540844771 5.15815440625 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
89 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 32 32 VAL H H . . . . . 3.23158384260 1.92619207613 5.78095739281 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
90 1 . . 1 1 32 32 VAL H H . . . 1 1 65 65 LEU H H . . . . . 3.31785239961 1.94183433141 4.69387046782 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
91 1 . . 1 1 41 41 LYS H H . . . 1 1 80 80 ALA H H . . . . . 2.26414623938 1.62335146522 2.90494101354 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
92 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 21 21 GLN HE21 H . . . . . 4.20124767491 1.99493742167 6.40755792815 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
93 1 . . 5 1 90 90 TYR QD H . . . 1 1 68 68 ASN HD21 H . . . . . 3.59156491369 1.97914759753 5.20398222984 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
94 1 . . 1 1 33 33 ALA H H . . . 1 1 86 86 SER H H . . . . . 2.28595678758 1.63275698325 2.93915659192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
95 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 11 11 LEU H H . . . . . 4.05880628294 1.99956772764 6.11804483823 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
96 1 . . 1 1 89 89 GLY H H . . . 1 1 8 8 PHE QD H . . . . . 3.99232592739 1.99999263858 5.98465921620 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
97 1 . . 1 1 87 87 LEU H H . . . 1 1 11 11 LEU H H . . . . . 2.45995528584 1.70353278480 3.21637778688 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
98 1 OR . 1 1 62 62 GLN H H . . . 1 1 56 56 VAL MG2 H . . . . . 2.77950147440 1.81379791862 3.74520503017 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
98 2 OR . 1 1 62 62 GLN H H . . . 1 1 56 56 VAL MG1 H . . . . . 2.77950147440 1.81379791862 3.74520503017 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
99 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE H H . . . . . 2.53273958832 1.73089336054 3.33458581610 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
100 1 . . 1 1 19 19 TYR QD H . . . 1 1 77 77 PHE H H . . . . . 3.51819110416 1.97098252349 5.06539968483 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
101 1 . . 1 1 28 28 HIS H H . . . 1 1 90 90 TYR QD H . . . . . 3.61145462243 1.98112906120 5.24178018366 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
102 1 . . 1 1 85 85 VAL H H . . . 1 1 35 35 ASP H H . . . . . 4.22255524639 1.99380864529 6.45130184748 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
103 1 . . 1 1 9 9 TRP HZ3 H . . . 1 1 87 87 LEU H H . . . . . 4.54360087045 1.96306226171 7.12413947920 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
104 1 . . 1 1 51 51 TYR H H . . . 1 1 46 46 ALA H H . . . . . 4.15936156457 1.99682548647 6.32189764267 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
105 1 . . 1 1 29 29 ILE H H . . . 1 1 68 68 ASN HA H . . . . . 3.25727353707 1.93104467516 4.58350239897 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
106 1 . . 1 1 34 34 LEU MD2 H . . . 1 1 58 58 LYS H H . . . . . 3.20449956914 1.92089738306 4.48810175521 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
107 1 . . 2 1 51 51 TYR QD H . . . 1 1 12 12 ASN HD21 H . . . . . 3.91873340838 1.99917446764 5.83829234913 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
108 1 . . 1 1 69 69 PHE H H . . . 1 1 27 27 PHE H H . . . . . 2.67656167076 1.78106387359 3.57205946794 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
109 1 . . 1 1 51 51 TYR QD H . . . 1 1 44 44 LEU H H . . . . . 3.50542714358 1.96942471121 5.04142957594 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
110 1 . . 1 1 54 54 ALA H H . . . 1 1 42 42 LEU H H . . . . . 2.49832410341 1.71812118770 4.32779432941 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
111 1 . . 1 1 57 57 THR H H . . . 1 1 63 63 VAL MG1 H . . . . . 3.87001298703 1.99788792206 5.74213805200 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
112 1 . . 5 1 12 12 ASN HD21 H . . . 1 1 50 50 GLU H H . . . . . 3.13249497464 1.90592937887 4.35906057040 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
113 1 . . 1 1 88 88 LEU H H . . . 1 1 31 31 GLY H H . . . . . 2.69368830159 1.78669371833 3.60068288486 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
114 1 . . 1 1 74 74 ARG HA H . . . 1 1 23 23 ILE H H . . . . . 3.96599751754 1.99985547890 5.93213955617 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
115 1 . . 2 1 51 51 TYR QE H . . . 1 1 12 12 ASN H H . . . . . 2.71037186149 1.79210740805 3.62863631493 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
116 1 . . 1 1 89 89 GLY H H . . . 1 1 9 9 TRP H H . . . . . 2.75469645998 1.80615238665 3.70324053330 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
117 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 38 38 GLN H H . . . . . 3.97911255138 1.99994546431 5.95827963845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
118 1 . . 1 1 19 19 TYR QE H . . . 1 1 13 13 MET H H . . . . . 4.39300102783 1.98069377402 6.80530828164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
119 1 . . 1 1 88 88 LEU H H . . . 1 1 30 30 SER H H . . . . . 3.42894619506 1.95923719398 4.89865519613 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
120 1 . . 1 1 55 55 THR H H . . . 5 1 62 62 GLN HE21 H . . . . . 3.10478915822 1.89982469360 4.30975362285 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
121 1 . . 1 1 85 85 VAL H H . . . 1 1 13 13 MET H H . . . . . 2.62969243002 1.76528214546 3.49410271458 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
122 1 . . 2 1 51 51 TYR QD H . . . 1 1 12 12 ASN HD22 H . . . . . 3.62783541613 1.98268669031 5.27298414195 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
123 1 . . 1 1 67 67 LEU H H . . . 5 1 30 30 SER HG H . . . . . 4.28441986160 3.42753588928 5.14130383391 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
124 1 . . 1 1 30 30 SER H H . . . 1 1 90 90 TYR H H . . . . . 4.80680615005 1.91863297953 7.69497932058 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
125 1 . . 1 1 29 29 ILE H H . . . 1 1 67 67 LEU H H . . . . . 2.52246522414 1.72711137326 3.31781907501 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
126 1 . . 1 1 69 69 PHE QE H . . . 1 1 29 29 ILE H H . . . . . 3.70644777927 1.98922838671 5.42366717182 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
127 1 . . 1 1 23 23 ILE MD H . . . 1 1 73 73 ASP H H . . . . . 3.73261215946 1.99106296784 5.47416135109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
128 1 OR . 1 1 43 43 TYR QE H . . . 1 1 80 80 ALA H H . . . . . 2.41874366157 1.68745354902 3.15003377412 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
128 2 OR . 1 1 43 43 TYR QD H . . . 1 1 80 80 ALA H H . . . . . 2.41874366157 1.68745354902 3.15003377412 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
129 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 83 83 ALA H H . . . . . 4.84184481768 1.91141216287 7.77227747250 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
130 1 . . 1 1 62 62 GLN H H . . . 1 1 34 34 LEU H H . . . . . 3.88023224747 1.99820696068 5.76225753426 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
131 1 . . 1 1 73 73 ASP H H . . . 1 1 70 70 SER H H . . . . . 3.76400609726 1.99303835973 5.53497383479 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
132 1 OR . 2 1 51 51 TYR QE H . . . 1 1 87 87 LEU H H . . . . . 3.92052424674 1.99921045058 5.84183804289 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
132 2 OR . 1 1 9 9 TRP HH2 H . . . 1 1 87 87 LEU H H . . . . . 3.92052424674 1.99921045058 5.84183804289 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
133 1 . . 1 1 76 76 MET H H . . . 1 1 21 21 GLN H H . . . . . 5.80916994072 1.59086301570 10.02747686580 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
134 1 . . 1 1 12 12 ASN HD21 H . . . 2 1 50 50 GLU H H . . . . . 4.27564552424 1.99050244312 6.56078860535 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
135 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL MG2 H . . . . . 3.39067087217 1.95358975175 4.82775199260 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
136 1 . . 1 1 57 57 THR H H . . . 1 1 34 34 LEU MD1 H . . . . . 3.39388065476 1.95407741742 5.94548082938 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
137 1 . . 1 1 51 51 TYR H H . . . 1 1 44 44 LEU H H . . . . . 2.52817494578 1.72921637622 3.32713351535 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
138 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 13 13 MET H H . . . . . 3.61088631871 1.98107381788 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
139 1 . . 1 1 89 89 GLY H H . . . 1 1 10 10 GLY H H . . . . . 4.17925979087 1.99598324092 6.36253634083 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
140 1 . . 1 1 76 76 MET H H . . . 1 1 45 45 ALA H H . . . . . 2.36692951280 1.66663509798 3.06722392762 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
141 1 . . 5 1 30 30 SER HG H . . . 1 1 66 66 ASP H H . . . . . 3.14760853491 2.51808682793 3.77713024189 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
142 1 . . 1 1 9 9 TRP HE3 H . . . 1 1 88 88 LEU H H . . . . . 4.00255857037 1.99999918171 6.00511795903 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
143 1 . . 1 1 87 87 LEU H H . . . 1 1 12 12 ASN H H . . . . . 4.33669790454 1.98582931513 6.68756649396 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
144 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 31 31 GLY H H . . . . . 3.53470084449 1.97293708699 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
145 1 . . 1 1 53 53 VAL MG1 H . . . 1 1 44 44 LEU H H . . . . . 2.80751594233 1.82224772153 5.65707948777 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
146 1 . . 1 1 78 78 TYR QD H . . . 1 1 19 19 TYR H H . . . . . 3.60264441206 1.98026356709 5.22502525703 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
147 1 . . 1 1 83 83 ALA H H . . . 1 1 38 38 GLN H H . . . . . 3.60690195946 1.98068424132 5.23311967760 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
148 1 . . 1 1 91 91 LEU H H . . . 1 1 7 7 MET H H . . . . . 4.91293026919 1.89581979045 7.93004074792 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
149 1 OR . 1 1 34 34 LEU MD2 H . . . 1 1 40 40 ALA H H . . . . . 3.11495401466 1.90208670048 4.32782132883 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
149 2 OR . 1 1 34 34 LEU MD1 H . . . 1 1 40 40 ALA H H . . . . . 3.11495401466 1.90208670048 4.32782132883 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
150 1 . . 1 1 80 80 ALA H H . . . 1 1 16 16 GLU H H . . . . . 4.24964763561 1.99220950725 6.50708576397 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
151 1 OR . 1 1 40 40 ALA H H . . . 1 1 56 56 VAL MG1 H . . . . . 2.61304581146 1.75954475986 3.46654686306 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
151 2 OR . 1 1 40 40 ALA H H . . . 1 1 56 56 VAL MG2 H . . . . . 2.61304581146 1.75954475986 3.46654686306 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
152 1 . . 1 1 17 17 ARG H H . . . 1 1 79 79 THR H H . . . . . 3.65746398363 1.98533363469 5.32959433258 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
153 1 . . 1 1 88 88 LEU H H . . . 1 1 31 31 GLY H H . . . . . 2.75561019286 1.80643675099 3.70478363474 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
154 1 . . 1 1 39 39 GLU H H . . . 1 1 82 82 ASP H H . . . . . 2.82380103788 1.82706950019 3.82053257557 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
155 1 . . 1 1 57 57 THR H H . . . 1 1 40 40 ALA H H . . . . . 3.98763545822 1.99998088976 5.97529002667 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
156 1 . . 1 1 27 27 PHE QD H . . . 1 1 90 90 TYR H H . . . . . 3.65195772490 1.98485832184 5.31905712795 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
157 1 . . 1 1 42 42 LEU MD1 H . . . 1 1 80 80 ALA H H . . . . . 4.56567515721 1.96000145206 7.17134886236 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
158 1 OR . 1 1 39 39 GLU H H . . . 1 1 58 58 LYS H H . . . . . 4.26289961621 1.99136047397 6.53443875845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
158 2 OR . 1 1 40 40 ALA H H . . . 1 1 58 58 LYS H H . . . . . 4.26289961621 1.99136047397 6.53443875845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
159 1 . . 1 1 43 43 TYR QD H . . . 1 1 53 53 VAL H H . . . . . 3.97637975759 1.99993026052 5.95282925467 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
160 1 . . 1 1 42 42 LEU MD2 H . . . 1 1 78 78 TYR H H . . . . . 4.70429704421 1.93799570919 7.47059837923 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
161 1 . . 1 1 9 9 TRP HZ3 H . . . 1 1 88 88 LEU H H . . . . . 3.82827883816 1.99631398032 5.66024369599 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
162 1 . . 1 1 63 63 VAL MG1 H . . . 1 1 55 55 THR H H . . . . . 2.98120199275 1.87025632755 4.09214765794 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
163 1 . . 1 1 70 70 SER HA H . . . 1 1 27 27 PHE H H . . . . . 3.46217756853 1.96384337903 4.96051175803 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
164 1 . . 1 1 12 12 ASN HD22 H . . . 2 1 50 50 GLU H H . . . . . 4.18948086876 1.99551212505 6.38344961246 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
165 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 92 92 HIS H H . . . . . 4.78092880614 1.92376877497 7.63808883731 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
166 1 . . 1 1 87 87 LEU H H . . . 1 1 12 12 ASN H H . . . . . 4.59987993583 1.95501800782 7.24474186383 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
167 1 . . 1 1 69 69 PHE QD H . . . 1 1 27 27 PHE H H . . . . . 3.73583455790 1.99127707740 5.48039203840 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
168 1 . . 1 1 23 23 ILE H H . . . 1 1 75 75 ILE H H . . . . . 4.76566411626 1.92671980763 7.60460842489 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
169 1 . . 1 1 32 32 VAL MG2 H . . . 1 1 63 63 VAL H H . . . . . 2.63898230822 1.76845385533 3.50951076111 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
170 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 27 27 PHE H H . . . . . 4.41063711777 1.97892214469 6.84235209085 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
171 1 . . 1 1 38 38 GLN H H . . . 1 1 82 82 ASP H H . . . . . 3.62163884577 1.98210535462 5.26117233692 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
172 1 . . 2 1 69 69 PHE QD H . . . 1 1 8 8 PHE H H . . . . . 4.28772845653 1.98965154191 6.58580537115 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
173 1 OR . 1 1 34 34 LEU MD1 H . . . 1 1 37 37 GLY H H . . . . . 3.12106820346 1.90343486213 4.33870154480 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
173 2 OR . 1 1 34 34 LEU MD2 H . . . 1 1 37 37 GLY H H . . . . . 3.12106820346 1.90343486213 4.33870154480 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
174 1 . . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE H H . . . . . 5.01631325943 1.87088841984 8.16173809902 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
175 1 . . 1 1 51 51 TYR H H . . . 1 1 44 44 LEU H H . . . . . 2.55947118743 1.74060959252 3.37833278234 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
176 1 . . 1 1 9 9 TRP H H . . . 1 1 90 90 TYR HA H . . . . . 3.84488403069 1.99699237951 5.69277568186 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
177 1 . . 1 1 39 39 GLU H H . . . 1 1 82 82 ASP H H . . . . . 2.83118512938 1.82923397478 3.83313628398 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
178 1 . . 1 1 89 89 GLY H H . . . 1 1 9 9 TRP H H . . . . . 2.83819757542 1.83127689078 3.84511826006 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
179 1 . . 1 1 63 63 VAL MG1 H . . . 1 1 63 63 VAL H H . . . . . 2.93772946453 1.85894766369 4.01651126538 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
180 1 . . 1 1 77 77 PHE H H . . . 1 1 45 45 ALA H H . . . . . 5.67685112333 1.64852128877 9.70518095790 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
181 1 . . 1 1 34 34 LEU H H . . . 2 1 55 55 THR HG1 H . . . . . 4.92177383464 1.89379162472 7.94975604455 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
182 1 OR . 1 1 56 56 VAL MG2 H . . . 1 1 60 60 ILE H H . . . . . 4.47447518700 1.97185916212 6.97709121188 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
182 2 OR . 1 1 56 56 VAL MG1 H . . . 1 1 60 60 ILE H H . . . . . 4.47447518700 1.97185916212 6.97709121188 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
183 1 . . 1 1 43 43 TYR H H . . . 1 1 79 79 THR HA H . . . . . 4.22161677528 1.99386075061 6.44937279995 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
184 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 9 9 TRP H H . . . . . 4.15282425362 1.99708059344 6.30856791380 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
185 1 . . 1 1 89 89 GLY H H . . . 1 1 30 30 SER H H . . . . . 4.22859293729 1.99346815863 6.46371771595 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
186 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 33 33 ALA H H . . . . . 4.94633761105 1.88805564074 8.00461958136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
187 1 OR . 1 1 44 44 LEU MD1 H . . . 1 1 76 76 MET H H . . . . . 2.91058585290 1.85164710201 3.96952460378 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
187 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 76 76 MET H H . . . . . 2.91058585290 1.85164710201 3.96952460378 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
188 1 OR . 1 1 56 56 VAL MG1 H . . . 1 1 34 34 LEU H H . . . . . 2.60455806191 1.75659272468 3.45252339915 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
188 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 34 34 LEU H H . . . . . 2.60455806191 1.75659272468 3.45252339915 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
189 1 . . 1 1 29 29 ILE H H . . . 1 1 69 69 PHE H H . . . . . 5.06044833045 1.85943116730 8.26146549361 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
190 1 . . 1 1 42 42 LEU MD1 H . . . 1 1 78 78 TYR H H . . . . . 2.76483843578 1.80929698878 3.72037988277 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
191 1 . . 1 1 46 46 ALA H H . . . 1 1 49 49 GLN H H . . . . . 2.55291932698 1.73824469072 3.36759396324 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
192 1 . . 1 1 41 41 LYS H H . . . 1 1 79 79 THR HA H . . . . . 4.66542403884 1.94465135607 7.38619672160 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
193 1 OR . 1 1 89 89 GLY H H . . . 1 1 30 30 SER H H . . . . . 4.34586866172 1.98504685861 6.70669046483 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
193 2 OR . 1 1 30 30 SER H H . . . 1 1 90 90 TYR H H . . . . . 4.34586866172 1.98504685861 6.70669046483 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
194 1 . . 1 1 43 43 TYR QE H . . . 1 1 52 52 ILE H H . . . . . 3.42254250454 1.95831785512 5.91065417205 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
195 1 . . 1 1 30 30 SER H H . . . 1 1 65 65 LEU H H . . . . . 4.27647501350 1.99044519586 6.56250483114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
196 1 . . 1 1 28 28 HIS H H . . . 1 1 90 90 TYR H H . . . . . 2.56663305144 1.74318239885 3.39008370403 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
197 1 . . 1 1 65 65 LEU MD1 H . . . 1 1 31 31 GLY H H . . . . . 4.04918665477 1.99969758412 6.09867572542 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
198 1 . . 1 1 9 9 TRP HE3 H . . . 1 1 89 89 GLY H H . . . . . 2.40773264109 1.68308558222 4.15825044372 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
199 1 . . 1 1 28 28 HIS H H . . . 1 1 90 90 TYR H H . . . . . 3.08354612266 1.89501403634 4.27207820898 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
200 1 . . 1 1 85 85 VAL H H . . . 1 1 79 79 THR HG1 H . . . . . 4.60957720536 1.95355195384 7.26560245688 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
201 1 . . 1 1 9 9 TRP H H . . . 1 1 90 90 TYR H H . . . . . 3.94284776868 1.99959170281 5.88610383454 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
202 1 . . 1 1 60 60 ILE MD H . . . 1 1 55 55 THR H H . . . . . 3.98199676579 1.99995948544 5.96403404613 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
203 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 30 30 SER H H . . . . . 4.25587842976 1.99181577865 6.51994108087 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
204 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 9 9 TRP HE1 H . . . . . 4.12547298622 1.99803206622 6.25291390623 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
205 1 . . 1 1 33 33 ALA H H . . . 1 1 87 87 LEU H H . . . . . 4.56877492224 1.95956188598 7.17798795849 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
206 1 . . 1 1 77 77 PHE H H . . . 1 1 21 21 GLN HE21 H . . . . . 3.46857975541 1.96469906546 4.97246044537 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
207 1 . . 1 1 52 52 ILE MD H . . . 1 1 42 42 LEU H H . . . . . 3.33380810573 1.94452354500 4.72309266646 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
208 1 . . 1 1 9 9 TRP H H . . . 1 1 91 91 LEU H H . . . . . 3.66390637021 1.98588013400 5.34193260643 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
209 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 25 25 LYS H H . . . . . 4.14281681290 1.99745041974 6.28818320605 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
210 1 . . 1 1 50 50 GLU H H . . . 5 1 12 12 ASN HD22 H . . . . . 3.08021458761 1.89424934940 4.26617982583 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
211 1 . . 1 1 69 69 PHE H H . . . 1 1 27 27 PHE H H . . . . . 2.63167680006 1.76596145256 3.49739214756 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
212 1 . . 1 1 78 78 TYR QD H . . . 1 1 17 17 ARG H H . . . . . 4.73778768575 1.93195866634 7.54361670516 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
213 1 . . 1 1 42 42 LEU MD2 H . . . 1 1 53 53 VAL H H . . . . . 5.02202102679 1.86943412760 8.17460792599 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
214 1 . . 1 1 51 51 TYR QE H . . . 1 1 46 46 ALA H H . . . . . 2.66099033639 1.77588164009 3.54609903268 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
215 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 11 11 LEU H H . . . . . 4.51374032949 1.96700885923 7.06047179975 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
216 1 OR . 1 1 27 27 PHE HZ H . . . 1 1 9 9 TRP HE1 H . . . . . 3.53899898917 1.97343475850 5.10456321984 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
216 2 OR . 1 1 27 27 PHE QD H . . . 1 1 9 9 TRP HE1 H . . . . . 3.53899898917 1.97343475850 5.10456321984 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
217 1 . . 1 1 31 31 GLY H H . . . 1 1 30 30 SER HG H . . . . . 4.19366489595 3.35493191676 5.03239787514 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
218 1 OR . 1 1 51 51 TYR H H . . . 1 1 43 43 TYR QD H . . . . . 3.28092620775 1.93536661016 4.62648580533 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
218 2 OR . 1 1 51 51 TYR H H . . . 5 1 8 8 PHE QE H . . . . . 3.28092620775 1.93536661016 4.62648580533 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
219 1 . . 5 1 90 90 TYR QE H . . . 1 1 68 68 ASN H H . . . . . 4.02494814134 3.21995851307 4.82993776961 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
220 1 . . 1 1 77 77 PHE H H . . . 1 1 21 21 GLN HE22 H . . . . . 4.02550286479 1.99991870049 6.05108702910 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
221 1 . . 1 1 19 19 TYR QD H . . . 1 1 78 78 TYR H H . . . . . 4.18726154291 1.99561663932 6.37890644651 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
222 1 . . 1 1 84 84 SER H H . . . 1 1 37 37 GLY H H . . . . . 4.48056449942 1.97113222024 6.98999677861 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
223 1 . . 1 1 8 8 PHE HZ H . . . 1 1 89 89 GLY H H . . . . . 4.19837019825 1.99508115806 6.40165923844 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
224 1 . . 1 1 13 13 MET H H . . . 1 1 87 87 LEU H H . . . . . 4.04474177699 1.99974977167 6.08973378230 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
225 1 . . 1 1 23 23 ILE MD H . . . 1 1 75 75 ILE H H . . . . . 3.34034676861 1.94560720179 4.73508633543 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
226 1 . . 1 1 43 43 TYR H H . . . 1 1 52 52 ILE MD H . . . . . 5.25284187919 1.80379840322 8.70188535517 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
227 1 . . 1 1 52 52 ILE MD H . . . 1 1 55 55 THR H H . . . . . 4.39594925023 1.98040302390 6.81149547656 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
228 1 . . 1 1 43 43 TYR QD H . . . 1 1 52 52 ILE H H . . . . . 3.20945041399 1.92187891901 4.49702190897 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
229 1 . . 1 1 19 19 TYR QD H . . . 1 1 79 79 THR H H . . . . . 4.63345382623 1.94984203125 7.31706562120 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
230 1 . . 1 1 16 16 GLU H H . . . 1 1 79 79 THR HG1 H . . . . . 2.83569026131 1.83054785405 3.84083266857 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
231 1 . . 1 1 30 30 SER H H . . . 1 1 67 67 LEU H H . . . . . 4.51983040297 1.96622204402 7.07343876192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
232 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 9 9 TRP HE1 H . . . . . 5.31396527685 1.78418690640 8.84374364730 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
233 1 . . 1 1 77 77 PHE H H . . . 1 1 21 21 GLN HE21 H . . . . . 3.84736423448 1.99708779039 5.69764067857 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
234 1 . . 1 1 43 43 TYR H H . . . 1 1 78 78 TYR QE H . . . . . 4.41423528704 1.97855114087 6.84991943320 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
235 1 . . 1 1 83 83 ALA H H . . . 1 1 39 39 GLU H H . . . . . 2.91394210801 1.85255978191 3.97532443412 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
236 1 . . 1 1 54 54 ALA H H . . . 1 1 42 42 LEU H H . . . . . 2.55059155209 1.73740189389 3.36378121029 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
237 1 . . 1 1 86 86 SER HG H . . . 1 1 12 12 ASN HD21 H . . . . . 3.61580618836 1.98154938939 5.25006298732 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
238 1 . . 1 1 13 13 MET H H . . . 1 1 86 86 SER HG H . . . . . 4.04969444978 1.99969130771 6.09969759184 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
239 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 87 87 LEU H H . . . . . 3.68388048883 1.98750855683 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
240 1 . . 1 1 16 16 GLU H H . . . 1 1 79 79 THR H H . . . . . 2.63796688878 1.76810822549 4.93640984646 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 10
stop_
save_
save_ARIA2_f5_run62_Dists_69|3_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_f5_run62_Dists_69|3_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 11
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 DistanceConstraints list run51_m0_69|3 69|3, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-13C NOESY" . . . . 1 1 11
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 11
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 32 32 VAL MG2 H . . . 1 1 64 64 ALA H H . . . . . 3.02034065389 1.88003344570 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
2 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 84 84 SER H H . . . . . 3.26934614605 1.93326811821 4.60542417389 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
3 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 9 9 TRP HE1 H . . . . . 4.06634323715 1.99944982186 6.13323665244 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
4 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 10 10 GLY H H . . . . . 3.69076183735 1.98804646985 5.39347720486 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
5 1 OR . 1 1 34 34 LEU MD1 H . . . 1 1 58 58 LYS H H . . . . . 2.50350178412 1.72006163623 4.45286716806 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
5 2 OR . 1 1 34 34 LEU MD1 H . . . 1 1 59 59 ALA H H . . . . . 2.50350178412 1.72006163623 4.45286716806 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
6 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 21 21 GLN HE22 H . . . . . 2.60284853625 1.75599597342 3.44970109908 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
7 1 . . 1 1 52 52 ILE MD H . . . 5 1 35 35 ASP H H . . . . . 3.70974220163 1.98946880131 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
8 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 86 86 SER HG H . . . . . 3.91046727804 1.99899798646 5.82193656962 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
9 1 . . 1 1 32 32 VAL H H . . . 1 1 32 32 VAL MG2 H . . . . . 3.81554772457 1.99574716976 5.63534827938 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
10 1 . . 1 1 23 23 ILE MD H . . . 1 1 73 73 ASP H H . . . . . 3.41261087102 1.95687175139 4.86834999064 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
11 1 OR . 1 1 52 52 ILE MD H . . . 1 1 55 55 THR H H . . . . . 2.91760099416 1.85355154902 3.98165043930 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
11 2 OR . 1 1 52 52 ILE MD H . . . 1 1 42 42 LEU H H . . . . . 2.91760099416 1.85355154902 3.98165043930 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
12 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 25 25 LYS H H . . . . . 3.82515677245 1.99617873072 5.65413481417 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
13 1 OR . 1 1 34 34 LEU MD2 H . . . 1 1 59 59 ALA H H . . . . . 2.69406884699 1.78681797795 3.60131971603 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
13 2 OR . 1 1 34 34 LEU MD2 H . . . 1 1 58 58 LYS H H . . . . . 2.69406884699 1.78681797795 3.60131971603 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
14 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 21 21 GLN HE22 H . . . . . 2.30826191555 1.64225278170 2.97427104939 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
15 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 76 76 MET H H . . . . . 3.17765664034 1.91546892485 5.56134393090 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
16 1 . . 1 1 52 52 ILE MD H . . . 1 1 55 55 THR HG1 H . . . . . 2.95812235111 1.86431137059 4.05193333162 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
17 1 . . 1 1 75 75 ILE MD H . . . 1 1 21 21 GLN HE21 H . . . . . 4.22151018303 1.99386665485 6.44915371121 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
18 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 9 9 TRP HE1 H . . . . . 3.26531078804 1.93252897023 4.59809260586 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
19 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 8 8 PHE H H . . . . . 4.18870332479 1.99554888190 6.38185776768 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
20 1 . . 1 1 56 56 VAL MG1 H . . . 5 1 62 62 GLN HE21 H . . . . . 2.87886748107 1.84288273437 5.34055361811 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
21 1 OR . 1 1 32 32 VAL MG2 H . . . 1 1 88 88 LEU H H . . . . . 4.10790221811 1.99854463892 6.21725979730 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
21 2 OR . 1 1 32 32 VAL MG2 H . . . 1 1 33 33 ALA H H . . . . . 4.10790221811 1.99854463892 6.21725979730 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
22 1 . . 1 1 56 56 VAL MG1 H . . . 1 1 60 60 ILE H H . . . . . 3.52976333554 1.97235968492 5.08716698615 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
23 1 . . 1 1 65 65 LEU MD1 H . . . 5 1 62 62 GLN HE21 H . . . . . 3.80854101646 1.99541793220 5.62166410071 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
24 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 76 76 MET H H . . . . . 2.47782386428 1.71037247648 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
25 1 . . 1 1 60 60 ILE MD H . . . 5 1 62 62 GLN HE21 H . . . . . 2.56307763896 1.74190676604 3.38424851188 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
26 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 26 26 SER H H . . . . . 3.82329100613 1.99609674144 5.65048527083 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
27 1 . . 1 1 60 60 ILE MD H . . . 5 1 62 62 GLN HE22 H . . . . . 2.47150243341 1.70796189861 3.23504296820 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
28 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 21 21 GLN HE21 H . . . . . 2.46846447513 1.70679986701 4.33196845840 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
29 1 . . 1 1 63 63 VAL MG1 H . . . 1 1 55 55 THR H H . . . . . 2.67472362476 1.78045531615 3.56899193337 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
30 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 21 21 GLN HE21 H . . . . . 2.97210832247 1.86792983741 4.07628680753 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
31 1 OR . 1 1 23 23 ILE MD H . . . 1 1 27 27 PHE H H . . . . . 3.43735747988 1.96042917432 4.91428578545 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
31 2 OR . 1 1 23 23 ILE MD H . . . 1 1 24 24 ILE H H . . . . . 3.43735747988 1.96042917432 4.91428578545 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
32 1 . . 1 1 56 56 VAL MG1 H . . . 1 1 64 64 ALA H H . . . . . 2.98185743649 1.87042321505 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
33 1 . . 1 1 60 60 ILE MD H . . . 1 1 55 55 THR H H . . . . . 3.90087136295 1.99877168916 5.80297103673 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
34 1 . . 1 1 63 63 VAL MG2 H . . . 1 1 55 55 THR H H . . . . . 3.18466391345 1.91690338325 4.45242444366 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 11
stop_
save_
save_ARIA2_f5_run62_Dists_69|8_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_f5_run62_Dists_69|8_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 12
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 DistanceConstraints list run51_u2D_69|8 69|8, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 12
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 83 83 ALA HA H . . . 1 1 37 37 GLY HA3 H . . . . . 2.05298385953 1.52614101860 2.57982670047 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
2 1 . . 1 1 27 27 PHE QD H . . . 1 1 23 23 ILE MD H . . . . . 2.57020506330 1.74446080487 5.12231642660 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
3 1 . . 1 1 75 75 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 2.90923084110 1.85127783025 3.96718385196 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
4 1 . . 1 1 30 30 SER HA H . . . 1 1 28 28 HIS HE1 H . . . . . 2.89556776065 1.84752867858 3.94360684271 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
5 1 . . 1 1 34 34 LEU HA H . . . 1 1 85 85 VAL HA H . . . . . 2.70758818697 1.79120896319 3.62396741075 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
6 1 . . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD1 H . . . . . 1.89877961705 1.44810911278 3.74474703610 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
7 1 . . 1 1 85 85 VAL H H . . . 1 1 13 13 MET H H . . . . . 4.14946886089 1.99720738245 6.30173033934 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
8 1 . . 1 1 83 83 ALA HA H . . . 1 1 37 37 GLY HA2 H . . . . . 2.38842890725 1.67535482663 3.10150298788 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
9 1 . . 1 1 32 32 VAL HA H . . . 1 1 87 87 LEU HA H . . . . . 2.24994068942 1.61716155118 2.88271982766 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
10 1 . . 1 1 29 29 ILE H H . . . 1 1 68 68 ASN HA H . . . . . 2.42296090542 1.68911846177 5.21699824128 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
11 1 . . 1 1 32 32 VAL HA H . . . 1 1 87 87 LEU HA H . . . . . 2.43773324854 1.69491532466 3.18055117242 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
12 1 . . 1 1 43 43 TYR H H . . . 1 1 78 78 TYR H H . . . . . 3.73171886347 1.99100315397 5.47243457297 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
13 1 . . 1 1 69 69 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 2.27031754035 1.62602482360 2.91461025711 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
14 1 . . 1 1 77 77 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 2.41857591507 1.68738723295 3.14976459719 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
15 1 . . 1 1 51 51 TYR H H . . . 1 1 44 44 LEU H H . . . . . 4.01685804497 1.99996447579 6.03375161416 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
16 1 . . 1 1 29 29 ILE H H . . . 1 1 67 67 LEU H H . . . . . 3.49889427517 1.96861163157 5.02917691878 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
17 1 . . 1 1 57 57 THR HA H . . . 1 1 39 39 GLU HA H . . . . . 1.66095837127 1.31611053238 3.35679356056 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
18 1 . . 1 1 9 9 TRP H H . . . 1 1 90 90 TYR HA H . . . . . 3.00938137738 1.87733434306 4.14142841169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
19 1 . . 1 1 85 85 VAL MG2 H . . . 1 1 13 13 MET H H . . . . . 3.11502630455 1.90210269480 4.32794991431 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
20 1 OR . 1 1 15 15 PRO HD3 H . . . 1 1 84 84 SER HB2 H . . . . . 1.94120815916 1.47017201951 2.41224429881 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
20 2 OR . 1 1 15 15 PRO HD3 H . . . 1 1 84 84 SER HB3 H . . . . . 1.94120815916 1.47017201951 2.41224429881 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
21 1 . . 1 1 75 75 ILE MD H . . . 1 1 21 21 GLN HG2 H . . . . . 3.05175551251 1.88760404899 4.21590697603 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
22 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 19 19 TYR QD H . . . . . 3.97769627578 1.99993781799 5.95545473358 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
23 1 . . 1 1 13 13 MET ME H . . . 1 1 19 19 TYR QD H . . . . . 2.03358755072 1.51665275992 3.87781764237 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
24 1 OR . 1 1 28 28 HIS HE1 H . . . 1 1 66 66 ASP HB2 H . . . . . 4.53324916176 1.96445566643 7.10204265709 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
24 2 OR . 1 1 66 66 ASP HB3 H . . . 5 1 28 28 HIS HE1 H . . . . . 4.53324916176 1.96445566643 7.10204265709 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
24 3 OR . 1 1 66 66 ASP HB2 H . . . 5 1 28 28 HIS HE1 H . . . . . 4.53324916176 1.96445566643 7.10204265709 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
24 4 OR . 1 1 28 28 HIS HE1 H . . . 1 1 66 66 ASP HB3 H . . . . . 4.53324916176 1.96445566643 7.10204265709 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
25 1 OR . 1 1 57 57 THR H H . . . 1 1 62 62 GLN H H . . . . . 2.91598711022 1.85311450685 3.97885971358 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
25 2 OR . 1 1 57 57 THR H H . . . 1 1 60 60 ILE H H . . . . . 2.91598711022 1.85311450685 3.97885971358 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
26 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE QD H . . . . . 2.14911360297 1.57177744316 4.42554214605 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
27 1 . . 1 1 9 9 TRP H H . . . 1 1 90 90 TYR HA H . . . . . 2.90184841983 1.84925788837 3.95443895130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
28 1 . . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD2 H . . . . . 2.47568895617 1.70955948021 4.43353296349 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
29 1 . . 1 1 51 51 TYR H H . . . 1 1 45 45 ALA HA H . . . . . 2.11244393834 1.55464151426 3.98436693163 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
30 1 . . 1 1 69 69 PHE HZ H . . . 1 1 75 75 ILE MD H . . . . . 3.13371622175 1.90619405194 4.36123839156 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
31 1 . . 1 1 76 76 MET H H . . . 1 1 45 45 ALA H H . . . . . 3.76950714785 1.99335913064 5.54565516507 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
32 1 . . 1 1 44 44 LEU HA H . . . 1 1 77 77 PHE HA H . . . . . 2.67515050575 1.78059672720 3.56970428431 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
33 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE QE H . . . . . 2.28889155661 1.63401348687 2.94376962635 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
34 1 . . 1 1 30 30 SER HA H . . . 1 1 28 28 HIS HD2 H . . . . . 3.55621578069 1.97538194584 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
35 1 OR . 1 1 57 57 THR H H . . . 1 1 62 62 GLN H H . . . . . 2.95447400635 1.86335942458 4.04558858813 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
35 2 OR . 1 1 57 57 THR H H . . . 1 1 60 60 ILE H H . . . . . 2.95447400635 1.86335942458 4.04558858813 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
36 1 . . 1 1 28 28 HIS HE1 H . . . 1 1 30 30 SER HB2 H . . . . . 2.96796413741 1.86686274729 5.26200737154 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
37 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 13 13 MET H H . . . . . 5.03035813935 1.86729526308 8.19342101562 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
38 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL H H . . . . . 3.10745643098 1.90042074718 4.31449211479 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
39 1 . . 1 1 51 51 TYR H H . . . 1 1 44 44 LEU H H . . . . . 3.42539872481 1.95872917182 4.89206827780 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
40 1 . . 1 1 44 44 LEU HA H . . . 1 1 78 78 TYR H H . . . . . 2.40997146784 1.68397615836 4.19737490506 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
41 1 . . 1 1 46 46 ALA HA H . . . 1 1 75 75 ILE HA H . . . . . 2.47006783675 1.70741344698 3.23272222652 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
42 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 9 9 TRP HH2 H . . . . . 3.12907437269 1.90518606896 4.35296267643 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
43 1 . . 1 1 28 28 HIS HD2 H . . . 1 1 30 30 SER HB2 H . . . . . 2.84217946221 1.83243145028 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
44 1 . . 1 1 28 28 HIS HE1 H . . . 1 1 30 30 SER HB3 H . . . . . 3.03824155990 1.88437758786 4.19210553194 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
45 1 . . 1 1 28 28 HIS HD2 H . . . 1 1 30 30 SER HB3 H . . . . . 2.48785232411 1.71417617579 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
46 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 19 19 TYR QD H . . . . . 3.25433394854 1.93049776746 4.57817012962 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
47 1 OR . 1 1 28 28 HIS HE1 H . . . 1 1 66 66 ASP HB2 H . . . . . 2.92007713327 1.85422082524 3.98593344130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
47 2 OR . 1 1 66 66 ASP HB3 H . . . 5 1 28 28 HIS HE1 H . . . . . 2.92007713327 1.85422082524 3.98593344130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
47 3 OR . 1 1 28 28 HIS HE1 H . . . 1 1 66 66 ASP HB3 H . . . . . 2.92007713327 1.85422082524 3.98593344130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
47 4 OR . 1 1 66 66 ASP HB2 H . . . 5 1 28 28 HIS HE1 H . . . . . 2.92007713327 1.85422082524 3.98593344130 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
48 1 . . 1 1 27 27 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 3.39763372534 1.95464435889 4.84062309178 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
49 1 . . 1 1 67 67 LEU H H . . . 1 1 28 28 HIS HE1 H . . . . . 3.47265989572 1.96523905180 4.98008073964 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
50 1 . . 1 1 78 78 TYR QD H . . . 1 1 18 18 LYS HA H . . . . . 2.72589727754 1.79708278158 4.78949517075 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
51 1 . . 1 1 57 57 THR HA H . . . 1 1 40 40 ALA H H . . . . . 2.26175145936 1.62231150137 2.90119141735 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
52 1 . . 1 1 65 65 LEU H H . . . 1 1 30 30 SER HA H . . . . . 3.30353149946 1.93936645347 4.66769654545 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
53 1 . . 1 1 44 44 LEU HA H . . . 1 1 77 77 PHE HA H . . . . . 2.27840346747 1.62951317240 2.92729376255 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
54 1 . . 1 1 69 69 PHE HZ H . . . 1 1 75 75 ILE MD H . . . . . 2.85625276587 1.83648028305 3.87602524868 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
55 1 . . 1 1 39 39 GLU HA H . . . 1 1 57 57 THR HB H . . . . . 2.25096698644 1.61761043968 3.99662082712 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
56 1 . . 1 1 33 33 ALA H H . . . 1 1 86 86 SER H H . . . . . 2.79645366184 1.81893452649 3.77397279720 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
57 1 . . 1 1 57 57 THR HA H . . . 1 1 39 39 GLU HA H . . . . . 2.05353263448 1.52640809937 2.58065716958 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
58 1 . . 1 1 78 78 TYR QE H . . . 1 1 44 44 LEU HA H . . . . . 4.25886332187 1.99162372257 6.52610292116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
59 1 . . 1 1 27 27 PHE QD H . . . 1 1 23 23 ILE MG H . . . . . 2.21068086982 1.59979213130 2.82156960834 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
60 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 19 19 TYR QD H . . . . . 3.35792416206 1.94846732729 4.76738099683 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
61 1 . . 1 1 19 19 TYR QE H . . . 1 1 13 13 MET ME H . . . . . 1.99650767657 1.49825231374 4.16881595368 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
62 1 . . 1 1 69 69 PHE QE H . . . 1 1 29 29 ILE H H . . . . . 4.71439511022 1.93620495331 7.49258526713 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
63 1 . . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE MD H . . . . . 2.55617745514 1.73942205737 3.37293285291 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
64 1 . . 1 1 50 50 GLU HA H . . . 1 1 45 45 ALA HA H . . . . . 2.05362949837 1.52645523380 2.58080376294 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
65 1 . . 1 1 28 28 HIS HD2 H . . . 1 1 30 30 SER HB2 H . . . . . 2.78223983436 1.81463252237 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
66 1 . . 1 1 28 28 HIS HD2 H . . . 1 1 66 66 ASP HA H . . . . . 3.12836181570 1.90503085946 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
67 1 . . 1 1 34 34 LEU HA H . . . 1 1 86 86 SER H H . . . . . 3.74951456879 1.99215713109 5.50687200649 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
68 1 . . 1 1 27 27 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 3.40803613837 1.95619734831 4.85987492842 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
69 1 . . 1 1 43 43 TYR H H . . . 1 1 79 79 THR HA H . . . . . 2.45406543108 1.70126078858 3.20687007358 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
70 1 . . 1 1 30 30 SER HA H . . . 1 1 66 66 ASP HA H . . . . . 2.44305252013 1.69698931811 3.18911572214 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
71 1 . . 1 1 75 75 ILE MD H . . . 1 1 77 77 PHE HZ H . . . . . 3.92461164147 1.99928957442 5.84993370851 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
72 1 . . 1 1 77 77 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 2.38913114255 1.67563769051 3.10262459459 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
73 1 OR . 1 1 10 10 GLY HA2 H . . . 1 1 88 88 LEU HA H . . . . . 2.64357231420 1.77001299165 3.51713163676 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
73 2 OR . 1 1 10 10 GLY HA3 H . . . 1 1 88 88 LEU HA H . . . . . 2.64357231420 1.77001299165 3.51713163676 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
74 1 . . 1 1 28 28 HIS HD2 H . . . 1 1 66 66 ASP HA H . . . . . 3.31752214735 1.94177799758 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
75 1 . . 1 1 34 34 LEU HA H . . . 1 1 85 85 VAL HA H . . . . . 2.54976333186 1.73710170080 3.36242496293 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
76 1 . . 1 1 50 50 GLU HA H . . . 1 1 45 45 ALA HA H . . . . . 2.24915458752 1.61681754270 2.88149163234 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
77 1 OR . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE MG H . . . . . 2.42109460112 1.68838221767 3.15380698456 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
77 2 OR . 1 1 27 27 PHE QE H . . . 1 1 75 75 ILE HG13 H . . . . . 2.42109460112 1.68838221767 3.15380698456 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
77 3 OR . 1 1 27 27 PHE QE H . . . 1 1 75 75 ILE HG12 H . . . . . 2.42109460112 1.68838221767 3.15380698456 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
78 1 . . 1 1 87 87 LEU H H . . . 1 1 11 11 LEU H H . . . . . 3.05434397579 1.88821683548 4.22047111610 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
79 1 . . 1 1 30 30 SER HA H . . . 1 1 28 28 HIS HE1 H . . . . . 2.61338230037 1.75966141939 3.46710318136 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
80 1 . . 1 1 20 20 SER HA H . . . 1 1 76 76 MET HA H . . . . . 2.16012324590 1.57685669122 2.74338980059 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
81 1 . . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD2 H . . . . . 2.42396585134 1.68951454528 4.43353296349 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
82 1 . . 1 1 30 30 SER HA H . . . 1 1 28 28 HIS HD2 H . . . . . 3.43581523180 1.96021194342 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
83 1 . . 1 1 51 51 TYR QD H . . . 1 1 45 45 ALA HA H . . . . . 2.73312365375 1.79937804041 3.66686926708 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
84 1 . . 1 1 75 75 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 2.51902770985 1.72584013448 3.31221528522 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
85 1 . . 1 1 28 28 HIS HD2 H . . . 1 1 30 30 SER HB3 H . . . . . 2.40596903789 1.68238316148 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
86 1 . . 1 1 9 9 TRP HZ2 H . . . 1 1 11 11 LEU MD2 H . . . . . 3.08597842350 1.89557056971 4.27638627730 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
87 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE HZ H . . . . . 2.33395520388 1.65303684217 3.01487356560 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
88 1 . . 1 1 45 45 ALA MB H . . . 1 1 78 78 TYR QE H . . . . . 2.17904281006 1.58551436405 2.77257125607 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
89 1 . . 1 1 67 67 LEU H H . . . 1 1 28 28 HIS HE1 H . . . . . 3.15061270363 1.90981765260 4.39140775466 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
90 1 . . 1 1 51 51 TYR QD H . . . 1 1 45 45 ALA HA H . . . . . 2.77088377922 1.81115916448 3.73060839396 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
91 1 OR . 1 1 26 26 SER HB2 H . . . 1 1 70 70 SER HA H . . . . . 2.52577950599 1.72833424188 3.32322477009 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
91 2 OR . 1 1 26 26 SER HB3 H . . . 1 1 70 70 SER HA H . . . . . 2.52577950599 1.72833424188 3.32322477009 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
92 1 OR . 1 1 15 15 PRO HD3 H . . . 1 1 84 84 SER HB2 H . . . . . 1.88779681275 1.44232471197 3.42542982934 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
92 2 OR . 1 1 15 15 PRO HD3 H . . . 1 1 84 84 SER HB3 H . . . . . 1.88779681275 1.44232471197 3.42542982934 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
93 1 . . 1 1 57 57 THR H H . . . 1 1 60 60 ILE HB H . . . . . 2.49503729951 1.71688590877 3.27318869026 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
94 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 2.38255364080 1.67298340939 5.00718398719 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
95 1 . . 1 1 87 87 LEU H H . . . 1 1 11 11 LEU H H . . . . . 3.07884632072 1.89393448739 4.26375815404 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
96 1 . . 1 1 43 43 TYR H H . . . 1 1 78 78 TYR H H . . . . . 3.60996742504 1.98098432381 5.23895052628 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
97 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 19 19 TYR QD H . . . . . 3.36890180877 1.95021438413 4.78758923342 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
98 1 . . 1 1 90 90 TYR HA H . . . 1 1 8 8 PHE HA H . . . . . 2.91772815651 1.85358595710 3.98187035593 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
99 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 34 34 LEU HA H . . . . . 2.12306618585 1.55963993216 2.68649243954 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
100 1 . . 1 1 28 28 HIS HE1 H . . . 1 1 66 66 ASP HA H . . . . . 2.68474675311 1.78376361207 3.58572989415 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
101 1 . . 1 1 77 77 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 3.45576671664 1.96297626666 4.94855716662 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
102 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 8 8 PHE HZ H . . . . . 3.62308856747 1.50000000000 5.26393491343 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
103 1 . . 1 1 28 28 HIS HE1 H . . . 1 1 66 66 ASP HA H . . . . . 2.22501701554 1.60617942561 2.84385460547 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
104 1 . . 1 1 30 30 SER H H . . . 1 1 28 28 HIS HD2 H . . . . . 5.06575904910 1.85801970616 8.27349839204 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
105 1 . . 1 1 30 30 SER HA H . . . 1 1 66 66 ASP HA H . . . . . 2.48856170991 1.71444428691 3.26267913291 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
106 1 OR . 1 1 10 10 GLY HA2 H . . . 1 1 88 88 LEU HA H . . . . . 2.30678583236 1.64162822281 2.97194344191 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
106 2 OR . 1 1 10 10 GLY HA3 H . . . 1 1 88 88 LEU HA H . . . . . 2.30678583236 1.64162822281 2.97194344191 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
107 1 . . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD1 H . . . . . 2.12770349419 1.56181322429 4.70741346068 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
108 1 . . 1 1 76 76 MET ME H . . . 1 1 78 78 TYR QE H . . . . . 2.79728431714 1.81918437328 3.77538426101 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
109 1 . . 1 1 77 77 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 3.51260452322 1.97030570615 5.05490334029 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
110 1 . . 1 1 51 51 TYR H H . . . 1 1 45 45 ALA HA H . . . . . 2.25243395851 1.61825161633 2.88661630070 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
111 1 . . 1 1 32 32 VAL H H . . . 1 1 63 63 VAL H H . . . . . 3.90859960532 1.99895574598 5.81824346466 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 12
stop_
save_
save_ARIA2_f5_run62_Dists_69|1_it2
_Gen_dist_constraint_list.Sf_category general_distance_constraints
_Gen_dist_constraint_list.Sf_framecode ARIA2_f5_run62_Dists_69|1_it2
_Gen_dist_constraint_list.Entry_ID 1
_Gen_dist_constraint_list.ID 13
_Gen_dist_constraint_list.Constraint_type NOE
_Gen_dist_constraint_list.Details 'ARIA2 DistanceConstraints list run51_S2_cnoe_69|1 69|1, project "pentamer ", run "62", iteration 2.'
loop_
_Gen_dist_constraint_expt.Experiment_ID
_Gen_dist_constraint_expt.Experiment_name
_Gen_dist_constraint_expt.Method_ID
_Gen_dist_constraint_expt.Method_label
_Gen_dist_constraint_expt.Sample_ID
_Gen_dist_constraint_expt.Sample_label
_Gen_dist_constraint_expt.Sample_state
_Gen_dist_constraint_expt.Entry_ID
_Gen_dist_constraint_expt.Gen_dist_constraint_list_ID
. "3D 1H-13C NOESY" . . . . 1 1 13
stop_
loop_
_Gen_dist_constraint_software.Software_ID
_Gen_dist_constraint_software.Software_label
_Gen_dist_constraint_software.Method_ID
_Gen_dist_constraint_software.Method_label
_Gen_dist_constraint_software.Entry_ID
_Gen_dist_constraint_software.Gen_dist_constraint_list_ID
. . . . 1 13
stop_
loop_
_Gen_dist_constraint.ID
_Gen_dist_constraint.Member_ID
_Gen_dist_constraint.Member_logic_code
_Gen_dist_constraint.Assembly_atom_ID_1
_Gen_dist_constraint.Entity_assembly_ID_1
_Gen_dist_constraint.Entity_ID_1
_Gen_dist_constraint.Comp_index_ID_1
_Gen_dist_constraint.Seq_ID_1
_Gen_dist_constraint.Comp_ID_1
_Gen_dist_constraint.Atom_ID_1
_Gen_dist_constraint.Atom_type_1
_Gen_dist_constraint.Atom_isotope_number_1
_Gen_dist_constraint.Resonance_ID_1
_Gen_dist_constraint.Assembly_atom_ID_2
_Gen_dist_constraint.Entity_assembly_ID_2
_Gen_dist_constraint.Entity_ID_2
_Gen_dist_constraint.Comp_index_ID_2
_Gen_dist_constraint.Seq_ID_2
_Gen_dist_constraint.Comp_ID_2
_Gen_dist_constraint.Atom_ID_2
_Gen_dist_constraint.Atom_type_2
_Gen_dist_constraint.Atom_isotope_number_2
_Gen_dist_constraint.Resonance_ID_2
_Gen_dist_constraint.Intensity_val
_Gen_dist_constraint.Intensity_lower_val_err
_Gen_dist_constraint.Intensity_upper_val_err
_Gen_dist_constraint.Distance_val
_Gen_dist_constraint.Distance_lower_bound_val
_Gen_dist_constraint.Distance_upper_bound_val
_Gen_dist_constraint.Contribution_fractional_val
_Gen_dist_constraint.Spectral_peak_ID
_Gen_dist_constraint.Spectral_peak_list_ID
_Gen_dist_constraint.PDB_record_ID_1
_Gen_dist_constraint.PDB_model_num_1
_Gen_dist_constraint.PDB_strand_ID_1
_Gen_dist_constraint.PDB_ins_code_1
_Gen_dist_constraint.PDB_residue_no_1
_Gen_dist_constraint.PDB_residue_name_1
_Gen_dist_constraint.PDB_atom_name_1
_Gen_dist_constraint.PDB_record_ID_2
_Gen_dist_constraint.PDB_model_num_2
_Gen_dist_constraint.PDB_strand_ID_2
_Gen_dist_constraint.PDB_ins_code_2
_Gen_dist_constraint.PDB_residue_no_2
_Gen_dist_constraint.PDB_residue_name_2
_Gen_dist_constraint.PDB_atom_name_2
_Gen_dist_constraint.Auth_entity_assembly_ID_1
_Gen_dist_constraint.Auth_asym_ID_1
_Gen_dist_constraint.Auth_chain_ID_1
_Gen_dist_constraint.Auth_seq_ID_1
_Gen_dist_constraint.Auth_comp_ID_1
_Gen_dist_constraint.Auth_atom_ID_1
_Gen_dist_constraint.Auth_alt_ID_1
_Gen_dist_constraint.Auth_atom_name_1
_Gen_dist_constraint.Auth_entity_assembly_ID_2
_Gen_dist_constraint.Auth_asym_ID_2
_Gen_dist_constraint.Auth_chain_ID_2
_Gen_dist_constraint.Auth_seq_ID_2
_Gen_dist_constraint.Auth_comp_ID_2
_Gen_dist_constraint.Auth_atom_ID_2
_Gen_dist_constraint.Auth_alt_ID_2
_Gen_dist_constraint.Auth_atom_name_2
_Gen_dist_constraint.Entry_ID
_Gen_dist_constraint.Gen_dist_constraint_list_ID
1 1 . . 1 1 67 67 LEU MD2 H . . . 1 1 77 77 PHE HZ H . . . . . 2.23926832602 1.61247799653 5.84533808393 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
2 1 . . 1 1 9 9 TRP HZ2 H . . . 1 1 11 11 LEU MD2 H . . . . . 2.74183304516 1.80212698922 5.29826092129 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
3 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 11 11 LEU MD1 H . . . . . 2.32251948264 1.64825738923 4.44942444773 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
4 1 . . 1 1 51 51 TYR QD H . . . 1 1 44 44 LEU MD1 H . . . . . 2.20267639519 1.59620348245 4.74448367782 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
5 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE QD H . . . . . 2.74122516143 1.80193573822 5.12858649673 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
6 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 27 27 PHE HB3 H . . . . . 3.42515821746 1.50000000000 4.89162181929 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
7 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HH2 H . . . . . 2.48592400514 1.71344673522 3.25840127505 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
8 1 OR . 1 1 69 69 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 2.45097352217 1.70006462137 3.20188242296 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
8 2 OR . 1 1 75 75 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 2.45097352217 1.70006462137 3.20188242296 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
9 1 OR . 1 1 34 34 LEU MD1 H . . . 1 1 56 56 VAL MG1 H . . . . . 1.98253685722 1.49123030844 3.60168342799 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
9 2 OR . 1 1 34 34 LEU MD1 H . . . 1 1 56 56 VAL MG2 H . . . . . 1.98253685722 1.49123030844 3.60168342799 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
10 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 11 11 LEU MD2 H . . . . . 2.15151151196 1.57288628870 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
11 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 8 8 PHE QE H . . . . . 2.55513250192 1.73904473912 3.37122026472 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
12 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 9 9 TRP HZ3 H . . . . . 3.21941841504 1.92383654865 4.51500028143 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
13 1 . . 1 1 77 77 PHE QD H . . . 1 1 75 75 ILE MD H . . . . . 3.02128363781 1.88026428530 4.16230299033 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
14 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 11 11 LEU MD2 H . . . . . 2.45517426414 1.70168918073 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
15 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 9 9 TRP HZ3 H . . . . . 3.82932006475 1.99635854496 5.66228158454 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
16 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 11 11 LEU MD1 H . . . . . 2.18832500272 1.58972921303 3.90172181214 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
17 1 . . 1 1 44 44 LEU MD1 H . . . 5 1 8 8 PHE HZ H . . . . . 2.55423085625 1.73871894787 3.36974276462 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
18 1 OR . 1 1 88 88 LEU MD2 H . . . 2 1 69 69 PHE QE H . . . . . 3.72400163551 1.99047811285 5.45752515818 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
18 2 OR . 1 1 88 88 LEU MD2 H . . . 2 1 77 77 PHE QE H . . . . . 3.72400163551 1.99047811285 5.45752515818 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
19 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 91 91 LEU HG H . . . . . 3.38808074915 1.95319435381 4.82296714450 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
20 1 . . 1 1 63 63 VAL MG2 H . . . 1 1 55 55 THR H H . . . . . 3.25456867798 1.93054151802 4.57859583794 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
21 1 OR . 1 1 88 88 LEU MD1 H . . . 2 1 53 53 VAL MG1 H . . . . . 1.93222010414 1.46553578779 2.39890442050 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
21 2 OR . 1 1 88 88 LEU MD1 H . . . 2 1 53 53 VAL MG2 H . . . . . 1.93222010414 1.46553578779 2.39890442050 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
22 1 OR . 1 1 32 32 VAL MG2 H . . . 1 1 42 42 LEU MD1 H . . . . . 1.86088930961 1.42802568178 3.41131478076 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
22 2 OR . 1 1 42 42 LEU MD1 H . . . 1 1 85 85 VAL MG2 H . . . . . 1.86088930961 1.42802568178 3.41131478076 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
22 3 OR . 1 1 65 65 LEU MD1 H . . . 1 1 42 42 LEU MD1 H . . . . . 1.86088930961 1.42802568178 3.41131478076 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
23 1 OR . 1 1 29 29 ILE MD H . . . 1 1 69 69 PHE QE H . . . . . 2.20031233119 1.59514053684 2.80548412554 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
23 2 OR . 1 1 29 29 ILE MD H . . . 1 1 77 77 PHE QE H . . . . . 2.20031233119 1.59514053684 2.80548412554 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
24 1 . . 1 1 42 42 LEU MD2 H . . . 1 1 67 67 LEU MD1 H . . . . . 3.32656208059 1.94331017109 5.74410089661 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
25 1 . . 1 1 27 27 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 3.36124541629 1.94899907272 4.77349175986 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
26 1 OR . 1 1 65 65 LEU MD2 H . . . 1 1 42 42 LEU MD1 H . . . . . 2.27640850666 1.62865404551 2.92416296780 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
26 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 42 42 LEU MD1 H . . . . . 2.27640850666 1.62865404551 2.92416296780 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
26 3 OR . 1 1 87 87 LEU MD1 H . . . 1 1 42 42 LEU MD1 H . . . . . 2.27640850666 1.62865404551 2.92416296780 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
26 4 OR . 1 1 44 44 LEU MD1 H . . . 1 1 42 42 LEU MD1 H . . . . . 2.27640850666 1.62865404551 2.92416296780 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
27 1 OR . 1 1 32 32 VAL MG2 H . . . 1 1 42 42 LEU MD2 H . . . . . 2.00764566979 1.50381552786 4.44132373395 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
27 2 OR . 1 1 87 87 LEU MD2 H . . . 1 1 32 32 VAL MG2 H . . . . . 2.00764566979 1.50381552786 4.44132373395 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
28 1 . . 1 1 51 51 TYR QD H . . . 1 1 44 44 LEU MD2 H . . . . . 2.20712558340 1.59820016579 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
29 1 . . 1 1 9 9 TRP HZ2 H . . . 1 1 11 11 LEU MD1 H . . . . . 2.76251797217 1.80857977885 5.26830828316 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
30 1 OR . 1 1 77 77 PHE QD H . . . 1 1 11 11 LEU MD1 H . . . . . 2.32467997060 1.64916284989 3.00019709131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
30 2 OR . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD1 H . . . . . 2.32467997060 1.64916284989 3.00019709131 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
31 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE HZ H . . . . . 2.21423280344 1.60137943996 2.82708616692 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
32 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 8 8 PHE HZ H . . . . . 2.90790639142 1.85091644376 3.96489633907 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
33 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 77 77 PHE QE H . . . . . 2.78768765554 1.81628734743 3.75908796365 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
34 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 75 75 ILE MD H . . . . . 2.51273906833 1.72350686514 3.30197127152 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
35 1 OR . 1 1 77 77 PHE QD H . . . 1 1 44 44 LEU MD1 H . . . . . 2.38415578469 1.67363093398 4.49457487062 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
35 2 OR . 1 1 44 44 LEU MD1 H . . . 5 1 8 8 PHE QD H . . . . . 2.38415578469 1.67363093398 4.49457487062 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
36 1 . . 1 1 88 88 LEU MD2 H . . . 2 1 53 53 VAL MG1 H . . . . . 2.62061577687 1.76216239562 5.13929058273 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
37 1 OR . 1 1 88 88 LEU MD1 H . . . 2 1 77 77 PHE QE H . . . . . 3.22158712402 1.92425917431 4.51891507373 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
37 2 OR . 1 1 88 88 LEU MD1 H . . . 2 1 69 69 PHE QE H . . . . . 3.22158712402 1.92425917431 4.51891507373 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
38 1 OR . 1 1 29 29 ILE MD H . . . 1 1 69 69 PHE QD H . . . . . 2.40789398732 1.68314980555 3.13263816909 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
38 2 OR . 1 1 29 29 ILE MD H . . . 1 1 9 9 TRP HH2 H . . . . . 2.40789398732 1.68314980555 3.13263816909 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
39 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 19 19 TYR QD H . . . . . 2.60463910940 1.75662099812 3.45265722068 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
40 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 11 11 LEU MD1 H . . . . . 2.04987427548 1.52462620732 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
41 1 OR . 1 1 77 77 PHE QE H . . . 1 1 67 67 LEU MD1 H . . . . . 2.50680248425 1.72129514737 3.29230982114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
41 2 OR . 1 1 69 69 PHE QE H . . . 1 1 67 67 LEU MD1 H . . . . . 2.50680248425 1.72129514737 3.29230982114 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
42 1 OR . 1 1 77 77 PHE QE H . . . 1 1 75 75 ILE MD H . . . . . 2.40494134455 1.68197348571 3.12790920339 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
42 2 OR . 1 1 75 75 ILE MD H . . . 1 1 69 69 PHE QE H . . . . . 2.40494134455 1.68197348571 3.12790920339 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
43 1 OR . 1 1 44 44 LEU MD1 H . . . 1 1 53 53 VAL MG1 H . . . . . 2.20693740156 1.59811581476 2.81575898835 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
43 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 53 53 VAL MG1 H . . . . . 2.20693740156 1.59811581476 2.81575898835 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
43 3 OR . 1 1 65 65 LEU MD2 H . . . 1 1 53 53 VAL MG1 H . . . . . 2.20693740156 1.59811581476 2.81575898835 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
44 1 OR . 1 1 42 42 LEU MD1 H . . . 1 1 54 54 ALA H H . . . . . 2.45094245115 1.70005258879 3.20183231350 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
44 2 OR . 1 1 77 77 PHE QD H . . . 1 1 42 42 LEU MD1 H . . . . . 2.45094245115 1.70005258879 3.20183231350 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
45 1 . . 1 1 77 77 PHE QE H . . . 1 1 42 42 LEU MD2 H . . . . . 3.21749434268 1.92346061203 4.51152807333 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
46 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 32 32 VAL H H . . . . . 3.74915694791 1.99213472040 5.50617917542 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
47 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 75 75 ILE MD H . . . . . 3.14983242939 1.90965188774 4.39001297104 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
48 1 . . 1 1 77 77 PHE QE H . . . 1 1 42 42 LEU MD1 H . . . . . 2.91725654474 1.85345832626 3.98105476322 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
49 1 OR . 1 1 85 85 VAL MG1 H . . . 1 1 34 34 LEU H H . . . . . 3.54537053746 1.97416400647 5.11657706845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
49 2 OR . 1 1 85 85 VAL MG1 H . . . 1 1 13 13 MET H H . . . . . 3.54537053746 1.97416400647 5.11657706845 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
50 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 77 77 PHE HZ H . . . . . 1.97933425981 1.48961374580 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
51 1 OR . 1 1 44 44 LEU MD1 H . . . 1 1 67 67 LEU MD2 H . . . . . 2.13640754641 1.56587789587 2.70693719696 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
51 2 OR . 1 1 44 44 LEU MD1 H . . . 5 1 88 88 LEU MD1 H . . . . . 2.13640754641 1.56587789587 2.70693719696 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
52 1 OR . 5 1 8 8 PHE QD H . . . 1 1 67 67 LEU MD2 H . . . . . 2.91335643976 1.85240072162 5.09230337837 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
52 2 OR . 1 1 77 77 PHE QD H . . . 1 1 67 67 LEU MD2 H . . . . . 2.91335643976 1.85240072162 5.09230337837 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
53 1 . . 1 1 44 44 LEU MD2 H . . . 5 1 8 8 PHE QE H . . . . . 2.26466874944 1.62357818135 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
54 1 . . 1 1 69 69 PHE HZ H . . . 1 1 75 75 ILE MD H . . . . . 2.84687215621 1.83378702199 3.85995729044 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
55 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 11 11 LEU MD2 H . . . . . 2.15903238556 1.57635478032 4.48895235287 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
56 1 . . 1 1 88 88 LEU MD2 H . . . 1 1 8 8 PHE QE H . . . . . 1.97392095940 1.48687546516 3.53785571742 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
57 1 . . 1 1 40 40 ALA H H . . . 1 1 56 56 VAL MG1 H . . . . . 3.07368312161 1.89274213010 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
58 1 OR . 1 1 69 69 PHE QE H . . . 1 1 67 67 LEU MD2 H . . . . . 2.35166290778 1.66037310380 4.34609578492 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
58 2 OR . 1 1 77 77 PHE QE H . . . 1 1 67 67 LEU MD2 H . . . . . 2.35166290778 1.66037310380 4.34609578492 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
59 1 . . 1 1 56 56 VAL MG1 H . . . 1 1 63 63 VAL H H . . . . . 2.98377726666 1.87091141953 4.09664311379 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
60 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 34 34 LEU HA H . . . . . 3.43573897580 1.96020118707 4.91127676453 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
61 1 . . 1 1 27 27 PHE QE H . . . 1 1 24 24 ILE MD H . . . . . 3.35913939036 1.94866220988 5.81596919066 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
62 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 76 76 MET H H . . . . . 2.74492867894 1.80309949738 3.68675786051 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
63 1 OR . 1 1 52 52 ILE MD H . . . 1 1 55 55 THR H H . . . . . 3.06705534582 1.89120178403 4.24290890760 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
63 2 OR . 1 1 52 52 ILE MD H . . . 1 1 42 42 LEU H H . . . . . 3.06705534582 1.89120178403 4.24290890760 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
64 1 OR . 1 1 29 29 ILE MD H . . . 1 1 65 65 LEU MD1 H . . . . . 2.87521581579 1.84185756737 5.03723712258 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
64 2 OR . 1 1 29 29 ILE MD H . . . 1 1 32 32 VAL MG2 H . . . . . 2.87521581579 1.84185756737 5.03723712258 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
64 3 OR . 1 1 29 29 ILE MD H . . . 1 1 53 53 VAL MG2 H . . . . . 2.87521581579 1.84185756737 5.03723712258 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
64 4 OR . 1 1 29 29 ILE MD H . . . 1 1 32 32 VAL MG1 H . . . . . 2.87521581579 1.84185756737 5.03723712258 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
65 1 OR . 1 1 69 69 PHE QE H . . . 1 1 53 53 VAL MG1 H . . . . . 2.67374767687 1.78013184692 4.91966533070 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
65 2 OR . 1 1 77 77 PHE QE H . . . 1 1 53 53 VAL MG1 H . . . . . 2.67374767687 1.78013184692 4.91966533070 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
66 1 . . 1 1 27 27 PHE QE H . . . 1 1 87 87 LEU MD1 H . . . . . 3.79313246849 1.99465072805 5.59161420894 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
67 1 OR . 1 1 85 85 VAL MG2 H . . . 1 1 56 56 VAL MG1 H . . . . . 2.33136003607 1.65195508385 5.18018929040 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
67 2 OR . 1 1 42 42 LEU MD1 H . . . 1 1 85 85 VAL MG2 H . . . . . 2.33136003607 1.65195508385 5.18018929040 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
68 1 . . 1 1 77 77 PHE QE H . . . 1 1 11 11 LEU MD2 H . . . . . 2.78121794678 1.81432128834 3.74811460521 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
69 1 . . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE QE H . . . . . 2.69197673312 1.78613439166 3.59781907457 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
70 1 OR . 1 1 29 29 ILE MD H . . . 1 1 27 27 PHE QD H . . . . . 2.62147756516 1.76245948708 3.48049564323 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
70 2 OR . 1 1 29 29 ILE MD H . . . 1 1 9 9 TRP HZ3 H . . . . . 2.62147756516 1.76245948708 3.48049564323 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
71 1 . . 1 1 67 67 LEU MD1 H . . . 5 1 8 8 PHE HZ H . . . . . 3.55495856791 1.97524226547 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
72 1 . . 1 1 75 75 ILE MD H . . . 1 1 23 23 ILE MD H . . . . . 2.90435652863 1.84994567296 3.95876738431 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
73 1 . . 1 1 34 34 LEU MD2 H . . . 1 1 57 57 THR HA H . . . . . 3.44741666598 1.96183145737 4.93300187459 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
74 1 . . 1 1 69 69 PHE QD H . . . 1 1 23 23 ILE MD H . . . . . 2.89791055821 1.84817485779 3.94764625864 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
75 1 OR . 1 1 87 87 LEU MD1 H . . . 1 1 9 9 TRP HZ2 H . . . . . 2.64564901830 1.77071667730 4.78730824889 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
75 2 OR . 1 1 87 87 LEU MD1 H . . . 1 1 77 77 PHE HZ H . . . . . 2.64564901830 1.77071667730 4.78730824889 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
76 1 . . 1 1 32 32 VAL MG2 H . . . 1 1 63 63 VAL H H . . . . . 2.81685995829 1.82502245521 5.53605211323 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
77 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 63 63 VAL MG2 H . . . . . 2.57611261798 1.74656809042 3.40565714555 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
78 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 9 9 TRP HZ3 H . . . . . 2.60495429715 1.75673093587 4.79416537672 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
79 1 . . 1 1 43 43 TYR QD H . . . 1 1 52 52 ILE MD H . . . . . 2.59809272618 1.75433199945 3.44185345292 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
80 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 27 27 PHE QD H . . . . . 3.12887614688 1.90514290406 4.35260938969 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
81 1 . . 1 1 53 53 VAL MG1 H . . . 5 1 8 8 PHE QE H . . . . . 3.22941751551 1.92577532932 4.53305970169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
82 1 . . 1 1 29 29 ILE MD H . . . 1 1 77 77 PHE QD H . . . . . 3.09956619986 1.89865237144 4.30048002827 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
83 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 27 27 PHE QD H . . . . . 3.96274490317 1.99982650722 5.92566329912 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
84 1 . . 1 1 63 63 VAL MG1 H . . . 1 1 55 55 THR H H . . . . . 2.77910731374 1.81367763108 3.74453699640 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
85 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 56 56 VAL MG1 H . . . . . 2.29248155092 1.63554759326 3.99421858752 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
86 1 . . 1 1 88 88 LEU MD1 H . . . 2 1 51 51 TYR QE H . . . . . 3.80889889892 1.99543504615 5.62236275169 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
87 1 OR . 1 1 44 44 LEU MD1 H . . . 1 1 69 69 PHE QD H . . . . . 2.46847246978 1.70680292802 4.62886264329 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
87 2 OR . 1 1 44 44 LEU MD1 H . . . 1 1 51 51 TYR QE H . . . . . 2.46847246978 1.70680292802 4.62886264329 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
88 1 OR . 1 1 44 44 LEU MD2 H . . . 5 1 8 8 PHE QD H . . . . . 2.36348735276 1.66522829443 3.06174641109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
88 2 OR . 1 1 77 77 PHE QD H . . . 1 1 44 44 LEU MD2 H . . . . . 2.36348735276 1.66522829443 3.06174641109 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
89 1 . . 1 1 29 29 ILE MD H . . . 1 1 67 67 LEU MD1 H . . . . . 3.20565461120 1.92112692541 4.49018229699 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
90 1 . . 1 1 75 75 ILE MD H . . . 1 1 77 77 PHE HZ H . . . . . 2.97373897577 1.86834853877 4.07912941278 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
91 1 . . 1 1 42 42 LEU MD1 H . . . 1 1 78 78 TYR H H . . . . . 3.49599230783 1.96824703078 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
92 1 OR . 1 1 87 87 LEU MD2 H . . . 1 1 32 32 VAL MG2 H . . . . . 2.11115314388 1.55403219427 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
92 2 OR . 1 1 87 87 LEU MD2 H . . . 1 1 32 32 VAL MG1 H . . . . . 2.11115314388 1.55403219427 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
92 3 OR . 1 1 87 87 LEU MD2 H . . . 1 1 53 53 VAL MG2 H . . . . . 2.11115314388 1.55403219427 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
93 1 OR . 1 1 44 44 LEU MD1 H . . . 1 1 77 77 PHE QE H . . . . . 1.93567033121 1.46731787732 2.40402278510 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
93 2 OR . 1 1 44 44 LEU MD1 H . . . 1 1 69 69 PHE QE H . . . . . 1.93567033121 1.46731787732 2.40402278510 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
94 1 . . 1 1 29 29 ILE MD H . . . 1 1 77 77 PHE HZ H . . . . . 2.61633284874 1.76068315181 3.47198254566 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
95 1 OR . 1 1 19 19 TYR QE H . . . 1 1 11 11 LEU MD2 H . . . . . 2.33486616751 1.65341616499 4.46345962028 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
95 2 OR . 1 1 77 77 PHE QD H . . . 1 1 11 11 LEU MD2 H . . . . . 2.33486616751 1.65341616499 4.46345962028 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
96 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 69 69 PHE HZ H . . . . . 2.45803034530 1.70279119800 4.27998685140 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
97 1 . . 1 1 88 88 LEU MD2 H . . . 2 1 51 51 TYR QD H . . . . . 2.35400793147 1.66133876379 3.04667709914 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
98 1 . . 1 1 27 27 PHE QE H . . . 1 1 91 91 LEU MD2 H . . . . . 3.92720610605 1.99933763113 5.85507458098 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
99 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 77 77 PHE HZ H . . . . . 1.97431206599 1.48707354925 4.57738367902 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
100 1 . . 1 1 65 65 LEU MD1 H . . . 1 1 67 67 LEU MD2 H . . . . . 2.02125864633 1.51057283191 4.55691066721 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
101 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 9 9 TRP HE3 H . . . . . 3.28967631766 1.93693003329 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
102 1 . . 1 1 29 29 ILE MD H . . . 1 1 53 53 VAL MG1 H . . . . . 2.38705446989 1.67480083961 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
103 1 OR . 1 1 27 27 PHE QD H . . . 1 1 23 23 ILE MD H . . . . . 2.77152707246 1.81135678329 3.73169736164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
103 2 OR . 1 1 23 23 ILE MD H . . . 1 1 27 27 PHE HZ H . . . . . 2.77152707246 1.81135678329 3.73169736164 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
104 1 OR . 1 1 42 42 LEU MD2 H . . . 1 1 67 67 LEU MD2 H . . . . . 1.99477489905 1.49738403681 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
104 2 OR . 1 1 63 63 VAL MG1 H . . . 1 1 42 42 LEU MD2 H . . . . . 1.99477489905 1.49738403681 6.50000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
105 1 OR . 1 1 77 77 PHE QD H . . . 1 1 42 42 LEU MD2 H . . . . . 2.87184901685 1.84090941990 3.90278861380 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
105 2 OR . 1 1 42 42 LEU MD2 H . . . 1 1 54 54 ALA H H . . . . . 2.87184901685 1.84090941990 3.90278861380 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
106 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 69 69 PHE HZ H . . . . . 2.29622786048 1.63714506208 2.95531065889 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
107 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HZ3 H . . . . . 2.90885674565 1.85117579981 3.96653769150 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
108 1 . . 1 1 11 11 LEU MD2 H . . . 1 1 9 9 TRP HH2 H . . . . . 2.42261366125 1.68898154229 3.15624578022 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
109 1 . . 1 1 91 91 LEU MD2 H . . . 1 1 91 91 LEU MD1 H . . . . . 1.89241225384 1.44475923653 2.34006527116 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
110 1 . . 1 1 29 29 ILE MD H . . . 1 1 75 75 ILE MD H . . . . . 3.81253280474 1.99560700634 5.62945860314 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
111 1 . . 1 1 43 43 TYR QE H . . . 1 1 52 52 ILE MD H . . . . . 2.42981763768 1.69181591863 3.16781935673 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
112 1 . . 1 1 88 88 LEU MD1 H . . . 2 1 51 51 TYR QD H . . . . . 2.93524026505 1.85828583835 5.06884710822 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
113 1 OR . 1 1 44 44 LEU MD2 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.53121613042 1.73033424306 3.33209801779 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
113 2 OR . 1 1 87 87 LEU MD1 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.53121613042 1.73033424306 3.33209801779 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
113 3 OR . 1 1 65 65 LEU MD2 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.53121613042 1.73033424306 3.33209801779 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
113 4 OR . 1 1 44 44 LEU MD1 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.53121613042 1.73033424306 3.33209801779 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
114 1 . . 1 1 34 34 LEU MD2 H . . . 1 1 40 40 ALA H H . . . . . 3.59574891009 1.97957263204 5.21192518814 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
115 1 . . 1 1 67 67 LEU MD1 H . . . 5 1 8 8 PHE QE H . . . . . 2.58949761817 1.75131037886 5.36630348385 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
116 1 . . 1 1 29 29 ILE MD H . . . 1 1 11 11 LEU MD1 H . . . . . 2.98037667165 1.87004603353 5.70149256789 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
117 1 . . 1 1 77 77 PHE QD H . . . 1 1 87 87 LEU MD1 H . . . . . 2.63231013997 1.76617805585 4.60856652995 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
118 1 OR . 1 1 85 85 VAL MG2 H . . . 1 1 41 41 LYS H H . . . . . 2.68040518339 1.78233369000 4.90181435324 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
118 2 OR . 1 1 85 85 VAL MG2 H . . . 1 1 13 13 MET H H . . . . . 2.68040518339 1.78233369000 4.90181435324 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
119 1 OR . 5 1 8 8 PHE QD H . . . 1 1 67 67 LEU MD1 H . . . . . 2.71972363174 1.79511155261 5.94530051086 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
119 2 OR . 1 1 77 77 PHE QD H . . . 1 1 67 67 LEU MD1 H . . . . . 2.71972363174 1.79511155261 5.94530051086 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
120 1 OR . 1 1 87 87 LEU MD2 H . . . 1 1 11 11 LEU MD1 H . . . . . 2.26919850600 1.62554077355 2.91285623846 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
120 2 OR . 1 1 42 42 LEU MD2 H . . . 1 1 53 53 VAL MG1 H . . . . . 2.26919850600 1.62554077355 2.91285623846 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
121 1 . . 1 1 29 29 ILE MD H . . . 1 1 9 9 TRP HE3 H . . . . . 2.82812525136 1.82833869669 4.82973353499 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
122 1 . . 1 1 69 69 PHE HZ H . . . 1 1 53 53 VAL MG1 H . . . . . 3.43532361689 1.96014257279 4.91050466098 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
123 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 9 9 TRP HH2 H . . . . . 2.32565105895 1.64956945295 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
124 1 . . 1 1 69 69 PHE HZ H . . . 1 1 67 67 LEU MD2 H . . . . . 2.92327725793 1.85508351709 3.99147099877 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
125 1 . . 1 1 69 69 PHE QD H . . . 1 1 67 67 LEU MD2 H . . . . . 3.07593172976 1.89326222899 5.36765094155 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
126 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 67 67 LEU MD2 H . . . . . 2.21051080536 1.59971605278 4.06360491017 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
127 1 OR . 1 1 87 87 LEU MD1 H . . . 1 1 32 32 VAL MG1 H . . . . . 2.21088673599 1.59988421607 4.01129807138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
127 2 OR . 1 1 65 65 LEU MD2 H . . . 1 1 32 32 VAL MG1 H . . . . . 2.21088673599 1.59988421607 4.01129807138 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
128 1 OR . 1 1 87 87 LEU MD2 H . . . 1 1 42 42 LEU MD1 H . . . . . 1.97013093892 1.48495394936 4.26700207242 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
128 2 OR . 1 1 29 29 ILE MD H . . . 1 1 42 42 LEU MD1 H . . . . . 1.97013093892 1.48495394936 4.26700207242 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
129 1 OR . 1 1 42 42 LEU MD1 H . . . 5 1 88 88 LEU MD2 H . . . . . 2.51441137353 1.72412830411 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
129 2 OR . 1 1 42 42 LEU MD1 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.51441137353 1.72412830411 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
130 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 19 19 TYR QD H . . . . . 2.24162870900 1.61351630038 2.86974111763 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
131 1 OR . 1 1 44 44 LEU MD2 H . . . 1 1 51 51 TYR QE H . . . . . 2.46725521929 1.70633667965 4.80820630348 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
131 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 69 69 PHE QD H . . . . . 2.46725521929 1.70633667965 4.80820630348 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
132 1 . . 1 1 34 34 LEU MD1 H . . . 1 1 85 85 VAL MG1 H . . . . . 2.32582441710 1.64964201470 3.00200681949 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
133 1 . . 1 1 85 85 VAL MG1 H . . . 1 1 33 33 ALA H H . . . . . 3.79024400791 1.99450030297 5.58598771286 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
134 1 . . 1 1 88 88 LEU MD2 H . . . 2 1 51 51 TYR QE H . . . . . 2.86154457962 1.83798990698 3.88509925227 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
135 1 . . 1 1 44 44 LEU MD1 H . . . 1 1 76 76 MET H H . . . . . 3.83923487141 1.99676932168 5.68170042113 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
136 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 77 77 PHE QE H . . . . . 2.65508194840 1.77389942931 4.57117618718 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
137 1 . . 1 1 29 29 ILE MD H . . . 1 1 67 67 LEU MD2 H . . . . . 2.79090187305 1.81726021493 5.06383469058 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
138 1 . . 1 1 69 69 PHE QE H . . . 1 1 23 23 ILE MD H . . . . . 3.46402279016 1.96409105382 4.96395452650 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
139 1 . . 1 1 75 75 ILE MD H . . . 1 1 23 23 ILE MD H . . . . . 2.95658899207 1.86391168357 4.04926630058 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
140 1 . . 1 1 51 51 TYR QD H . . . 1 1 53 53 VAL MG1 H . . . . . 4.09690626543 1.99882614697 6.19498638390 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
141 1 . . 1 1 69 69 PHE HZ H . . . 1 1 53 53 VAL MG2 H . . . . . 3.87859435844 1.99815758377 5.75903113311 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
142 1 . . 1 1 67 67 LEU MD1 H . . . 1 1 77 77 PHE HZ H . . . . . 2.71792372061 1.79453505173 4.75414065582 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
143 1 . . 1 1 32 32 VAL MG1 H . . . 1 1 86 86 SER H H . . . . . 3.50880211427 1.96984057963 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
144 1 . . 1 1 44 44 LEU MD1 H . . . 5 1 8 8 PHE QE H . . . . . 2.32162545341 1.64788236017 2.99536854665 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
145 1 . . 1 1 87 87 LEU MD1 H . . . 1 1 69 69 PHE HZ H . . . . . 3.24818251565 1.92934630878 5.67372777323 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
146 1 OR . 1 1 65 65 LEU MD2 H . . . 1 1 32 32 VAL MG2 H . . . . . 2.10078975312 1.54912505477 2.65245445148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
146 2 OR . 1 1 87 87 LEU MD1 H . . . 1 1 32 32 VAL MG2 H . . . . . 2.10078975312 1.54912505477 2.65245445148 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
147 1 OR . 1 1 42 42 LEU MD2 H . . . 1 1 67 67 LEU MD2 H . . . . . 2.77623403529 1.81279960795 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
147 2 OR . 1 1 87 87 LEU MD2 H . . . 1 1 67 67 LEU MD2 H . . . . . 2.77623403529 1.81279960795 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
148 1 OR . 1 1 56 56 VAL MG1 H . . . 1 1 60 60 ILE H H . . . . . 3.09709774233 1.89809593914 4.29609954553 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
148 2 OR . 1 1 62 62 GLN H H . . . 1 1 56 56 VAL MG1 H . . . . . 3.09709774233 1.89809593914 4.29609954553 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
149 1 OR . 1 1 87 87 LEU MD2 H . . . 1 1 53 53 VAL MG2 H . . . . . 2.11623840940 1.55643028372 5.48529674656 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
149 2 OR . 1 1 42 42 LEU MD2 H . . . 1 1 53 53 VAL MG2 H . . . . . 2.11623840940 1.55643028372 5.48529674656 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
150 1 . . 1 1 91 91 LEU MD1 H . . . 1 1 9 9 TRP HD1 H . . . . . 4.04836116505 1.99970764971 6.09701468038 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
151 1 . . 1 1 27 27 PHE QE H . . . 1 1 23 23 ILE MD H . . . . . 2.60964944826 1.75836566791 3.46093322861 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
152 1 . . 1 1 77 77 PHE QD H . . . 1 1 87 87 LEU MD2 H . . . . . 2.73766785357 1.80081469401 3.67452101313 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
153 1 OR . 1 1 32 32 VAL MG2 H . . . 1 1 42 42 LEU MD2 H . . . . . 1.85708028176 1.42598688515 4.74179847715 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
153 2 OR . 1 1 42 42 LEU MD2 H . . . 1 1 53 53 VAL MG2 H . . . . . 1.85708028176 1.42598688515 4.74179847715 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
153 3 OR . 1 1 32 32 VAL MG1 H . . . 1 1 42 42 LEU MD2 H . . . . . 1.85708028176 1.42598688515 4.74179847715 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
153 4 OR . 1 1 42 42 LEU MD2 H . . . 1 1 56 56 VAL MG2 H . . . . . 1.85708028176 1.42598688515 4.74179847715 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
154 1 OR . 1 1 34 34 LEU MD2 H . . . 1 1 56 56 VAL MG2 H . . . . . 2.25844083805 1.62087146068 4.02116962962 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
154 2 OR . 1 1 34 34 LEU MD2 H . . . 1 1 56 56 VAL MG1 H . . . . . 2.25844083805 1.62087146068 4.02116962962 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
155 1 . . 1 1 53 53 VAL MG1 H . . . 1 1 67 67 LEU MD1 H . . . . . 2.11032370757 1.55364043873 4.70217640508 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
156 1 OR . 1 1 44 44 LEU MD2 H . . . 1 1 69 69 PHE QE H . . . . . 1.91737242698 1.45783279901 2.37691205495 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
156 2 OR . 1 1 44 44 LEU MD2 H . . . 1 1 77 77 PHE QE H . . . . . 1.91737242698 1.45783279901 2.37691205495 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
157 1 OR . 1 1 88 88 LEU MD2 H . . . 2 1 53 53 VAL MG2 H . . . . . 2.64330675246 1.76992292901 4.63592744574 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
157 2 OR . 1 1 88 88 LEU MD2 H . . . 2 1 65 65 LEU MD2 H . . . . . 2.64330675246 1.76992292901 4.63592744574 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
158 1 . . 1 1 69 69 PHE QD H . . . 1 1 67 67 LEU MD1 H . . . . . 3.17532416957 1.91498872184 5.66943466339 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
159 1 . . 1 1 65 65 LEU MD2 H . . . 1 1 67 67 LEU MD2 H . . . . . 2.32655688719 1.64994851852 4.06360491017 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
160 1 OR . 1 1 62 62 GLN H H . . . 1 1 56 56 VAL MG2 H . . . . . 3.93979003432 1.99954684500 5.88003322364 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
160 2 OR . 1 1 56 56 VAL MG2 H . . . 1 1 60 60 ILE H H . . . . . 3.93979003432 1.99954684500 5.88003322364 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
161 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 11 11 LEU MD2 H . . . . . 2.35039586461 1.65985077456 4.48895235287 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
162 1 . . 1 1 11 11 LEU MD1 H . . . 1 1 9 9 TRP HH2 H . . . . . 2.99688264244 1.87421944587 4.11954583902 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
163 1 . . 1 1 44 44 LEU MD2 H . . . 5 1 8 8 PHE HZ H . . . . . 2.83491358052 1.83032170439 4.91047173440 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
164 1 . . 1 1 44 44 LEU MD2 H . . . 1 1 75 75 ILE MD H . . . . . 2.49160062552 1.71559141588 3.26760983515 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
165 1 . . 1 1 87 87 LEU MD2 H . . . 1 1 9 9 TRP HE3 H . . . . . 3.61987301322 1.98193793424 6.00000000000 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
166 1 . . 1 1 88 88 LEU MD1 H . . . 1 1 8 8 PHE QD H . . . . . 3.01578422130 1.87891491262 5.28325942259 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 13
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