NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
624202 | 6bf3 | 30365 | cing | 4-filtered-FRED | STAR | entry | full | 17 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6bf3 # This FRED archive file contains, for PDB entry <6bf3>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_6bf3 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6bf3 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 780.80 loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 . 1 $QDP_DPR_K_2TL__DAS_ A . 1 1 stop_ save_ save_QDP_DPR_K_2TL__DAS_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "QDP DPR K 2TL DAS " _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code QDPXKTX _Entity.Number_of_monomers 7 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLN . 1 1 2 ASP . 1 1 3 PRO . 1 1 4 DPR $DPR 1 1 5 LYS . 1 1 6 DTH . 1 1 7 . $. 1 1 stop_ loop_ _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 GLN 1 1 1 1 ASP 2 2 1 1 PRO 3 3 1 1 DPR 4 4 1 1 LYS 5 5 1 1 DTH 6 6 1 1 . 7 7 1 1 stop_ save_ save_DPR _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID DPR _Chem_comp.Type non-polymer save_ save_. _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID . _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 4 DPR HA . 3 . HA 1 1 1 1 2 1 1 4 DPR HD3 . 3 . HD2 1 1 2 1 1 1 1 4 DPR HA . 3 . HA 1 1 2 1 2 1 1 5 LYS QD . 4 . HD2 1 1 3 1 1 1 1 4 DPR HA . 3 . HA 1 1 3 1 2 1 1 6 DTH H . 5 . HN 1 1 4 1 1 1 1 4 DPR HB2 . 3 . HB1 1 1 4 1 2 1 1 4 DPR HD2 . 3 . HD1 1 1 5 1 1 1 1 4 DPR HB2 . 3 . HB1 1 1 5 1 2 1 1 4 DPR HD3 . 3 . HD2 1 1 6 1 1 1 1 4 DPR HB3 . 3 . HB2 1 1 6 1 2 1 1 4 DPR HD2 . 3 . HD1 1 1 7 1 1 1 1 4 DPR HB3 . 3 . HB2 1 1 7 1 2 1 1 4 DPR HD3 . 3 . HD2 1 1 8 1 1 1 1 4 DPR HD2 . 3 . HD1 1 1 8 1 2 1 1 4 DPR HG2 . 3 . HG1 1 1 9 1 1 1 1 4 DPR HD2 . 3 . HD1 1 1 9 1 2 1 1 4 DPR HG3 . 3 . HG2 1 1 10 1 1 1 1 4 DPR HD3 . 3 . HD2 1 1 10 1 2 1 1 4 DPR HG2 . 3 . HG1 1 1 11 1 1 1 1 4 DPR HD3 . 3 . HD2 1 1 11 1 2 1 1 4 DPR HG3 . 3 . HG2 1 1 12 1 1 1 1 4 DPR HG3 . 3 . HG2 1 1 12 1 2 1 1 5 LYS QD . 4 . HD2 1 1 13 1 1 1 1 5 LYS HA . 4 . HA 1 1 13 1 2 1 1 5 LYS QG . 4 . HG2 1 1 14 1 1 1 1 5 LYS HA . 4 . HA 1 1 14 1 2 1 1 6 DTH H . 5 . HN 1 1 15 1 1 1 1 5 LYS QD . 4 . HD2 1 1 15 1 2 1 1 6 DTH H . 5 . HN 1 1 16 1 1 1 1 6 DTH H . 5 . HN 1 1 16 1 2 1 1 6 DTH HA . 5 . HA 1 1 17 1 1 1 1 6 DTH H . 5 . HN 1 1 17 1 2 1 1 6 DTH HB . 5 . HB# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 4.5 2.9 6.1 1 1 2 1 . . . . . 4.5 2.9 6.1 1 1 3 1 . . . . . 4.5 2.9 6.1 1 1 4 1 . . . . . 4.5 2.9 6.1 1 1 5 1 . . . . . 4.5 2.9 6.1 1 1 6 1 . . . . . 4.5 2.9 6.1 1 1 7 1 . . . . . 4.5 2.9 6.1 1 1 8 1 . . . . . 4.5 2.9 6.1 1 1 9 1 . . . . . 4.5 2.9 6.1 1 1 10 1 . . . . . 3.5 2.3 4.7 1 1 11 1 . . . . . 3.5 2.3 4.7 1 1 12 1 . . . . . 4.5 2.9 6.1 1 1 13 1 . . . . . 4.5 2.9 6.1 1 1 14 1 . . . . . 4.5 2.9 6.1 1 1 15 1 . . . . . 4.5 2.9 6.1 1 1 16 1 . . . . . 4.5 2.9 6.1 1 1 17 1 . . . . . 4.5 2.9 6.1 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLN C C 17.170 14.950 20.700 1.00 . A A . 1 GLN C 1 1 1 2 1 1 1 GLN CA C 18.430 15.400 21.430 1.00 . A A . 1 GLN CA 1 1 1 3 1 1 1 GLN CB C 18.400 15.160 22.930 1.00 . A A . 1 GLN CB 1 1 1 4 1 1 1 GLN CD C 20.900 14.750 23.190 1.00 . A A . 1 GLN CD 1 1 1 5 1 1 1 GLN CG C 19.680 15.550 23.660 1.00 . A A . 1 GLN CG 1 1 1 6 1 1 1 GLN H1 H 19.980 16.690 20.760 1.00 . A A . 1 GLN H1 1 1 1 7 1 1 1 GLN HA H 19.120 14.660 21.010 1.00 . A A . 1 GLN HA 1 1 1 8 1 1 1 GLN HB2 H 17.600 15.750 23.390 1.00 . A A . 1 GLN HB2 1 1 1 9 1 1 1 GLN HB3 H 18.130 14.130 23.180 1.00 . A A . 1 GLN HB3 1 1 1 10 1 1 1 GLN HE21 H 20.230 13.210 24.190 1.00 . A A . 1 GLN HE21 1 1 1 11 1 1 1 GLN HE22 H 21.670 12.820 23.220 1.00 . A A . 1 GLN HE22 1 1 1 12 1 1 1 GLN HG2 H 19.890 16.600 23.470 1.00 . A A . 1 GLN HG2 1 1 1 13 1 1 1 GLN HG3 H 19.620 15.510 24.750 1.00 . A A . 1 GLN HG3 1 1 1 14 1 1 1 GLN N N 19.010 16.670 21.040 1.00 . A A . 1 GLN N 1 1 1 15 1 1 1 GLN NE2 N 20.960 13.470 23.550 1.00 . A A . 1 GLN NE2 1 1 1 16 1 1 1 GLN O O 16.520 14.020 21.160 1.00 . A A . 1 GLN O 1 1 1 17 1 1 1 GLN OE1 O 21.720 15.260 22.420 1.00 . A A . 1 GLN OE1 1 1 1 18 1 1 2 ASP C C 15.730 15.540 17.370 1.00 . A A . 2 ASP C 1 1 1 19 1 1 2 ASP CA C 15.610 15.250 18.860 1.00 . A A . 2 ASP CA 1 1 1 20 1 1 2 ASP CB C 14.460 16.130 19.360 1.00 . A A . 2 ASP CB 1 1 1 21 1 1 2 ASP CG C 13.150 15.850 18.640 1.00 . A A . 2 ASP CG 1 1 1 22 1 1 2 ASP H H 17.410 16.330 19.250 1.00 . A A . 2 ASP H 1 1 1 23 1 1 2 ASP HA H 15.250 14.240 19.030 1.00 . A A . 2 ASP HA 1 1 1 24 1 1 2 ASP HB2 H 14.270 15.910 20.410 1.00 . A A . 2 ASP HB2 1 1 1 25 1 1 2 ASP HB3 H 14.730 17.180 19.300 1.00 . A A . 2 ASP HB3 1 1 1 26 1 1 2 ASP N N 16.850 15.550 19.550 1.00 . A A . 2 ASP N 1 1 1 27 1 1 2 ASP O O 15.770 16.710 16.980 1.00 . A A . 2 ASP O 1 1 1 28 1 1 2 ASP OD1 O 12.150 16.540 18.940 1.00 . A A . 2 ASP OD1 1 1 1 29 1 1 2 ASP OD2 O 13.020 14.790 17.990 1.00 . A A . 2 ASP OD2 1 1 1 30 1 1 3 PRO C C 15.900 15.440 14.290 1.00 . A A . 3 PRO C 1 1 1 31 1 1 3 PRO CA C 16.650 14.630 15.340 1.00 . A A . 3 PRO CA 1 1 1 32 1 1 3 PRO CB C 17.110 13.270 14.830 1.00 . A A . 3 PRO CB 1 1 1 33 1 1 3 PRO CD C 15.830 13.070 16.860 1.00 . A A . 3 PRO CD 1 1 1 34 1 1 3 PRO CG C 16.060 12.400 15.510 1.00 . A A . 3 PRO CG 1 1 1 35 1 1 3 PRO HA H 17.550 15.170 15.620 1.00 . A A . 3 PRO HA 1 1 1 36 1 1 3 PRO HB2 H 17.090 13.150 13.750 1.00 . A A . 3 PRO HB2 1 1 1 37 1 1 3 PRO HB3 H 18.140 13.110 15.180 1.00 . A A . 3 PRO HB3 1 1 1 38 1 1 3 PRO HD2 H 14.870 12.870 17.340 1.00 . A A . 3 PRO HD2 1 1 1 39 1 1 3 PRO HD3 H 16.590 12.950 17.630 1.00 . A A . 3 PRO HD3 1 1 1 40 1 1 3 PRO HG2 H 15.180 12.400 14.860 1.00 . A A . 3 PRO HG2 1 1 1 41 1 1 3 PRO HG3 H 16.360 11.360 15.620 1.00 . A A . 3 PRO HG3 1 1 1 42 1 1 3 PRO N N 15.890 14.490 16.570 1.00 . A A . 3 PRO N 1 1 1 43 1 1 3 PRO O O 14.680 15.530 14.210 1.00 . A A . 3 PRO O 1 1 1 44 1 1 4 DPR C C 15.530 18.350 13.100 1.00 . A A . 4 DPR C 1 1 1 45 1 1 4 DPR CA C 16.140 17.100 12.500 1.00 . A A . 4 DPR CA 1 1 1 46 1 1 4 DPR CB C 17.170 17.360 11.410 1.00 . A A . 4 DPR CB 1 1 1 47 1 1 4 DPR CD C 18.030 15.830 13.040 1.00 . A A . 4 DPR CD 1 1 1 48 1 1 4 DPR CG C 18.450 17.000 12.150 1.00 . A A . 4 DPR CG 1 1 1 49 1 1 4 DPR HA H 15.250 16.620 12.070 1.00 . A A . 4 DPR HA 1 1 1 50 1 1 4 DPR HB2 H 17.280 18.370 11.020 1.00 . A A . 4 DPR HB2 1 1 1 51 1 1 4 DPR HB3 H 17.140 16.720 10.520 1.00 . A A . 4 DPR HB3 1 1 1 52 1 1 4 DPR HD2 H 18.810 15.780 13.800 1.00 . A A . 4 DPR HD2 1 1 1 53 1 1 4 DPR HD3 H 17.980 14.880 12.510 1.00 . A A . 4 DPR HD3 1 1 1 54 1 1 4 DPR HG2 H 18.770 17.820 12.800 1.00 . A A . 4 DPR HG2 1 1 1 55 1 1 4 DPR HG3 H 19.230 16.740 11.430 1.00 . A A . 4 DPR HG3 1 1 1 56 1 1 4 DPR N N 16.660 16.100 13.410 1.00 . A A . 4 DPR N 1 1 1 57 1 1 4 DPR O O 15.230 19.290 12.370 1.00 . A A . 4 DPR O 1 1 1 58 1 1 5 LYS C C 16.120 20.250 15.880 1.00 . A A . 5 LYS C 1 1 1 59 1 1 5 LYS CA C 14.960 19.580 15.160 1.00 . A A . 5 LYS CA 1 1 1 60 1 1 5 LYS CB C 13.800 19.250 16.090 1.00 . A A . 5 LYS CB 1 1 1 61 1 1 5 LYS CD C 11.940 17.490 15.720 1.00 . A A . 5 LYS CD 1 1 1 62 1 1 5 LYS CE C 10.630 17.160 15.000 1.00 . A A . 5 LYS CE 1 1 1 63 1 1 5 LYS CG C 12.480 18.880 15.430 1.00 . A A . 5 LYS CG 1 1 1 64 1 1 5 LYS H H 15.490 17.570 15.000 1.00 . A A . 5 LYS H 1 1 1 65 1 1 5 LYS HA H 14.640 20.240 14.350 1.00 . A A . 5 LYS HA 1 1 1 66 1 1 5 LYS HB2 H 14.050 18.590 16.920 1.00 . A A . 5 LYS HB2 1 1 1 67 1 1 5 LYS HB3 H 13.590 20.220 16.550 1.00 . A A . 5 LYS HB3 1 1 1 68 1 1 5 LYS HD2 H 12.700 16.750 15.470 1.00 . A A . 5 LYS HD2 1 1 1 69 1 1 5 LYS HD3 H 11.740 17.350 16.790 1.00 . A A . 5 LYS HD3 1 1 1 70 1 1 5 LYS HE2 H 9.810 17.840 15.240 1.00 . A A . 5 LYS HE2 1 1 1 71 1 1 5 LYS HE3 H 10.820 17.300 13.940 1.00 . A A . 5 LYS HE3 1 1 1 72 1 1 5 LYS HG2 H 11.680 19.520 15.820 1.00 . A A . 5 LYS HG2 1 1 1 73 1 1 5 LYS HG3 H 12.500 19.030 14.350 1.00 . A A . 5 LYS HG3 1 1 1 74 1 1 5 LYS HZ1 H 10.020 15.640 16.190 1.00 . A A . 5 LYS HZ1 1 1 1 75 1 1 5 LYS HZ2 H 11.090 15.110 15.060 1.00 . A A . 5 LYS HZ2 1 1 1 76 1 1 5 LYS HZ3 H 9.530 15.440 14.680 1.00 . A A . 5 LYS HZ3 1 1 1 77 1 1 5 LYS N N 15.390 18.400 14.430 1.00 . A A . 5 LYS N 1 1 1 78 1 1 5 LYS NZ N 10.320 15.740 15.230 1.00 . A A . 5 LYS NZ 1 1 1 79 1 1 5 LYS O O 16.160 21.480 15.900 1.00 . A A . 5 LYS O 1 1 1 80 1 1 6 DTH C C 18.570 19.160 18.430 1.00 . A A . 6 DTH C 1 1 1 81 1 1 6 DTH CA C 18.140 20.090 17.300 1.00 . A A . 6 DTH CA 1 1 1 82 1 1 6 DTH CB C 19.420 20.290 16.500 1.00 . A A . 6 DTH CB 1 1 1 83 1 1 6 DTH CG2 C 19.680 19.250 15.410 1.00 . A A . 6 DTH CG2 1 1 1 84 1 1 6 DTH H H 16.800 18.560 16.670 1.00 . A A . 6 DTH H 1 1 1 85 1 1 6 DTH HA H 17.870 21.060 17.720 1.00 . A A . 6 DTH HA 1 1 1 86 1 1 6 DTH HB H 20.260 20.320 17.190 1.00 . A A . 6 DTH HB 1 1 1 87 1 1 6 DTH HG1 H 18.690 21.230 15.060 1.00 . A A . 6 DTH HG1 1 1 1 88 1 1 6 DTH HG21 H 18.970 19.290 14.580 1.00 . A A . 6 DTH HG21 1 1 1 89 1 1 6 DTH HG22 H 19.780 18.230 15.780 1.00 . A A . 6 DTH HG22 1 1 1 90 1 1 6 DTH HG23 H 20.670 19.530 15.030 1.00 . A A . 6 DTH HG23 1 1 1 91 1 1 6 DTH N N 17.030 19.540 16.540 1.00 . A A . 6 DTH N 1 1 1 92 1 1 6 DTH O O 18.910 18.000 18.230 1.00 . A A . 6 DTH O 1 1 1 93 1 1 6 DTH OG1 O 19.400 21.440 15.680 1.00 . A A . 6 DTH OG1 1 1 1 94 1 1 7 . C C 18.330 17.810 21.110 1.00 . A A . 7 DAS C 1 1 1 95 1 1 7 . CA C 19.130 19.070 20.790 1.00 . A A . 7 DAS CA 1 1 1 96 1 1 7 . CB C 20.640 18.920 20.750 1.00 . A A . 7 DAS CB 1 1 1 97 1 1 7 . CG C 21.560 20.090 20.440 1.00 . A A . 7 DAS CG 1 1 1 98 1 1 7 . H H 18.630 20.790 19.650 1.00 . A A . 7 DAS H 1 1 1 99 1 1 7 . HA H 18.980 19.720 21.660 1.00 . A A . 7 DAS HA 1 1 1 100 1 1 7 . HB2 H 20.920 18.190 19.980 1.00 . A A . 7 DAS HB2 1 1 1 101 1 1 7 . HB3 H 21.040 18.420 21.640 1.00 . A A . 7 DAS HB3 1 1 1 102 1 1 7 . N N 18.690 19.780 19.610 1.00 . A A . 7 DAS N 1 1 1 103 1 1 7 . O O 17.130 17.910 21.360 1.00 . A A . 7 DAS O 1 1 1 104 1 1 7 . OD1 O 22.560 19.950 19.700 1.00 . A A . 7 DAS OD1 1 1 1 105 1 1 7 . OD2 O 21.320 21.190 20.980 1.00 . A A . 7 DAS OD2 1 1 2 106 1 1 1 GLN C C 17.067 15.074 20.647 1.00 . A A . 1 GLN C 1 1 2 107 1 1 1 GLN CA C 18.349 15.358 21.423 1.00 . A A . 1 GLN CA 1 1 2 108 1 1 1 GLN CB C 18.206 15.013 22.900 1.00 . A A . 1 GLN CB 1 1 2 109 1 1 1 GLN CD C 20.492 14.682 23.895 1.00 . A A . 1 GLN CD 1 1 2 110 1 1 1 GLN CG C 19.196 15.476 23.961 1.00 . A A . 1 GLN CG 1 1 2 111 1 1 1 GLN H1 H 19.908 16.642 20.932 1.00 . A A . 1 GLN H1 1 1 2 112 1 1 1 GLN HA H 19.106 14.676 21.022 1.00 . A A . 1 GLN HA 1 1 2 113 1 1 1 GLN HB2 H 17.257 15.501 23.147 1.00 . A A . 1 GLN HB2 1 1 2 114 1 1 1 GLN HB3 H 18.172 13.925 22.978 1.00 . A A . 1 GLN HB3 1 1 2 115 1 1 1 GLN HE21 H 19.534 12.952 24.438 1.00 . A A . 1 GLN HE21 1 1 2 116 1 1 1 GLN HE22 H 21.286 12.882 24.117 1.00 . A A . 1 GLN HE22 1 1 2 117 1 1 1 GLN HG2 H 19.355 16.545 23.807 1.00 . A A . 1 GLN HG2 1 1 2 118 1 1 1 GLN HG3 H 18.822 15.341 24.975 1.00 . A A . 1 GLN HG3 1 1 2 119 1 1 1 GLN N N 18.928 16.658 21.159 1.00 . A A . 1 GLN N 1 1 2 120 1 1 1 GLN NE2 N 20.412 13.379 24.203 1.00 . A A . 1 GLN NE2 1 1 2 121 1 1 1 GLN O O 16.336 14.205 21.138 1.00 . A A . 1 GLN O 1 1 2 122 1 1 1 GLN OE1 O 21.561 15.144 23.484 1.00 . A A . 1 GLN OE1 1 1 2 123 1 1 2 ASP C C 15.888 15.517 17.257 1.00 . A A . 2 ASP C 1 1 2 124 1 1 2 ASP CA C 15.559 15.464 18.747 1.00 . A A . 2 ASP CA 1 1 2 125 1 1 2 ASP CB C 14.450 16.403 19.192 1.00 . A A . 2 ASP CB 1 1 2 126 1 1 2 ASP CG C 13.060 16.055 18.674 1.00 . A A . 2 ASP CG 1 1 2 127 1 1 2 ASP H H 17.253 16.556 19.263 1.00 . A A . 2 ASP H 1 1 2 128 1 1 2 ASP HA H 15.272 14.454 19.033 1.00 . A A . 2 ASP HA 1 1 2 129 1 1 2 ASP HB2 H 14.407 16.340 20.285 1.00 . A A . 2 ASP HB2 1 1 2 130 1 1 2 ASP HB3 H 14.651 17.421 18.862 1.00 . A A . 2 ASP HB3 1 1 2 131 1 1 2 ASP N N 16.749 15.729 19.533 1.00 . A A . 2 ASP N 1 1 2 132 1 1 2 ASP O O 16.252 16.597 16.798 1.00 . A A . 2 ASP O 1 1 2 133 1 1 2 ASP OD1 O 12.077 16.601 19.228 1.00 . A A . 2 ASP OD1 1 1 2 134 1 1 2 ASP OD2 O 12.968 15.220 17.747 1.00 . A A . 2 ASP OD2 1 1 2 135 1 1 3 PRO C C 16.083 15.228 14.159 1.00 . A A . 3 PRO C 1 1 2 136 1 1 3 PRO CA C 16.736 14.447 15.295 1.00 . A A . 3 PRO CA 1 1 2 137 1 1 3 PRO CB C 17.096 12.994 15.014 1.00 . A A . 3 PRO CB 1 1 2 138 1 1 3 PRO CD C 15.563 13.076 16.871 1.00 . A A . 3 PRO CD 1 1 2 139 1 1 3 PRO CG C 15.931 12.244 15.639 1.00 . A A . 3 PRO CG 1 1 2 140 1 1 3 PRO HA H 17.707 14.918 15.468 1.00 . A A . 3 PRO HA 1 1 2 141 1 1 3 PRO HB2 H 17.177 12.690 13.965 1.00 . A A . 3 PRO HB2 1 1 2 142 1 1 3 PRO HB3 H 17.959 12.685 15.595 1.00 . A A . 3 PRO HB3 1 1 2 143 1 1 3 PRO HD2 H 14.493 13.035 17.083 1.00 . A A . 3 PRO HD2 1 1 2 144 1 1 3 PRO HD3 H 16.078 12.753 17.775 1.00 . A A . 3 PRO HD3 1 1 2 145 1 1 3 PRO HG2 H 15.063 12.302 14.982 1.00 . A A . 3 PRO HG2 1 1 2 146 1 1 3 PRO HG3 H 16.082 11.198 15.905 1.00 . A A . 3 PRO HG3 1 1 2 147 1 1 3 PRO N N 15.952 14.424 16.503 1.00 . A A . 3 PRO N 1 1 2 148 1 1 3 PRO O O 14.880 15.086 13.942 1.00 . A A . 3 PRO O 1 1 2 149 1 1 4 DPR C C 15.506 18.334 13.246 1.00 . A A . 4 DPR C 1 1 2 150 1 1 4 DPR CA C 16.187 17.151 12.571 1.00 . A A . 4 DPR CA 1 1 2 151 1 1 4 DPR CB C 17.405 17.622 11.781 1.00 . A A . 4 DPR CB 1 1 2 152 1 1 4 DPR CD C 18.176 15.969 13.258 1.00 . A A . 4 DPR CD 1 1 2 153 1 1 4 DPR CG C 18.367 16.435 11.812 1.00 . A A . 4 DPR CG 1 1 2 154 1 1 4 DPR HA H 15.485 16.624 11.920 1.00 . A A . 4 DPR HA 1 1 2 155 1 1 4 DPR HB2 H 17.803 18.517 12.256 1.00 . A A . 4 DPR HB2 1 1 2 156 1 1 4 DPR HB3 H 17.172 17.919 10.753 1.00 . A A . 4 DPR HB3 1 1 2 157 1 1 4 DPR HD2 H 18.700 16.695 13.876 1.00 . A A . 4 DPR HD2 1 1 2 158 1 1 4 DPR HD3 H 18.625 14.995 13.413 1.00 . A A . 4 DPR HD3 1 1 2 159 1 1 4 DPR HG2 H 19.388 16.753 11.639 1.00 . A A . 4 DPR HG2 1 1 2 160 1 1 4 DPR HG3 H 18.039 15.686 11.081 1.00 . A A . 4 DPR HG3 1 1 2 161 1 1 4 DPR N N 16.748 16.131 13.435 1.00 . A A . 4 DPR N 1 1 2 162 1 1 4 DPR O O 14.959 19.191 12.558 1.00 . A A . 4 DPR O 1 1 2 163 1 1 5 LYS C C 15.928 20.197 16.175 1.00 . A A . 5 LYS C 1 1 2 164 1 1 5 LYS CA C 14.898 19.495 15.291 1.00 . A A . 5 LYS CA 1 1 2 165 1 1 5 LYS CB C 13.587 19.084 15.962 1.00 . A A . 5 LYS CB 1 1 2 166 1 1 5 LYS CD C 11.243 18.295 15.827 1.00 . A A . 5 LYS CD 1 1 2 167 1 1 5 LYS CE C 10.293 17.563 14.890 1.00 . A A . 5 LYS CE 1 1 2 168 1 1 5 LYS CG C 12.467 18.708 15.002 1.00 . A A . 5 LYS CG 1 1 2 169 1 1 5 LYS H H 16.015 17.684 15.082 1.00 . A A . 5 LYS H 1 1 2 170 1 1 5 LYS HA H 14.672 20.300 14.588 1.00 . A A . 5 LYS HA 1 1 2 171 1 1 5 LYS HB2 H 13.854 18.256 16.623 1.00 . A A . 5 LYS HB2 1 1 2 172 1 1 5 LYS HB3 H 13.216 19.878 16.609 1.00 . A A . 5 LYS HB3 1 1 2 173 1 1 5 LYS HD2 H 11.531 17.587 16.596 1.00 . A A . 5 LYS HD2 1 1 2 174 1 1 5 LYS HD3 H 10.650 19.100 16.251 1.00 . A A . 5 LYS HD3 1 1 2 175 1 1 5 LYS HE2 H 9.926 18.220 14.109 1.00 . A A . 5 LYS HE2 1 1 2 176 1 1 5 LYS HE3 H 10.874 16.780 14.401 1.00 . A A . 5 LYS HE3 1 1 2 177 1 1 5 LYS HG2 H 12.213 19.513 14.309 1.00 . A A . 5 LYS HG2 1 1 2 178 1 1 5 LYS HG3 H 12.777 17.900 14.337 1.00 . A A . 5 LYS HG3 1 1 2 179 1 1 5 LYS HZ1 H 8.732 16.311 15.200 1.00 . A A . 5 LYS HZ1 1 1 2 180 1 1 5 LYS HZ2 H 8.466 17.671 15.879 1.00 . A A . 5 LYS HZ2 1 1 2 181 1 1 5 LYS HZ3 H 9.498 16.516 16.571 1.00 . A A . 5 LYS HZ3 1 1 2 182 1 1 5 LYS N N 15.507 18.390 14.579 1.00 . A A . 5 LYS N 1 1 2 183 1 1 5 LYS NZ N 9.218 17.006 15.735 1.00 . A A . 5 LYS NZ 1 1 2 184 1 1 5 LYS O O 15.586 21.230 16.750 1.00 . A A . 5 LYS O 1 1 2 185 1 1 6 DTH C C 18.443 19.159 18.447 1.00 . A A . 6 DTH C 1 1 2 186 1 1 6 DTH CA C 18.079 20.099 17.300 1.00 . A A . 6 DTH CA 1 1 2 187 1 1 6 DTH CB C 19.388 20.403 16.588 1.00 . A A . 6 DTH CB 1 1 2 188 1 1 6 DTH CG2 C 19.869 19.336 15.603 1.00 . A A . 6 DTH CG2 1 1 2 189 1 1 6 DTH H H 17.180 18.612 16.057 1.00 . A A . 6 DTH H 1 1 2 190 1 1 6 DTH HA H 17.734 21.015 17.778 1.00 . A A . 6 DTH HA 1 1 2 191 1 1 6 DTH HB H 20.225 20.514 17.279 1.00 . A A . 6 DTH HB 1 1 2 192 1 1 6 DTH HG1 H 19.724 22.291 16.154 1.00 . A A . 6 DTH HG1 1 1 2 193 1 1 6 DTH HG21 H 20.847 19.639 15.216 1.00 . A A . 6 DTH HG21 1 1 2 194 1 1 6 DTH HG22 H 19.107 19.295 14.837 1.00 . A A . 6 DTH HG22 1 1 2 195 1 1 6 DTH HG23 H 19.946 18.430 16.207 1.00 . A A . 6 DTH HG23 1 1 2 196 1 1 6 DTH N N 17.048 19.524 16.466 1.00 . A A . 6 DTH N 1 1 2 197 1 1 6 DTH O O 18.506 17.933 18.399 1.00 . A A . 6 DTH O 1 1 2 198 1 1 6 DTH OG1 O 19.119 21.601 15.894 1.00 . A A . 6 DTH OG1 1 1 2 199 1 1 7 . C C 18.435 17.903 21.201 1.00 . A A . 7 DAS C 1 1 2 200 1 1 7 . CA C 19.252 19.106 20.752 1.00 . A A . 7 DAS CA 1 1 2 201 1 1 7 . CB C 20.749 18.909 20.585 1.00 . A A . 7 DAS CB 1 1 2 202 1 1 7 . CG C 21.600 20.088 20.140 1.00 . A A . 7 DAS CG 1 1 2 203 1 1 7 . H H 18.552 20.785 19.698 1.00 . A A . 7 DAS H 1 1 2 204 1 1 7 . HA H 19.180 19.851 21.542 1.00 . A A . 7 DAS HA 1 1 2 205 1 1 7 . HB2 H 20.909 18.040 19.944 1.00 . A A . 7 DAS HB2 1 1 2 206 1 1 7 . HB3 H 21.130 18.567 21.549 1.00 . A A . 7 DAS HB3 1 1 2 207 1 1 7 . N N 18.726 19.792 19.586 1.00 . A A . 7 DAS N 1 1 2 208 1 1 7 . O O 17.284 18.070 21.611 1.00 . A A . 7 DAS O 1 1 2 209 1 1 7 . OD1 O 21.428 21.241 20.582 1.00 . A A . 7 DAS OD1 1 1 2 210 1 1 7 . OD2 O 22.732 19.792 19.698 1.00 . A A . 7 DAS OD2 1 1 3 211 1 1 1 GLN C C 17.329 15.095 20.281 1.00 . A A . 1 GLN C 1 1 3 212 1 1 1 GLN CA C 18.722 15.316 20.865 1.00 . A A . 1 GLN CA 1 1 3 213 1 1 1 GLN CB C 19.040 14.614 22.185 1.00 . A A . 1 GLN CB 1 1 3 214 1 1 1 GLN CD C 20.822 13.543 23.723 1.00 . A A . 1 GLN CD 1 1 3 215 1 1 1 GLN CG C 20.523 14.402 22.492 1.00 . A A . 1 GLN CG 1 1 3 216 1 1 1 GLN H1 H 19.891 16.846 20.056 1.00 . A A . 1 GLN H1 1 1 3 217 1 1 1 GLN HA H 19.453 14.806 20.234 1.00 . A A . 1 GLN HA 1 1 3 218 1 1 1 GLN HB2 H 18.466 15.121 22.950 1.00 . A A . 1 GLN HB2 1 1 3 219 1 1 1 GLN HB3 H 18.684 13.605 22.007 1.00 . A A . 1 GLN HB3 1 1 3 220 1 1 1 GLN HE21 H 22.686 12.847 23.032 1.00 . A A . 1 GLN HE21 1 1 3 221 1 1 1 GLN HE22 H 22.013 12.227 24.530 1.00 . A A . 1 GLN HE22 1 1 3 222 1 1 1 GLN HG2 H 21.063 13.857 21.718 1.00 . A A . 1 GLN HG2 1 1 3 223 1 1 1 GLN HG3 H 20.988 15.377 22.604 1.00 . A A . 1 GLN HG3 1 1 3 224 1 1 1 GLN N N 19.199 16.678 20.769 1.00 . A A . 1 GLN N 1 1 3 225 1 1 1 GLN NE2 N 21.965 12.863 23.740 1.00 . A A . 1 GLN NE2 1 1 3 226 1 1 1 GLN O O 16.638 14.151 20.627 1.00 . A A . 1 GLN O 1 1 3 227 1 1 1 GLN OE1 O 20.016 13.367 24.630 1.00 . A A . 1 GLN OE1 1 1 3 228 1 1 2 ASP C C 15.878 15.583 17.253 1.00 . A A . 2 ASP C 1 1 3 229 1 1 2 ASP CA C 15.595 15.807 18.735 1.00 . A A . 2 ASP CA 1 1 3 230 1 1 2 ASP CB C 14.732 17.015 19.096 1.00 . A A . 2 ASP CB 1 1 3 231 1 1 2 ASP CG C 13.290 16.782 18.689 1.00 . A A . 2 ASP CG 1 1 3 232 1 1 2 ASP H H 17.302 16.902 19.327 1.00 . A A . 2 ASP H 1 1 3 233 1 1 2 ASP HA H 15.090 14.900 19.040 1.00 . A A . 2 ASP HA 1 1 3 234 1 1 2 ASP HB2 H 14.837 17.228 20.161 1.00 . A A . 2 ASP HB2 1 1 3 235 1 1 2 ASP HB3 H 15.146 17.822 18.485 1.00 . A A . 2 ASP HB3 1 1 3 236 1 1 2 ASP N N 16.868 15.997 19.411 1.00 . A A . 2 ASP N 1 1 3 237 1 1 2 ASP O O 16.285 16.567 16.635 1.00 . A A . 2 ASP O 1 1 3 238 1 1 2 ASP OD1 O 12.431 17.680 18.793 1.00 . A A . 2 ASP OD1 1 1 3 239 1 1 2 ASP OD2 O 12.964 15.672 18.212 1.00 . A A . 2 ASP OD2 1 1 3 240 1 1 3 PRO C C 15.796 15.175 14.233 1.00 . A A . 3 PRO C 1 1 3 241 1 1 3 PRO CA C 16.145 14.126 15.280 1.00 . A A . 3 PRO CA 1 1 3 242 1 1 3 PRO CB C 15.520 12.760 15.007 1.00 . A A . 3 PRO CB 1 1 3 243 1 1 3 PRO CD C 15.201 13.210 17.242 1.00 . A A . 3 PRO CD 1 1 3 244 1 1 3 PRO CG C 15.474 12.010 16.339 1.00 . A A . 3 PRO CG 1 1 3 245 1 1 3 PRO HA H 17.229 13.973 15.301 1.00 . A A . 3 PRO HA 1 1 3 246 1 1 3 PRO HB2 H 14.473 12.885 14.715 1.00 . A A . 3 PRO HB2 1 1 3 247 1 1 3 PRO HB3 H 16.086 12.153 14.299 1.00 . A A . 3 PRO HB3 1 1 3 248 1 1 3 PRO HD2 H 14.135 13.354 17.402 1.00 . A A . 3 PRO HD2 1 1 3 249 1 1 3 PRO HD3 H 15.749 13.039 18.169 1.00 . A A . 3 PRO HD3 1 1 3 250 1 1 3 PRO HG2 H 14.641 11.332 16.502 1.00 . A A . 3 PRO HG2 1 1 3 251 1 1 3 PRO HG3 H 16.439 11.520 16.458 1.00 . A A . 3 PRO HG3 1 1 3 252 1 1 3 PRO N N 15.684 14.422 16.621 1.00 . A A . 3 PRO N 1 1 3 253 1 1 3 PRO O O 14.640 15.361 13.861 1.00 . A A . 3 PRO O 1 1 3 254 1 1 4 DPR C C 15.950 18.265 13.231 1.00 . A A . 4 DPR C 1 1 3 255 1 1 4 DPR CA C 16.554 16.962 12.712 1.00 . A A . 4 DPR CA 1 1 3 256 1 1 4 DPR CB C 17.859 17.174 11.946 1.00 . A A . 4 DPR CB 1 1 3 257 1 1 4 DPR CD C 18.187 15.631 13.777 1.00 . A A . 4 DPR CD 1 1 3 258 1 1 4 DPR CG C 18.877 16.747 12.998 1.00 . A A . 4 DPR CG 1 1 3 259 1 1 4 DPR HA H 15.786 16.657 12.000 1.00 . A A . 4 DPR HA 1 1 3 260 1 1 4 DPR HB2 H 18.072 18.202 11.664 1.00 . A A . 4 DPR HB2 1 1 3 261 1 1 4 DPR HB3 H 17.921 16.471 11.113 1.00 . A A . 4 DPR HB3 1 1 3 262 1 1 4 DPR HD2 H 18.486 15.614 14.828 1.00 . A A . 4 DPR HD2 1 1 3 263 1 1 4 DPR HD3 H 18.503 14.689 13.311 1.00 . A A . 4 DPR HD3 1 1 3 264 1 1 4 DPR HG2 H 19.008 17.604 13.652 1.00 . A A . 4 DPR HG2 1 1 3 265 1 1 4 DPR HG3 H 19.845 16.440 12.595 1.00 . A A . 4 DPR HG3 1 1 3 266 1 1 4 DPR N N 16.769 15.828 13.581 1.00 . A A . 4 DPR N 1 1 3 267 1 1 4 DPR O O 15.778 19.234 12.498 1.00 . A A . 4 DPR O 1 1 3 268 1 1 5 LYS C C 15.907 20.267 16.125 1.00 . A A . 5 LYS C 1 1 3 269 1 1 5 LYS CA C 15.060 19.413 15.187 1.00 . A A . 5 LYS CA 1 1 3 270 1 1 5 LYS CB C 13.798 18.890 15.859 1.00 . A A . 5 LYS CB 1 1 3 271 1 1 5 LYS CD C 11.474 18.116 15.549 1.00 . A A . 5 LYS CD 1 1 3 272 1 1 5 LYS CE C 10.405 17.851 14.486 1.00 . A A . 5 LYS CE 1 1 3 273 1 1 5 LYS CG C 12.760 18.490 14.816 1.00 . A A . 5 LYS CG 1 1 3 274 1 1 5 LYS H H 16.110 17.551 15.110 1.00 . A A . 5 LYS H 1 1 3 275 1 1 5 LYS HA H 14.700 20.106 14.442 1.00 . A A . 5 LYS HA 1 1 3 276 1 1 5 LYS HB2 H 14.130 18.050 16.471 1.00 . A A . 5 LYS HB2 1 1 3 277 1 1 5 LYS HB3 H 13.393 19.694 16.484 1.00 . A A . 5 LYS HB3 1 1 3 278 1 1 5 LYS HD2 H 11.691 17.174 16.049 1.00 . A A . 5 LYS HD2 1 1 3 279 1 1 5 LYS HD3 H 11.130 18.980 16.113 1.00 . A A . 5 LYS HD3 1 1 3 280 1 1 5 LYS HE2 H 10.173 18.816 14.040 1.00 . A A . 5 LYS HE2 1 1 3 281 1 1 5 LYS HE3 H 10.780 17.214 13.681 1.00 . A A . 5 LYS HE3 1 1 3 282 1 1 5 LYS HG2 H 12.504 19.354 14.216 1.00 . A A . 5 LYS HG2 1 1 3 283 1 1 5 LYS HG3 H 13.089 17.677 14.160 1.00 . A A . 5 LYS HG3 1 1 3 284 1 1 5 LYS HZ1 H 8.527 16.959 14.270 1.00 . A A . 5 LYS HZ1 1 1 3 285 1 1 5 LYS HZ2 H 8.702 17.919 15.582 1.00 . A A . 5 LYS HZ2 1 1 3 286 1 1 5 LYS HZ3 H 9.349 16.462 15.615 1.00 . A A . 5 LYS HZ3 1 1 3 287 1 1 5 LYS N N 15.786 18.331 14.556 1.00 . A A . 5 LYS N 1 1 3 288 1 1 5 LYS NZ N 9.172 17.241 14.997 1.00 . A A . 5 LYS NZ 1 1 3 289 1 1 5 LYS O O 15.506 21.389 16.429 1.00 . A A . 5 LYS O 1 1 3 290 1 1 6 DTH C C 18.282 19.377 18.656 1.00 . A A . 6 DTH C 1 1 3 291 1 1 6 DTH CA C 17.858 20.375 17.588 1.00 . A A . 6 DTH CA 1 1 3 292 1 1 6 DTH CB C 19.079 21.130 17.073 1.00 . A A . 6 DTH CB 1 1 3 293 1 1 6 DTH CG2 C 20.172 20.318 16.372 1.00 . A A . 6 DTH CG2 1 1 3 294 1 1 6 DTH H H 17.296 18.813 16.259 1.00 . A A . 6 DTH H 1 1 3 295 1 1 6 DTH HA H 17.276 21.162 18.068 1.00 . A A . 6 DTH HA 1 1 3 296 1 1 6 DTH HB H 19.619 21.681 17.848 1.00 . A A . 6 DTH HB 1 1 3 297 1 1 6 DTH HG1 H 18.586 22.918 16.635 1.00 . A A . 6 DTH HG1 1 1 3 298 1 1 6 DTH HG21 H 20.699 19.698 17.098 1.00 . A A . 6 DTH HG21 1 1 3 299 1 1 6 DTH HG22 H 20.901 20.998 15.931 1.00 . A A . 6 DTH HG22 1 1 3 300 1 1 6 DTH HG23 H 19.697 19.647 15.660 1.00 . A A . 6 DTH HG23 1 1 3 301 1 1 6 DTH N N 17.040 19.732 16.584 1.00 . A A . 6 DTH N 1 1 3 302 1 1 6 DTH O O 18.428 18.184 18.366 1.00 . A A . 6 DTH O 1 1 3 303 1 1 6 DTH OG1 O 18.674 22.101 16.135 1.00 . A A . 6 DTH OG1 1 1 3 304 1 1 7 . C C 18.625 17.733 21.364 1.00 . A A . 7 DAS C 1 1 3 305 1 1 7 . CA C 19.126 19.122 21.014 1.00 . A A . 7 DAS CA 1 1 3 306 1 1 7 . CB C 20.639 19.279 21.202 1.00 . A A . 7 DAS CB 1 1 3 307 1 1 7 . CG C 21.230 20.657 20.935 1.00 . A A . 7 DAS CG 1 1 3 308 1 1 7 . H H 18.581 20.844 19.922 1.00 . A A . 7 DAS H 1 1 3 309 1 1 7 . HA H 18.682 19.754 21.777 1.00 . A A . 7 DAS HA 1 1 3 310 1 1 7 . HB2 H 21.156 18.551 20.579 1.00 . A A . 7 DAS HB2 1 1 3 311 1 1 7 . HB3 H 20.796 19.052 22.253 1.00 . A A . 7 DAS HB3 1 1 3 312 1 1 7 . N N 18.572 19.830 19.882 1.00 . A A . 7 DAS N 1 1 3 313 1 1 7 . O O 17.772 17.630 22.248 1.00 . A A . 7 DAS O 1 1 3 314 1 1 7 . OD1 O 22.458 20.838 20.872 1.00 . A A . 7 DAS OD1 1 1 3 315 1 1 7 . OD2 O 20.465 21.624 20.749 1.00 . A A . 7 DAS OD2 1 1 4 316 1 1 1 GLN C C 17.056 15.224 20.553 1.00 . A A . 1 GLN C 1 1 4 317 1 1 1 GLN CA C 18.388 15.346 21.279 1.00 . A A . 1 GLN CA 1 1 4 318 1 1 1 GLN CB C 18.320 14.855 22.723 1.00 . A A . 1 GLN CB 1 1 4 319 1 1 1 GLN CD C 19.630 13.942 24.651 1.00 . A A . 1 GLN CD 1 1 4 320 1 1 1 GLN CG C 19.714 14.671 23.312 1.00 . A A . 1 GLN CG 1 1 4 321 1 1 1 GLN H1 H 20.005 16.430 20.513 1.00 . A A . 1 GLN H1 1 1 4 322 1 1 1 GLN HA H 18.990 14.582 20.775 1.00 . A A . 1 GLN HA 1 1 4 323 1 1 1 GLN HB2 H 17.786 15.530 23.378 1.00 . A A . 1 GLN HB2 1 1 4 324 1 1 1 GLN HB3 H 17.785 13.911 22.665 1.00 . A A . 1 GLN HB3 1 1 4 325 1 1 1 GLN HE21 H 21.662 13.615 24.608 1.00 . A A . 1 GLN HE21 1 1 4 326 1 1 1 GLN HE22 H 20.728 12.974 25.977 1.00 . A A . 1 GLN HE22 1 1 4 327 1 1 1 GLN HG2 H 20.379 14.094 22.676 1.00 . A A . 1 GLN HG2 1 1 4 328 1 1 1 GLN HG3 H 20.176 15.641 23.463 1.00 . A A . 1 GLN HG3 1 1 4 329 1 1 1 GLN N N 19.220 16.526 21.148 1.00 . A A . 1 GLN N 1 1 4 330 1 1 1 GLN NE2 N 20.800 13.508 25.124 1.00 . A A . 1 GLN NE2 1 1 4 331 1 1 1 GLN O O 16.274 14.309 20.829 1.00 . A A . 1 GLN O 1 1 4 332 1 1 1 GLN OE1 O 18.659 13.883 25.390 1.00 . A A . 1 GLN OE1 1 1 4 333 1 1 2 ASP C C 16.067 15.721 17.174 1.00 . A A . 2 ASP C 1 1 4 334 1 1 2 ASP CA C 15.643 15.846 18.626 1.00 . A A . 2 ASP CA 1 1 4 335 1 1 2 ASP CB C 14.678 16.996 18.916 1.00 . A A . 2 ASP CB 1 1 4 336 1 1 2 ASP CG C 13.226 16.711 18.564 1.00 . A A . 2 ASP CG 1 1 4 337 1 1 2 ASP H H 17.538 16.560 19.120 1.00 . A A . 2 ASP H 1 1 4 338 1 1 2 ASP HA H 15.046 14.994 18.949 1.00 . A A . 2 ASP HA 1 1 4 339 1 1 2 ASP HB2 H 14.688 17.276 19.975 1.00 . A A . 2 ASP HB2 1 1 4 340 1 1 2 ASP HB3 H 14.950 17.811 18.237 1.00 . A A . 2 ASP HB3 1 1 4 341 1 1 2 ASP N N 16.800 15.982 19.494 1.00 . A A . 2 ASP N 1 1 4 342 1 1 2 ASP O O 16.213 16.729 16.500 1.00 . A A . 2 ASP O 1 1 4 343 1 1 2 ASP OD1 O 12.315 17.433 19.016 1.00 . A A . 2 ASP OD1 1 1 4 344 1 1 2 ASP OD2 O 12.918 15.671 17.943 1.00 . A A . 2 ASP OD2 1 1 4 345 1 1 3 PRO C C 15.983 15.206 14.288 1.00 . A A . 3 PRO C 1 1 4 346 1 1 3 PRO CA C 16.651 14.290 15.304 1.00 . A A . 3 PRO CA 1 1 4 347 1 1 3 PRO CB C 16.591 12.782 15.039 1.00 . A A . 3 PRO CB 1 1 4 348 1 1 3 PRO CD C 16.062 13.239 17.374 1.00 . A A . 3 PRO CD 1 1 4 349 1 1 3 PRO CG C 16.450 12.119 16.409 1.00 . A A . 3 PRO CG 1 1 4 350 1 1 3 PRO HA H 17.734 14.432 15.272 1.00 . A A . 3 PRO HA 1 1 4 351 1 1 3 PRO HB2 H 15.727 12.577 14.414 1.00 . A A . 3 PRO HB2 1 1 4 352 1 1 3 PRO HB3 H 17.536 12.530 14.551 1.00 . A A . 3 PRO HB3 1 1 4 353 1 1 3 PRO HD2 H 15.007 13.172 17.652 1.00 . A A . 3 PRO HD2 1 1 4 354 1 1 3 PRO HD3 H 16.714 13.210 18.246 1.00 . A A . 3 PRO HD3 1 1 4 355 1 1 3 PRO HG2 H 15.757 11.288 16.490 1.00 . A A . 3 PRO HG2 1 1 4 356 1 1 3 PRO HG3 H 17.440 11.873 16.780 1.00 . A A . 3 PRO HG3 1 1 4 357 1 1 3 PRO N N 16.293 14.490 16.694 1.00 . A A . 3 PRO N 1 1 4 358 1 1 3 PRO O O 14.762 15.199 14.128 1.00 . A A . 3 PRO O 1 1 4 359 1 1 4 DPR C C 15.404 18.072 13.158 1.00 . A A . 4 DPR C 1 1 4 360 1 1 4 DPR CA C 16.276 16.964 12.581 1.00 . A A . 4 DPR CA 1 1 4 361 1 1 4 DPR CB C 17.522 17.479 11.865 1.00 . A A . 4 DPR CB 1 1 4 362 1 1 4 DPR CD C 18.190 16.214 13.687 1.00 . A A . 4 DPR CD 1 1 4 363 1 1 4 DPR CG C 18.565 17.513 12.973 1.00 . A A . 4 DPR CG 1 1 4 364 1 1 4 DPR HA H 15.589 16.482 11.887 1.00 . A A . 4 DPR HA 1 1 4 365 1 1 4 DPR HB2 H 17.290 18.498 11.556 1.00 . A A . 4 DPR HB2 1 1 4 366 1 1 4 DPR HB3 H 17.804 16.829 11.034 1.00 . A A . 4 DPR HB3 1 1 4 367 1 1 4 DPR HD2 H 18.557 16.321 14.706 1.00 . A A . 4 DPR HD2 1 1 4 368 1 1 4 DPR HD3 H 18.681 15.371 13.199 1.00 . A A . 4 DPR HD3 1 1 4 369 1 1 4 DPR HG2 H 18.461 18.420 13.576 1.00 . A A . 4 DPR HG2 1 1 4 370 1 1 4 DPR HG3 H 19.543 17.367 12.509 1.00 . A A . 4 DPR HG3 1 1 4 371 1 1 4 DPR N N 16.753 16.066 13.613 1.00 . A A . 4 DPR N 1 1 4 372 1 1 4 DPR O O 14.646 18.712 12.438 1.00 . A A . 4 DPR O 1 1 4 373 1 1 5 LYS C C 15.730 20.201 16.204 1.00 . A A . 5 LYS C 1 1 4 374 1 1 5 LYS CA C 14.889 19.536 15.118 1.00 . A A . 5 LYS CA 1 1 4 375 1 1 5 LYS CB C 13.616 19.014 15.757 1.00 . A A . 5 LYS CB 1 1 4 376 1 1 5 LYS CD C 11.069 18.639 15.401 1.00 . A A . 5 LYS CD 1 1 4 377 1 1 5 LYS CE C 10.112 18.125 14.325 1.00 . A A . 5 LYS CE 1 1 4 378 1 1 5 LYS CG C 12.467 18.717 14.798 1.00 . A A . 5 LYS CG 1 1 4 379 1 1 5 LYS H H 16.166 17.883 15.004 1.00 . A A . 5 LYS H 1 1 4 380 1 1 5 LYS HA H 14.563 20.286 14.394 1.00 . A A . 5 LYS HA 1 1 4 381 1 1 5 LYS HB2 H 13.780 18.099 16.340 1.00 . A A . 5 LYS HB2 1 1 4 382 1 1 5 LYS HB3 H 13.341 19.825 16.438 1.00 . A A . 5 LYS HB3 1 1 4 383 1 1 5 LYS HD2 H 11.166 17.839 16.145 1.00 . A A . 5 LYS HD2 1 1 4 384 1 1 5 LYS HD3 H 10.653 19.567 15.800 1.00 . A A . 5 LYS HD3 1 1 4 385 1 1 5 LYS HE2 H 10.082 18.879 13.545 1.00 . A A . 5 LYS HE2 1 1 4 386 1 1 5 LYS HE3 H 10.537 17.288 13.770 1.00 . A A . 5 LYS HE3 1 1 4 387 1 1 5 LYS HG2 H 12.444 19.540 14.086 1.00 . A A . 5 LYS HG2 1 1 4 388 1 1 5 LYS HG3 H 12.716 17.816 14.237 1.00 . A A . 5 LYS HG3 1 1 4 389 1 1 5 LYS HZ1 H 8.349 18.659 15.328 1.00 . A A . 5 LYS HZ1 1 1 4 390 1 1 5 LYS HZ2 H 8.697 17.079 15.428 1.00 . A A . 5 LYS HZ2 1 1 4 391 1 1 5 LYS HZ3 H 8.168 17.624 14.034 1.00 . A A . 5 LYS HZ3 1 1 4 392 1 1 5 LYS N N 15.514 18.421 14.450 1.00 . A A . 5 LYS N 1 1 4 393 1 1 5 LYS NZ N 8.748 17.884 14.823 1.00 . A A . 5 LYS NZ 1 1 4 394 1 1 5 LYS O O 15.418 21.330 16.574 1.00 . A A . 5 LYS O 1 1 4 395 1 1 6 DTH C C 18.266 19.179 18.685 1.00 . A A . 6 DTH C 1 1 4 396 1 1 6 DTH CA C 17.730 20.163 17.653 1.00 . A A . 6 DTH CA 1 1 4 397 1 1 6 DTH CB C 18.895 20.876 16.988 1.00 . A A . 6 DTH CB 1 1 4 398 1 1 6 DTH CG2 C 19.797 19.978 16.140 1.00 . A A . 6 DTH CG2 1 1 4 399 1 1 6 DTH H H 16.870 18.597 16.482 1.00 . A A . 6 DTH H 1 1 4 400 1 1 6 DTH HA H 17.089 20.808 18.258 1.00 . A A . 6 DTH HA 1 1 4 401 1 1 6 DTH HB H 19.477 21.438 17.726 1.00 . A A . 6 DTH HB 1 1 4 402 1 1 6 DTH HG1 H 18.196 22.721 16.652 1.00 . A A . 6 DTH HG1 1 1 4 403 1 1 6 DTH HG21 H 19.246 19.363 15.428 1.00 . A A . 6 DTH HG21 1 1 4 404 1 1 6 DTH HG22 H 20.333 19.260 16.763 1.00 . A A . 6 DTH HG22 1 1 4 405 1 1 6 DTH HG23 H 20.627 20.529 15.686 1.00 . A A . 6 DTH HG23 1 1 4 406 1 1 6 DTH N N 16.798 19.585 16.706 1.00 . A A . 6 DTH N 1 1 4 407 1 1 6 DTH O O 18.349 18.000 18.312 1.00 . A A . 6 DTH O 1 1 4 408 1 1 6 DTH OG1 O 18.352 21.898 16.184 1.00 . A A . 6 DTH OG1 1 1 4 409 1 1 7 . C C 18.784 17.758 21.407 1.00 . A A . 7 DAS C 1 1 4 410 1 1 7 . CA C 19.483 18.975 20.820 1.00 . A A . 7 DAS CA 1 1 4 411 1 1 7 . CB C 20.962 18.773 20.475 1.00 . A A . 7 DAS CB 1 1 4 412 1 1 7 . CG C 21.682 20.027 19.991 1.00 . A A . 7 DAS CG 1 1 4 413 1 1 7 . H H 18.591 20.693 19.958 1.00 . A A . 7 DAS H 1 1 4 414 1 1 7 . HA H 19.408 19.586 21.715 1.00 . A A . 7 DAS HA 1 1 4 415 1 1 7 . HB2 H 21.002 17.983 19.721 1.00 . A A . 7 DAS HB2 1 1 4 416 1 1 7 . HB3 H 21.383 18.383 21.395 1.00 . A A . 7 DAS HB3 1 1 4 417 1 1 7 . N N 18.744 19.706 19.807 1.00 . A A . 7 DAS N 1 1 4 418 1 1 7 . O O 17.775 17.924 22.100 1.00 . A A . 7 DAS O 1 1 4 419 1 1 7 . OD1 O 21.841 21.019 20.726 1.00 . A A . 7 DAS OD1 1 1 4 420 1 1 7 . OD2 O 21.996 20.141 18.796 1.00 . A A . 7 DAS OD2 1 1 5 421 1 1 1 GLN C C 17.248 15.057 20.601 1.00 . A A . 1 GLN C 1 1 5 422 1 1 1 GLN CA C 18.660 15.253 21.129 1.00 . A A . 1 GLN CA 1 1 5 423 1 1 1 GLN CB C 18.784 14.781 22.564 1.00 . A A . 1 GLN CB 1 1 5 424 1 1 1 GLN CD C 20.439 14.241 24.428 1.00 . A A . 1 GLN CD 1 1 5 425 1 1 1 GLN CG C 20.184 14.990 23.132 1.00 . A A . 1 GLN CG 1 1 5 426 1 1 1 GLN H1 H 19.897 16.644 20.217 1.00 . A A . 1 GLN H1 1 1 5 427 1 1 1 GLN HA H 19.222 14.579 20.478 1.00 . A A . 1 GLN HA 1 1 5 428 1 1 1 GLN HB2 H 18.024 15.322 23.125 1.00 . A A . 1 GLN HB2 1 1 5 429 1 1 1 GLN HB3 H 18.650 13.697 22.573 1.00 . A A . 1 GLN HB3 1 1 5 430 1 1 1 GLN HE21 H 22.044 15.399 24.976 1.00 . A A . 1 GLN HE21 1 1 5 431 1 1 1 GLN HE22 H 21.632 14.126 26.086 1.00 . A A . 1 GLN HE22 1 1 5 432 1 1 1 GLN HG2 H 20.952 14.654 22.434 1.00 . A A . 1 GLN HG2 1 1 5 433 1 1 1 GLN HG3 H 20.362 16.053 23.300 1.00 . A A . 1 GLN HG3 1 1 5 434 1 1 1 GLN N N 19.112 16.608 20.854 1.00 . A A . 1 GLN N 1 1 5 435 1 1 1 GLN NE2 N 21.428 14.645 25.239 1.00 . A A . 1 GLN NE2 1 1 5 436 1 1 1 GLN O O 16.493 14.184 21.023 1.00 . A A . 1 GLN O 1 1 5 437 1 1 1 GLN OE1 O 19.709 13.305 24.734 1.00 . A A . 1 GLN OE1 1 1 5 438 1 1 2 ASP C C 16.001 15.776 17.315 1.00 . A A . 2 ASP C 1 1 5 439 1 1 2 ASP CA C 15.641 15.719 18.794 1.00 . A A . 2 ASP CA 1 1 5 440 1 1 2 ASP CB C 14.815 16.914 19.272 1.00 . A A . 2 ASP CB 1 1 5 441 1 1 2 ASP CG C 13.367 16.906 18.788 1.00 . A A . 2 ASP CG 1 1 5 442 1 1 2 ASP H H 17.642 16.278 19.055 1.00 . A A . 2 ASP H 1 1 5 443 1 1 2 ASP HA H 15.085 14.832 19.072 1.00 . A A . 2 ASP HA 1 1 5 444 1 1 2 ASP HB2 H 14.907 17.043 20.351 1.00 . A A . 2 ASP HB2 1 1 5 445 1 1 2 ASP HB3 H 15.324 17.811 18.938 1.00 . A A . 2 ASP HB3 1 1 5 446 1 1 2 ASP N N 16.919 15.725 19.494 1.00 . A A . 2 ASP N 1 1 5 447 1 1 2 ASP O O 16.361 16.826 16.787 1.00 . A A . 2 ASP O 1 1 5 448 1 1 2 ASP OD1 O 12.573 17.802 19.135 1.00 . A A . 2 ASP OD1 1 1 5 449 1 1 2 ASP OD2 O 12.938 15.980 18.064 1.00 . A A . 2 ASP OD2 1 1 5 450 1 1 3 PRO C C 15.934 15.376 14.323 1.00 . A A . 3 PRO C 1 1 5 451 1 1 3 PRO CA C 16.372 14.343 15.347 1.00 . A A . 3 PRO CA 1 1 5 452 1 1 3 PRO CB C 15.800 12.980 14.972 1.00 . A A . 3 PRO CB 1 1 5 453 1 1 3 PRO CD C 15.669 13.295 17.319 1.00 . A A . 3 PRO CD 1 1 5 454 1 1 3 PRO CG C 15.858 12.197 16.285 1.00 . A A . 3 PRO CG 1 1 5 455 1 1 3 PRO HA H 17.451 14.203 15.375 1.00 . A A . 3 PRO HA 1 1 5 456 1 1 3 PRO HB2 H 14.746 13.129 14.726 1.00 . A A . 3 PRO HB2 1 1 5 457 1 1 3 PRO HB3 H 16.280 12.548 14.095 1.00 . A A . 3 PRO HB3 1 1 5 458 1 1 3 PRO HD2 H 14.635 13.278 17.672 1.00 . A A . 3 PRO HD2 1 1 5 459 1 1 3 PRO HD3 H 16.348 13.196 18.162 1.00 . A A . 3 PRO HD3 1 1 5 460 1 1 3 PRO HG2 H 15.209 11.329 16.376 1.00 . A A . 3 PRO HG2 1 1 5 461 1 1 3 PRO HG3 H 16.869 11.805 16.264 1.00 . A A . 3 PRO HG3 1 1 5 462 1 1 3 PRO N N 15.910 14.592 16.703 1.00 . A A . 3 PRO N 1 1 5 463 1 1 3 PRO O O 14.743 15.660 14.260 1.00 . A A . 3 PRO O 1 1 5 464 1 1 4 DPR C C 15.707 18.327 13.054 1.00 . A A . 4 DPR C 1 1 5 465 1 1 4 DPR CA C 16.373 17.050 12.550 1.00 . A A . 4 DPR CA 1 1 5 466 1 1 4 DPR CB C 17.605 17.332 11.697 1.00 . A A . 4 DPR CB 1 1 5 467 1 1 4 DPR CD C 18.102 15.579 13.184 1.00 . A A . 4 DPR CD 1 1 5 468 1 1 4 DPR CG C 18.418 16.050 11.764 1.00 . A A . 4 DPR CG 1 1 5 469 1 1 4 DPR HA H 15.620 16.559 11.923 1.00 . A A . 4 DPR HA 1 1 5 470 1 1 4 DPR HB2 H 18.105 18.220 12.079 1.00 . A A . 4 DPR HB2 1 1 5 471 1 1 4 DPR HB3 H 17.320 17.472 10.652 1.00 . A A . 4 DPR HB3 1 1 5 472 1 1 4 DPR HD2 H 18.857 16.080 13.789 1.00 . A A . 4 DPR HD2 1 1 5 473 1 1 4 DPR HD3 H 18.247 14.493 13.245 1.00 . A A . 4 DPR HD3 1 1 5 474 1 1 4 DPR HG2 H 19.457 16.307 11.596 1.00 . A A . 4 DPR HG2 1 1 5 475 1 1 4 DPR HG3 H 18.081 15.321 11.019 1.00 . A A . 4 DPR HG3 1 1 5 476 1 1 4 DPR N N 16.754 16.009 13.477 1.00 . A A . 4 DPR N 1 1 5 477 1 1 4 DPR O O 15.082 19.045 12.279 1.00 . A A . 4 DPR O 1 1 5 478 1 1 5 LYS C C 15.801 20.216 16.155 1.00 . A A . 5 LYS C 1 1 5 479 1 1 5 LYS CA C 14.961 19.503 15.106 1.00 . A A . 5 LYS CA 1 1 5 480 1 1 5 LYS CB C 13.702 18.964 15.782 1.00 . A A . 5 LYS CB 1 1 5 481 1 1 5 LYS CD C 11.330 18.138 15.569 1.00 . A A . 5 LYS CD 1 1 5 482 1 1 5 LYS CE C 10.257 17.640 14.610 1.00 . A A . 5 LYS CE 1 1 5 483 1 1 5 LYS CG C 12.575 18.609 14.817 1.00 . A A . 5 LYS CG 1 1 5 484 1 1 5 LYS H H 16.314 17.880 14.903 1.00 . A A . 5 LYS H 1 1 5 485 1 1 5 LYS HA H 14.641 20.265 14.399 1.00 . A A . 5 LYS HA 1 1 5 486 1 1 5 LYS HB2 H 14.034 18.190 16.471 1.00 . A A . 5 LYS HB2 1 1 5 487 1 1 5 LYS HB3 H 13.330 19.808 16.367 1.00 . A A . 5 LYS HB3 1 1 5 488 1 1 5 LYS HD2 H 11.629 17.369 16.284 1.00 . A A . 5 LYS HD2 1 1 5 489 1 1 5 LYS HD3 H 10.880 18.956 16.142 1.00 . A A . 5 LYS HD3 1 1 5 490 1 1 5 LYS HE2 H 9.910 18.507 14.068 1.00 . A A . 5 LYS HE2 1 1 5 491 1 1 5 LYS HE3 H 10.737 16.951 13.906 1.00 . A A . 5 LYS HE3 1 1 5 492 1 1 5 LYS HG2 H 12.290 19.385 14.107 1.00 . A A . 5 LYS HG2 1 1 5 493 1 1 5 LYS HG3 H 12.907 17.784 14.185 1.00 . A A . 5 LYS HG3 1 1 5 494 1 1 5 LYS HZ1 H 8.521 17.703 15.685 1.00 . A A . 5 LYS HZ1 1 1 5 495 1 1 5 LYS HZ2 H 9.576 16.663 16.284 1.00 . A A . 5 LYS HZ2 1 1 5 496 1 1 5 LYS HZ3 H 8.705 16.277 14.918 1.00 . A A . 5 LYS HZ3 1 1 5 497 1 1 5 LYS N N 15.695 18.492 14.379 1.00 . A A . 5 LYS N 1 1 5 498 1 1 5 LYS NZ N 9.194 17.002 15.410 1.00 . A A . 5 LYS NZ 1 1 5 499 1 1 5 LYS O O 15.598 21.399 16.392 1.00 . A A . 5 LYS O 1 1 5 500 1 1 6 DTH C C 18.461 19.155 18.547 1.00 . A A . 6 DTH C 1 1 5 501 1 1 6 DTH CA C 17.950 20.100 17.470 1.00 . A A . 6 DTH CA 1 1 5 502 1 1 6 DTH CB C 19.197 20.531 16.713 1.00 . A A . 6 DTH CB 1 1 5 503 1 1 6 DTH CG2 C 19.862 19.422 15.897 1.00 . A A . 6 DTH CG2 1 1 5 504 1 1 6 DTH H H 16.756 18.587 16.521 1.00 . A A . 6 DTH H 1 1 5 505 1 1 6 DTH HA H 17.579 20.986 17.993 1.00 . A A . 6 DTH HA 1 1 5 506 1 1 6 DTH HB H 19.941 21.044 17.313 1.00 . A A . 6 DTH HB 1 1 5 507 1 1 6 DTH HG1 H 18.070 21.049 15.186 1.00 . A A . 6 DTH HG1 1 1 5 508 1 1 6 DTH HG21 H 20.589 19.987 15.315 1.00 . A A . 6 DTH HG21 1 1 5 509 1 1 6 DTH HG22 H 19.124 18.959 15.244 1.00 . A A . 6 DTH HG22 1 1 5 510 1 1 6 DTH HG23 H 20.373 18.696 16.546 1.00 . A A . 6 DTH HG23 1 1 5 511 1 1 6 DTH N N 16.826 19.568 16.728 1.00 . A A . 6 DTH N 1 1 5 512 1 1 6 DTH O O 18.645 17.964 18.296 1.00 . A A . 6 DTH O 1 1 5 513 1 1 6 DTH OG1 O 18.854 21.374 15.630 1.00 . A A . 6 DTH OG1 1 1 5 514 1 1 7 . C C 18.593 17.756 21.292 1.00 . A A . 7 DAS C 1 1 5 515 1 1 7 . CA C 19.104 19.151 20.983 1.00 . A A . 7 DAS CA 1 1 5 516 1 1 7 . CB C 20.583 19.205 21.348 1.00 . A A . 7 DAS CB 1 1 5 517 1 1 7 . CG C 21.364 20.381 20.791 1.00 . A A . 7 DAS CG 1 1 5 518 1 1 7 . H H 18.596 20.739 19.759 1.00 . A A . 7 DAS H 1 1 5 519 1 1 7 . HA H 18.581 19.838 21.641 1.00 . A A . 7 DAS HA 1 1 5 520 1 1 7 . HB2 H 21.032 18.240 21.102 1.00 . A A . 7 DAS HB2 1 1 5 521 1 1 7 . HB3 H 20.592 19.258 22.446 1.00 . A A . 7 DAS HB3 1 1 5 522 1 1 7 . N N 18.708 19.742 19.712 1.00 . A A . 7 DAS N 1 1 5 523 1 1 7 . O O 17.614 17.703 22.023 1.00 . A A . 7 DAS O 1 1 5 524 1 1 7 . OD1 O 21.372 21.448 21.439 1.00 . A A . 7 DAS OD1 1 1 5 525 1 1 7 . OD2 O 21.822 20.211 19.641 1.00 . A A . 7 DAS OD2 1 1 6 526 1 1 1 GLN C C 17.240 15.150 20.560 1.00 . A A . 1 GLN C 1 1 6 527 1 1 1 GLN CA C 18.699 15.302 20.963 1.00 . A A . 1 GLN CA 1 1 6 528 1 1 1 GLN CB C 18.891 14.876 22.422 1.00 . A A . 1 GLN CB 1 1 6 529 1 1 1 GLN CD C 20.943 16.133 23.209 1.00 . A A . 1 GLN CD 1 1 6 530 1 1 1 GLN CG C 20.344 14.782 22.859 1.00 . A A . 1 GLN CG 1 1 6 531 1 1 1 GLN H1 H 19.948 16.747 20.111 1.00 . A A . 1 GLN H1 1 1 6 532 1 1 1 GLN HA H 19.326 14.637 20.384 1.00 . A A . 1 GLN HA 1 1 6 533 1 1 1 GLN HB2 H 18.329 15.479 23.145 1.00 . A A . 1 GLN HB2 1 1 6 534 1 1 1 GLN HB3 H 18.480 13.880 22.615 1.00 . A A . 1 GLN HB3 1 1 6 535 1 1 1 GLN HE21 H 19.745 16.533 24.840 1.00 . A A . 1 GLN HE21 1 1 6 536 1 1 1 GLN HE22 H 20.765 17.798 24.407 1.00 . A A . 1 GLN HE22 1 1 6 537 1 1 1 GLN HG2 H 20.264 14.285 23.828 1.00 . A A . 1 GLN HG2 1 1 6 538 1 1 1 GLN HG3 H 20.951 14.131 22.236 1.00 . A A . 1 GLN HG3 1 1 6 539 1 1 1 GLN N N 19.209 16.645 20.798 1.00 . A A . 1 GLN N 1 1 6 540 1 1 1 GLN NE2 N 20.380 16.899 24.148 1.00 . A A . 1 GLN NE2 1 1 6 541 1 1 1 GLN O O 16.545 14.256 21.036 1.00 . A A . 1 GLN O 1 1 6 542 1 1 1 GLN OE1 O 21.971 16.429 22.595 1.00 . A A . 1 GLN OE1 1 1 6 543 1 1 2 ASP C C 15.795 15.724 17.315 1.00 . A A . 2 ASP C 1 1 6 544 1 1 2 ASP CA C 15.592 15.717 18.825 1.00 . A A . 2 ASP CA 1 1 6 545 1 1 2 ASP CB C 14.694 16.876 19.257 1.00 . A A . 2 ASP CB 1 1 6 546 1 1 2 ASP CG C 13.298 16.846 18.642 1.00 . A A . 2 ASP CG 1 1 6 547 1 1 2 ASP H H 17.567 16.428 19.048 1.00 . A A . 2 ASP H 1 1 6 548 1 1 2 ASP HA H 15.191 14.768 19.175 1.00 . A A . 2 ASP HA 1 1 6 549 1 1 2 ASP HB2 H 14.681 16.940 20.343 1.00 . A A . 2 ASP HB2 1 1 6 550 1 1 2 ASP HB3 H 15.082 17.763 18.767 1.00 . A A . 2 ASP HB3 1 1 6 551 1 1 2 ASP N N 16.854 15.883 19.509 1.00 . A A . 2 ASP N 1 1 6 552 1 1 2 ASP O O 16.177 16.739 16.726 1.00 . A A . 2 ASP O 1 1 6 553 1 1 2 ASP OD1 O 12.670 17.920 18.771 1.00 . A A . 2 ASP OD1 1 1 6 554 1 1 2 ASP OD2 O 12.814 15.926 17.955 1.00 . A A . 2 ASP OD2 1 1 6 555 1 1 3 PRO C C 15.866 15.277 14.191 1.00 . A A . 3 PRO C 1 1 6 556 1 1 3 PRO CA C 16.103 14.291 15.317 1.00 . A A . 3 PRO CA 1 1 6 557 1 1 3 PRO CB C 15.502 12.946 14.936 1.00 . A A . 3 PRO CB 1 1 6 558 1 1 3 PRO CD C 15.357 13.294 17.246 1.00 . A A . 3 PRO CD 1 1 6 559 1 1 3 PRO CG C 15.688 12.187 16.252 1.00 . A A . 3 PRO CG 1 1 6 560 1 1 3 PRO HA H 17.158 14.061 15.489 1.00 . A A . 3 PRO HA 1 1 6 561 1 1 3 PRO HB2 H 14.444 13.019 14.679 1.00 . A A . 3 PRO HB2 1 1 6 562 1 1 3 PRO HB3 H 16.059 12.485 14.119 1.00 . A A . 3 PRO HB3 1 1 6 563 1 1 3 PRO HD2 H 14.313 13.175 17.559 1.00 . A A . 3 PRO HD2 1 1 6 564 1 1 3 PRO HD3 H 15.891 13.084 18.167 1.00 . A A . 3 PRO HD3 1 1 6 565 1 1 3 PRO HG2 H 14.945 11.406 16.372 1.00 . A A . 3 PRO HG2 1 1 6 566 1 1 3 PRO HG3 H 16.727 11.850 16.299 1.00 . A A . 3 PRO HG3 1 1 6 567 1 1 3 PRO N N 15.613 14.583 16.652 1.00 . A A . 3 PRO N 1 1 6 568 1 1 3 PRO O O 14.715 15.368 13.776 1.00 . A A . 3 PRO O 1 1 6 569 1 1 4 DPR C C 16.006 18.238 13.259 1.00 . A A . 4 DPR C 1 1 6 570 1 1 4 DPR CA C 16.686 17.014 12.666 1.00 . A A . 4 DPR CA 1 1 6 571 1 1 4 DPR CB C 18.079 17.232 12.067 1.00 . A A . 4 DPR CB 1 1 6 572 1 1 4 DPR CD C 18.280 15.935 13.984 1.00 . A A . 4 DPR CD 1 1 6 573 1 1 4 DPR CG C 19.089 16.935 13.170 1.00 . A A . 4 DPR CG 1 1 6 574 1 1 4 DPR HA H 16.012 16.623 11.907 1.00 . A A . 4 DPR HA 1 1 6 575 1 1 4 DPR HB2 H 18.251 18.251 11.714 1.00 . A A . 4 DPR HB2 1 1 6 576 1 1 4 DPR HB3 H 18.301 16.564 11.242 1.00 . A A . 4 DPR HB3 1 1 6 577 1 1 4 DPR HD2 H 18.512 16.037 15.049 1.00 . A A . 4 DPR HD2 1 1 6 578 1 1 4 DPR HD3 H 18.679 14.941 13.755 1.00 . A A . 4 DPR HD3 1 1 6 579 1 1 4 DPR HG2 H 19.194 17.813 13.801 1.00 . A A . 4 DPR HG2 1 1 6 580 1 1 4 DPR HG3 H 20.054 16.590 12.824 1.00 . A A . 4 DPR HG3 1 1 6 581 1 1 4 DPR N N 16.878 15.945 13.618 1.00 . A A . 4 DPR N 1 1 6 582 1 1 4 DPR O O 15.813 19.246 12.576 1.00 . A A . 4 DPR O 1 1 6 583 1 1 5 LYS C C 15.817 20.316 16.014 1.00 . A A . 5 LYS C 1 1 6 584 1 1 5 LYS CA C 14.981 19.400 15.137 1.00 . A A . 5 LYS CA 1 1 6 585 1 1 5 LYS CB C 13.721 18.874 15.816 1.00 . A A . 5 LYS CB 1 1 6 586 1 1 5 LYS CD C 12.120 18.896 13.857 1.00 . A A . 5 LYS CD 1 1 6 587 1 1 5 LYS CE C 11.315 17.923 13.013 1.00 . A A . 5 LYS CE 1 1 6 588 1 1 5 LYS CG C 12.816 18.043 14.908 1.00 . A A . 5 LYS CG 1 1 6 589 1 1 5 LYS H H 15.830 17.458 15.119 1.00 . A A . 5 LYS H 1 1 6 590 1 1 5 LYS HA H 14.633 20.060 14.338 1.00 . A A . 5 LYS HA 1 1 6 591 1 1 5 LYS HB2 H 13.918 18.202 16.655 1.00 . A A . 5 LYS HB2 1 1 6 592 1 1 5 LYS HB3 H 13.189 19.702 16.294 1.00 . A A . 5 LYS HB3 1 1 6 593 1 1 5 LYS HD2 H 11.489 19.620 14.372 1.00 . A A . 5 LYS HD2 1 1 6 594 1 1 5 LYS HD3 H 12.841 19.476 13.273 1.00 . A A . 5 LYS HD3 1 1 6 595 1 1 5 LYS HE2 H 12.053 17.307 12.504 1.00 . A A . 5 LYS HE2 1 1 6 596 1 1 5 LYS HE3 H 10.674 17.319 13.665 1.00 . A A . 5 LYS HE3 1 1 6 597 1 1 5 LYS HG2 H 13.365 17.223 14.463 1.00 . A A . 5 LYS HG2 1 1 6 598 1 1 5 LYS HG3 H 12.052 17.616 15.565 1.00 . A A . 5 LYS HG3 1 1 6 599 1 1 5 LYS HZ1 H 9.724 19.009 12.566 1.00 . A A . 5 LYS HZ1 1 1 6 600 1 1 5 LYS HZ2 H 9.943 17.916 11.394 1.00 . A A . 5 LYS HZ2 1 1 6 601 1 1 5 LYS HZ3 H 10.890 19.259 11.454 1.00 . A A . 5 LYS HZ3 1 1 6 602 1 1 5 LYS N N 15.700 18.284 14.550 1.00 . A A . 5 LYS N 1 1 6 603 1 1 5 LYS NZ N 10.427 18.547 12.014 1.00 . A A . 5 LYS NZ 1 1 6 604 1 1 5 LYS O O 15.685 21.535 15.995 1.00 . A A . 5 LYS O 1 1 6 605 1 1 6 DTH C C 18.220 19.299 18.618 1.00 . A A . 6 DTH C 1 1 6 606 1 1 6 DTH CA C 17.767 20.299 17.563 1.00 . A A . 6 DTH CA 1 1 6 607 1 1 6 DTH CB C 18.991 20.984 16.958 1.00 . A A . 6 DTH CB 1 1 6 608 1 1 6 DTH CG2 C 19.876 20.056 16.134 1.00 . A A . 6 DTH CG2 1 1 6 609 1 1 6 DTH H H 17.065 18.735 16.457 1.00 . A A . 6 DTH H 1 1 6 610 1 1 6 DTH HA H 17.313 21.118 18.127 1.00 . A A . 6 DTH HA 1 1 6 611 1 1 6 DTH HB H 19.623 21.373 17.752 1.00 . A A . 6 DTH HB 1 1 6 612 1 1 6 DTH HG1 H 18.274 21.948 15.416 1.00 . A A . 6 DTH HG1 1 1 6 613 1 1 6 DTH HG21 H 20.155 19.244 16.803 1.00 . A A . 6 DTH HG21 1 1 6 614 1 1 6 DTH HG22 H 20.754 20.647 15.874 1.00 . A A . 6 DTH HG22 1 1 6 615 1 1 6 DTH HG23 H 19.359 19.811 15.202 1.00 . A A . 6 DTH HG23 1 1 6 616 1 1 6 DTH N N 16.839 19.702 16.623 1.00 . A A . 6 DTH N 1 1 6 617 1 1 6 DTH O O 18.347 18.098 18.396 1.00 . A A . 6 DTH O 1 1 6 618 1 1 6 DTH OG1 O 18.676 22.170 16.257 1.00 . A A . 6 DTH OG1 1 1 6 619 1 1 7 . C C 18.604 17.753 21.223 1.00 . A A . 7 DAS C 1 1 6 620 1 1 7 . CA C 19.232 19.097 20.909 1.00 . A A . 7 DAS CA 1 1 6 621 1 1 7 . CB C 20.743 19.084 20.704 1.00 . A A . 7 DAS CB 1 1 6 622 1 1 7 . CG C 21.329 20.417 20.249 1.00 . A A . 7 DAS CG 1 1 6 623 1 1 7 . H H 18.468 20.765 19.985 1.00 . A A . 7 DAS H 1 1 6 624 1 1 7 . HA H 18.991 19.791 21.717 1.00 . A A . 7 DAS HA 1 1 6 625 1 1 7 . HB2 H 21.020 18.341 19.965 1.00 . A A . 7 DAS HB2 1 1 6 626 1 1 7 . HB3 H 21.277 18.770 21.599 1.00 . A A . 7 DAS HB3 1 1 6 627 1 1 7 . N N 18.553 19.779 19.818 1.00 . A A . 7 DAS N 1 1 6 628 1 1 7 . O O 17.703 17.717 22.058 1.00 . A A . 7 DAS O 1 1 6 629 1 1 7 . OD1 O 20.845 21.513 20.610 1.00 . A A . 7 DAS OD1 1 1 6 630 1 1 7 . OD2 O 22.417 20.330 19.644 1.00 . A A . 7 DAS OD2 1 1 7 631 1 1 1 GLN C C 17.213 14.991 20.596 1.00 . A A . 1 GLN C 1 1 7 632 1 1 1 GLN CA C 18.458 15.298 21.424 1.00 . A A . 1 GLN CA 1 1 7 633 1 1 1 GLN CB C 18.244 15.087 22.918 1.00 . A A . 1 GLN CB 1 1 7 634 1 1 1 GLN CD C 20.550 16.045 23.546 1.00 . A A . 1 GLN CD 1 1 7 635 1 1 1 GLN CG C 19.523 14.946 23.740 1.00 . A A . 1 GLN CG 1 1 7 636 1 1 1 GLN H1 H 20.091 16.500 21.103 1.00 . A A . 1 GLN H1 1 1 7 637 1 1 1 GLN HA H 19.211 14.585 21.070 1.00 . A A . 1 GLN HA 1 1 7 638 1 1 1 GLN HB2 H 17.662 15.967 23.174 1.00 . A A . 1 GLN HB2 1 1 7 639 1 1 1 GLN HB3 H 17.635 14.198 23.063 1.00 . A A . 1 GLN HB3 1 1 7 640 1 1 1 GLN HE21 H 19.853 16.907 25.217 1.00 . A A . 1 GLN HE21 1 1 7 641 1 1 1 GLN HE22 H 21.004 17.875 24.357 1.00 . A A . 1 GLN HE22 1 1 7 642 1 1 1 GLN HG2 H 19.248 14.833 24.794 1.00 . A A . 1 GLN HG2 1 1 7 643 1 1 1 GLN HG3 H 19.936 13.971 23.472 1.00 . A A . 1 GLN HG3 1 1 7 644 1 1 1 GLN N N 19.084 16.573 21.118 1.00 . A A . 1 GLN N 1 1 7 645 1 1 1 GLN NE2 N 20.369 17.084 24.365 1.00 . A A . 1 GLN NE2 1 1 7 646 1 1 1 GLN O O 16.341 14.191 20.941 1.00 . A A . 1 GLN O 1 1 7 647 1 1 1 GLN OE1 O 21.472 16.044 22.726 1.00 . A A . 1 GLN OE1 1 1 7 648 1 1 2 ASP C C 15.998 15.620 17.236 1.00 . A A . 2 ASP C 1 1 7 649 1 1 2 ASP CA C 15.743 15.658 18.731 1.00 . A A . 2 ASP CA 1 1 7 650 1 1 2 ASP CB C 14.832 16.807 19.129 1.00 . A A . 2 ASP CB 1 1 7 651 1 1 2 ASP CG C 13.346 16.538 18.997 1.00 . A A . 2 ASP CG 1 1 7 652 1 1 2 ASP H H 17.705 16.341 19.223 1.00 . A A . 2 ASP H 1 1 7 653 1 1 2 ASP HA H 15.239 14.722 18.985 1.00 . A A . 2 ASP HA 1 1 7 654 1 1 2 ASP HB2 H 14.905 17.043 20.195 1.00 . A A . 2 ASP HB2 1 1 7 655 1 1 2 ASP HB3 H 15.093 17.777 18.683 1.00 . A A . 2 ASP HB3 1 1 7 656 1 1 2 ASP N N 16.968 15.718 19.508 1.00 . A A . 2 ASP N 1 1 7 657 1 1 2 ASP O O 16.345 16.668 16.681 1.00 . A A . 2 ASP O 1 1 7 658 1 1 2 ASP OD1 O 12.549 17.353 19.519 1.00 . A A . 2 ASP OD1 1 1 7 659 1 1 2 ASP OD2 O 12.934 15.487 18.465 1.00 . A A . 2 ASP OD2 1 1 7 660 1 1 3 PRO C C 15.888 15.342 14.239 1.00 . A A . 3 PRO C 1 1 7 661 1 1 3 PRO CA C 16.488 14.329 15.218 1.00 . A A . 3 PRO CA 1 1 7 662 1 1 3 PRO CB C 16.340 12.886 14.753 1.00 . A A . 3 PRO CB 1 1 7 663 1 1 3 PRO CD C 15.771 13.102 17.033 1.00 . A A . 3 PRO CD 1 1 7 664 1 1 3 PRO CG C 16.506 12.163 16.084 1.00 . A A . 3 PRO CG 1 1 7 665 1 1 3 PRO HA H 17.521 14.579 15.445 1.00 . A A . 3 PRO HA 1 1 7 666 1 1 3 PRO HB2 H 15.322 12.669 14.424 1.00 . A A . 3 PRO HB2 1 1 7 667 1 1 3 PRO HB3 H 17.106 12.643 14.013 1.00 . A A . 3 PRO HB3 1 1 7 668 1 1 3 PRO HD2 H 14.730 12.785 16.972 1.00 . A A . 3 PRO HD2 1 1 7 669 1 1 3 PRO HD3 H 16.101 13.048 18.067 1.00 . A A . 3 PRO HD3 1 1 7 670 1 1 3 PRO HG2 H 16.022 11.197 16.150 1.00 . A A . 3 PRO HG2 1 1 7 671 1 1 3 PRO HG3 H 17.525 12.081 16.472 1.00 . A A . 3 PRO HG3 1 1 7 672 1 1 3 PRO N N 15.956 14.464 16.560 1.00 . A A . 3 PRO N 1 1 7 673 1 1 3 PRO O O 14.684 15.567 14.237 1.00 . A A . 3 PRO O 1 1 7 674 1 1 4 DPR C C 15.572 18.213 13.163 1.00 . A A . 4 DPR C 1 1 7 675 1 1 4 DPR CA C 16.234 17.002 12.505 1.00 . A A . 4 DPR CA 1 1 7 676 1 1 4 DPR CB C 17.392 17.323 11.575 1.00 . A A . 4 DPR CB 1 1 7 677 1 1 4 DPR CD C 18.091 15.667 13.095 1.00 . A A . 4 DPR CD 1 1 7 678 1 1 4 DPR CG C 18.400 16.179 11.687 1.00 . A A . 4 DPR CG 1 1 7 679 1 1 4 DPR HA H 15.473 16.469 11.924 1.00 . A A . 4 DPR HA 1 1 7 680 1 1 4 DPR HB2 H 17.877 18.257 11.885 1.00 . A A . 4 DPR HB2 1 1 7 681 1 1 4 DPR HB3 H 17.091 17.355 10.532 1.00 . A A . 4 DPR HB3 1 1 7 682 1 1 4 DPR HD2 H 18.738 16.102 13.862 1.00 . A A . 4 DPR HD2 1 1 7 683 1 1 4 DPR HD3 H 18.200 14.593 13.211 1.00 . A A . 4 DPR HD3 1 1 7 684 1 1 4 DPR HG2 H 19.437 16.507 11.582 1.00 . A A . 4 DPR HG2 1 1 7 685 1 1 4 DPR HG3 H 18.204 15.479 10.882 1.00 . A A . 4 DPR HG3 1 1 7 686 1 1 4 DPR N N 16.716 16.002 13.428 1.00 . A A . 4 DPR N 1 1 7 687 1 1 4 DPR O O 15.300 19.125 12.400 1.00 . A A . 4 DPR O 1 1 7 688 1 1 5 LYS C C 15.873 20.230 16.169 1.00 . A A . 5 LYS C 1 1 7 689 1 1 5 LYS CA C 14.962 19.516 15.175 1.00 . A A . 5 LYS CA 1 1 7 690 1 1 5 LYS CB C 13.671 19.209 15.939 1.00 . A A . 5 LYS CB 1 1 7 691 1 1 5 LYS CD C 11.818 19.811 14.159 1.00 . A A . 5 LYS CD 1 1 7 692 1 1 5 LYS CE C 10.753 19.162 13.278 1.00 . A A . 5 LYS CE 1 1 7 693 1 1 5 LYS CG C 12.370 18.863 15.219 1.00 . A A . 5 LYS CG 1 1 7 694 1 1 5 LYS H H 15.755 17.541 15.026 1.00 . A A . 5 LYS H 1 1 7 695 1 1 5 LYS HA H 14.652 20.309 14.495 1.00 . A A . 5 LYS HA 1 1 7 696 1 1 5 LYS HB2 H 13.959 18.473 16.689 1.00 . A A . 5 LYS HB2 1 1 7 697 1 1 5 LYS HB3 H 13.352 20.112 16.462 1.00 . A A . 5 LYS HB3 1 1 7 698 1 1 5 LYS HD2 H 11.371 20.739 14.537 1.00 . A A . 5 LYS HD2 1 1 7 699 1 1 5 LYS HD3 H 12.702 20.074 13.575 1.00 . A A . 5 LYS HD3 1 1 7 700 1 1 5 LYS HE2 H 11.181 18.269 12.829 1.00 . A A . 5 LYS HE2 1 1 7 701 1 1 5 LYS HE3 H 9.925 18.876 13.934 1.00 . A A . 5 LYS HE3 1 1 7 702 1 1 5 LYS HG2 H 12.489 17.884 14.766 1.00 . A A . 5 LYS HG2 1 1 7 703 1 1 5 LYS HG3 H 11.652 18.854 16.031 1.00 . A A . 5 LYS HG3 1 1 7 704 1 1 5 LYS HZ1 H 9.755 20.864 12.482 1.00 . A A . 5 LYS HZ1 1 1 7 705 1 1 5 LYS HZ2 H 9.757 19.459 11.569 1.00 . A A . 5 LYS HZ2 1 1 7 706 1 1 5 LYS HZ3 H 11.056 20.423 11.675 1.00 . A A . 5 LYS HZ3 1 1 7 707 1 1 5 LYS N N 15.483 18.353 14.490 1.00 . A A . 5 LYS N 1 1 7 708 1 1 5 LYS NZ N 10.277 20.043 12.205 1.00 . A A . 5 LYS NZ 1 1 7 709 1 1 5 LYS O O 15.588 21.381 16.478 1.00 . A A . 5 LYS O 1 1 7 710 1 1 6 DTH C C 18.352 19.206 18.514 1.00 . A A . 6 DTH C 1 1 7 711 1 1 6 DTH CA C 17.964 20.285 17.518 1.00 . A A . 6 DTH CA 1 1 7 712 1 1 6 DTH CB C 19.215 20.714 16.749 1.00 . A A . 6 DTH CB 1 1 7 713 1 1 6 DTH CG2 C 19.784 19.712 15.748 1.00 . A A . 6 DTH CG2 1 1 7 714 1 1 6 DTH H H 17.080 18.686 16.429 1.00 . A A . 6 DTH H 1 1 7 715 1 1 6 DTH HA H 17.553 21.186 17.982 1.00 . A A . 6 DTH HA 1 1 7 716 1 1 6 DTH HB H 20.014 20.954 17.448 1.00 . A A . 6 DTH HB 1 1 7 717 1 1 6 DTH HG1 H 18.781 21.687 15.125 1.00 . A A . 6 DTH HG1 1 1 7 718 1 1 6 DTH HG21 H 20.455 19.035 16.270 1.00 . A A . 6 DTH HG21 1 1 7 719 1 1 6 DTH HG22 H 20.346 20.215 14.960 1.00 . A A . 6 DTH HG22 1 1 7 720 1 1 6 DTH HG23 H 19.027 19.124 15.239 1.00 . A A . 6 DTH HG23 1 1 7 721 1 1 6 DTH N N 16.963 19.662 16.668 1.00 . A A . 6 DTH N 1 1 7 722 1 1 6 DTH O O 18.558 18.042 18.185 1.00 . A A . 6 DTH O 1 1 7 723 1 1 6 DTH OG1 O 19.049 21.906 16.019 1.00 . A A . 6 DTH OG1 1 1 7 724 1 1 7 . C C 18.452 17.744 21.118 1.00 . A A . 7 DAS C 1 1 7 725 1 1 7 . CA C 19.211 19.032 20.810 1.00 . A A . 7 DAS CA 1 1 7 726 1 1 7 . CB C 20.719 18.919 20.562 1.00 . A A . 7 DAS CB 1 1 7 727 1 1 7 . CG C 21.444 20.233 20.354 1.00 . A A . 7 DAS CG 1 1 7 728 1 1 7 . H H 18.289 20.686 19.891 1.00 . A A . 7 DAS H 1 1 7 729 1 1 7 . HA H 19.110 19.736 21.636 1.00 . A A . 7 DAS HA 1 1 7 730 1 1 7 . HB2 H 20.840 18.294 19.678 1.00 . A A . 7 DAS HB2 1 1 7 731 1 1 7 . HB3 H 21.122 18.362 21.408 1.00 . A A . 7 DAS HB3 1 1 7 732 1 1 7 . N N 18.621 19.756 19.696 1.00 . A A . 7 DAS N 1 1 7 733 1 1 7 . O O 17.262 17.914 21.361 1.00 . A A . 7 DAS O 1 1 7 734 1 1 7 . OD1 O 20.851 21.325 20.490 1.00 . A A . 7 DAS OD1 1 1 7 735 1 1 7 . OD2 O 22.672 20.085 20.220 1.00 . A A . 7 DAS OD2 1 1 8 736 1 1 1 GLN C C 16.815 15.176 20.858 1.00 . A A . 1 GLN C 1 1 8 737 1 1 1 GLN CA C 18.226 15.306 21.423 1.00 . A A . 1 GLN CA 1 1 8 738 1 1 1 GLN CB C 18.243 15.206 22.949 1.00 . A A . 1 GLN CB 1 1 8 739 1 1 1 GLN CD C 20.292 13.724 23.391 1.00 . A A . 1 GLN CD 1 1 8 740 1 1 1 GLN CG C 19.632 15.092 23.570 1.00 . A A . 1 GLN CG 1 1 8 741 1 1 1 GLN H1 H 19.946 16.256 20.709 1.00 . A A . 1 GLN H1 1 1 8 742 1 1 1 GLN HA H 18.861 14.523 21.003 1.00 . A A . 1 GLN HA 1 1 8 743 1 1 1 GLN HB2 H 17.783 16.103 23.336 1.00 . A A . 1 GLN HB2 1 1 8 744 1 1 1 GLN HB3 H 17.743 14.267 23.181 1.00 . A A . 1 GLN HB3 1 1 8 745 1 1 1 GLN HE21 H 22.128 14.462 23.957 1.00 . A A . 1 GLN HE21 1 1 8 746 1 1 1 GLN HE22 H 22.042 12.806 23.345 1.00 . A A . 1 GLN HE22 1 1 8 747 1 1 1 GLN HG2 H 20.294 15.880 23.187 1.00 . A A . 1 GLN HG2 1 1 8 748 1 1 1 GLN HG3 H 19.489 15.359 24.617 1.00 . A A . 1 GLN HG3 1 1 8 749 1 1 1 GLN N N 18.996 16.461 20.992 1.00 . A A . 1 GLN N 1 1 8 750 1 1 1 GLN NE2 N 21.593 13.660 23.648 1.00 . A A . 1 GLN NE2 1 1 8 751 1 1 1 GLN O O 15.907 14.591 21.443 1.00 . A A . 1 GLN O 1 1 8 752 1 1 1 GLN OE1 O 19.688 12.743 22.982 1.00 . A A . 1 GLN OE1 1 1 8 753 1 1 2 ASP C C 15.775 15.682 17.404 1.00 . A A . 2 ASP C 1 1 8 754 1 1 2 ASP CA C 15.407 15.584 18.880 1.00 . A A . 2 ASP CA 1 1 8 755 1 1 2 ASP CB C 14.438 16.690 19.276 1.00 . A A . 2 ASP CB 1 1 8 756 1 1 2 ASP CG C 13.041 16.533 18.705 1.00 . A A . 2 ASP CG 1 1 8 757 1 1 2 ASP H H 17.377 16.270 19.273 1.00 . A A . 2 ASP H 1 1 8 758 1 1 2 ASP HA H 14.933 14.617 19.063 1.00 . A A . 2 ASP HA 1 1 8 759 1 1 2 ASP HB2 H 14.294 16.664 20.357 1.00 . A A . 2 ASP HB2 1 1 8 760 1 1 2 ASP HB3 H 14.775 17.688 19.010 1.00 . A A . 2 ASP HB3 1 1 8 761 1 1 2 ASP N N 16.600 15.760 19.684 1.00 . A A . 2 ASP N 1 1 8 762 1 1 2 ASP O O 15.820 16.770 16.844 1.00 . A A . 2 ASP O 1 1 8 763 1 1 2 ASP OD1 O 12.703 15.659 17.875 1.00 . A A . 2 ASP OD1 1 1 8 764 1 1 2 ASP OD2 O 12.151 17.235 19.236 1.00 . A A . 2 ASP OD2 1 1 8 765 1 1 3 PRO C C 16.284 15.497 14.436 1.00 . A A . 3 PRO C 1 1 8 766 1 1 3 PRO CA C 16.996 14.735 15.543 1.00 . A A . 3 PRO CA 1 1 8 767 1 1 3 PRO CB C 17.085 13.291 15.049 1.00 . A A . 3 PRO CB 1 1 8 768 1 1 3 PRO CD C 16.473 13.294 17.390 1.00 . A A . 3 PRO CD 1 1 8 769 1 1 3 PRO CG C 17.230 12.493 16.340 1.00 . A A . 3 PRO CG 1 1 8 770 1 1 3 PRO HA H 18.034 15.039 15.700 1.00 . A A . 3 PRO HA 1 1 8 771 1 1 3 PRO HB2 H 16.125 12.968 14.635 1.00 . A A . 3 PRO HB2 1 1 8 772 1 1 3 PRO HB3 H 17.931 13.134 14.383 1.00 . A A . 3 PRO HB3 1 1 8 773 1 1 3 PRO HD2 H 15.492 12.828 17.475 1.00 . A A . 3 PRO HD2 1 1 8 774 1 1 3 PRO HD3 H 17.081 13.337 18.292 1.00 . A A . 3 PRO HD3 1 1 8 775 1 1 3 PRO HG2 H 16.813 11.499 16.220 1.00 . A A . 3 PRO HG2 1 1 8 776 1 1 3 PRO HG3 H 18.318 12.531 16.434 1.00 . A A . 3 PRO HG3 1 1 8 777 1 1 3 PRO N N 16.347 14.621 16.834 1.00 . A A . 3 PRO N 1 1 8 778 1 1 3 PRO O O 15.063 15.558 14.368 1.00 . A A . 3 PRO O 1 1 8 779 1 1 4 DPR C C 15.489 18.238 13.027 1.00 . A A . 4 DPR C 1 1 8 780 1 1 4 DPR CA C 16.349 17.082 12.524 1.00 . A A . 4 DPR CA 1 1 8 781 1 1 4 DPR CB C 17.506 17.626 11.694 1.00 . A A . 4 DPR CB 1 1 8 782 1 1 4 DPR CD C 18.377 16.139 13.341 1.00 . A A . 4 DPR CD 1 1 8 783 1 1 4 DPR CG C 18.650 16.639 11.921 1.00 . A A . 4 DPR CG 1 1 8 784 1 1 4 DPR HA H 15.743 16.441 11.881 1.00 . A A . 4 DPR HA 1 1 8 785 1 1 4 DPR HB2 H 17.819 18.590 12.088 1.00 . A A . 4 DPR HB2 1 1 8 786 1 1 4 DPR HB3 H 17.237 17.637 10.635 1.00 . A A . 4 DPR HB3 1 1 8 787 1 1 4 DPR HD2 H 19.041 16.720 13.982 1.00 . A A . 4 DPR HD2 1 1 8 788 1 1 4 DPR HD3 H 18.690 15.099 13.430 1.00 . A A . 4 DPR HD3 1 1 8 789 1 1 4 DPR HG2 H 19.593 17.167 11.992 1.00 . A A . 4 DPR HG2 1 1 8 790 1 1 4 DPR HG3 H 18.641 15.811 11.208 1.00 . A A . 4 DPR HG3 1 1 8 791 1 1 4 DPR N N 16.947 16.220 13.527 1.00 . A A . 4 DPR N 1 1 8 792 1 1 4 DPR O O 14.966 19.016 12.234 1.00 . A A . 4 DPR O 1 1 8 793 1 1 5 LYS C C 15.659 20.186 16.034 1.00 . A A . 5 LYS C 1 1 8 794 1 1 5 LYS CA C 14.721 19.496 15.055 1.00 . A A . 5 LYS CA 1 1 8 795 1 1 5 LYS CB C 13.467 19.004 15.781 1.00 . A A . 5 LYS CB 1 1 8 796 1 1 5 LYS CD C 11.172 17.830 15.593 1.00 . A A . 5 LYS CD 1 1 8 797 1 1 5 LYS CE C 9.984 17.345 14.774 1.00 . A A . 5 LYS CE 1 1 8 798 1 1 5 LYS CG C 12.419 18.345 14.893 1.00 . A A . 5 LYS CG 1 1 8 799 1 1 5 LYS H H 15.738 17.621 14.862 1.00 . A A . 5 LYS H 1 1 8 800 1 1 5 LYS HA H 14.405 20.234 14.325 1.00 . A A . 5 LYS HA 1 1 8 801 1 1 5 LYS HB2 H 13.827 18.165 16.384 1.00 . A A . 5 LYS HB2 1 1 8 802 1 1 5 LYS HB3 H 13.014 19.827 16.332 1.00 . A A . 5 LYS HB3 1 1 8 803 1 1 5 LYS HD2 H 11.468 17.007 16.254 1.00 . A A . 5 LYS HD2 1 1 8 804 1 1 5 LYS HD3 H 10.745 18.539 16.295 1.00 . A A . 5 LYS HD3 1 1 8 805 1 1 5 LYS HE2 H 9.273 16.821 15.420 1.00 . A A . 5 LYS HE2 1 1 8 806 1 1 5 LYS HE3 H 9.524 18.251 14.366 1.00 . A A . 5 LYS HE3 1 1 8 807 1 1 5 LYS HG2 H 12.009 19.079 14.199 1.00 . A A . 5 LYS HG2 1 1 8 808 1 1 5 LYS HG3 H 12.786 17.567 14.218 1.00 . A A . 5 LYS HG3 1 1 8 809 1 1 5 LYS HZ1 H 10.742 16.934 12.862 1.00 . A A . 5 LYS HZ1 1 1 8 810 1 1 5 LYS HZ2 H 9.515 15.967 13.280 1.00 . A A . 5 LYS HZ2 1 1 8 811 1 1 5 LYS HZ3 H 11.021 15.823 13.997 1.00 . A A . 5 LYS HZ3 1 1 8 812 1 1 5 LYS N N 15.318 18.378 14.340 1.00 . A A . 5 LYS N 1 1 8 813 1 1 5 LYS NZ N 10.317 16.456 13.642 1.00 . A A . 5 LYS NZ 1 1 8 814 1 1 5 LYS O O 15.480 21.351 16.404 1.00 . A A . 5 LYS O 1 1 8 815 1 1 6 DTH C C 18.390 19.155 18.389 1.00 . A A . 6 DTH C 1 1 8 816 1 1 6 DTH CA C 17.674 20.150 17.483 1.00 . A A . 6 DTH CA 1 1 8 817 1 1 6 DTH CB C 18.768 20.931 16.737 1.00 . A A . 6 DTH CB 1 1 8 818 1 1 6 DTH CG2 C 19.545 20.080 15.739 1.00 . A A . 6 DTH CG2 1 1 8 819 1 1 6 DTH H H 16.827 18.612 16.294 1.00 . A A . 6 DTH H 1 1 8 820 1 1 6 DTH HA H 17.162 20.712 18.257 1.00 . A A . 6 DTH HA 1 1 8 821 1 1 6 DTH HB H 19.559 21.297 17.393 1.00 . A A . 6 DTH HB 1 1 8 822 1 1 6 DTH HG1 H 17.500 21.924 15.734 1.00 . A A . 6 DTH HG1 1 1 8 823 1 1 6 DTH HG21 H 20.137 19.291 16.213 1.00 . A A . 6 DTH HG21 1 1 8 824 1 1 6 DTH HG22 H 20.229 20.635 15.100 1.00 . A A . 6 DTH HG22 1 1 8 825 1 1 6 DTH HG23 H 18.875 19.602 15.032 1.00 . A A . 6 DTH HG23 1 1 8 826 1 1 6 DTH N N 16.742 19.588 16.533 1.00 . A A . 6 DTH N 1 1 8 827 1 1 6 DTH O O 18.347 17.952 18.123 1.00 . A A . 6 DTH O 1 1 8 828 1 1 6 DTH OG1 O 18.366 22.122 16.111 1.00 . A A . 6 DTH OG1 1 1 8 829 1 1 7 . C C 18.712 17.760 21.061 1.00 . A A . 7 DAS C 1 1 8 830 1 1 7 . CA C 19.687 18.767 20.472 1.00 . A A . 7 DAS CA 1 1 8 831 1 1 7 . CB C 21.082 18.281 20.062 1.00 . A A . 7 DAS CB 1 1 8 832 1 1 7 . CG C 21.895 19.311 19.291 1.00 . A A . 7 DAS CG 1 1 8 833 1 1 7 . H H 18.920 20.557 19.732 1.00 . A A . 7 DAS H 1 1 8 834 1 1 7 . HA H 19.916 19.388 21.331 1.00 . A A . 7 DAS HA 1 1 8 835 1 1 7 . HB2 H 20.986 17.353 19.503 1.00 . A A . 7 DAS HB2 1 1 8 836 1 1 7 . HB3 H 21.563 18.075 21.016 1.00 . A A . 7 DAS HB3 1 1 8 837 1 1 7 . N N 19.012 19.584 19.481 1.00 . A A . 7 DAS N 1 1 8 838 1 1 7 . O O 17.692 18.182 21.610 1.00 . A A . 7 DAS O 1 1 8 839 1 1 7 . OD1 O 22.298 20.292 19.949 1.00 . A A . 7 DAS OD1 1 1 8 840 1 1 7 . OD2 O 22.162 19.143 18.087 1.00 . A A . 7 DAS OD2 1 1 9 841 1 1 1 GLN C C 16.984 15.066 20.766 1.00 . A A . 1 GLN C 1 1 9 842 1 1 1 GLN CA C 18.210 15.410 21.594 1.00 . A A . 1 GLN CA 1 1 9 843 1 1 1 GLN CB C 17.887 15.352 23.089 1.00 . A A . 1 GLN CB 1 1 9 844 1 1 1 GLN CD C 20.077 14.237 23.735 1.00 . A A . 1 GLN CD 1 1 9 845 1 1 1 GLN CG C 19.084 15.350 24.037 1.00 . A A . 1 GLN CG 1 1 9 846 1 1 1 GLN H1 H 19.890 16.558 21.088 1.00 . A A . 1 GLN H1 1 1 9 847 1 1 1 GLN HA H 18.887 14.594 21.348 1.00 . A A . 1 GLN HA 1 1 9 848 1 1 1 GLN HB2 H 17.146 16.117 23.326 1.00 . A A . 1 GLN HB2 1 1 9 849 1 1 1 GLN HB3 H 17.363 14.412 23.258 1.00 . A A . 1 GLN HB3 1 1 9 850 1 1 1 GLN HE21 H 18.678 12.712 23.970 1.00 . A A . 1 GLN HE21 1 1 9 851 1 1 1 GLN HE22 H 20.242 12.297 23.288 1.00 . A A . 1 GLN HE22 1 1 9 852 1 1 1 GLN HG2 H 19.629 16.295 23.972 1.00 . A A . 1 GLN HG2 1 1 9 853 1 1 1 GLN HG3 H 18.691 15.262 25.045 1.00 . A A . 1 GLN HG3 1 1 9 854 1 1 1 GLN N N 18.890 16.635 21.234 1.00 . A A . 1 GLN N 1 1 9 855 1 1 1 GLN NE2 N 19.607 12.982 23.676 1.00 . A A . 1 GLN NE2 1 1 9 856 1 1 1 GLN O O 16.121 14.291 21.181 1.00 . A A . 1 GLN O 1 1 9 857 1 1 1 GLN OE1 O 21.182 14.476 23.240 1.00 . A A . 1 GLN OE1 1 1 9 858 1 1 2 ASP C C 16.012 15.681 17.243 1.00 . A A . 2 ASP C 1 1 9 859 1 1 2 ASP CA C 15.642 15.596 18.719 1.00 . A A . 2 ASP CA 1 1 9 860 1 1 2 ASP CB C 14.765 16.783 19.137 1.00 . A A . 2 ASP CB 1 1 9 861 1 1 2 ASP CG C 13.343 16.421 18.755 1.00 . A A . 2 ASP CG 1 1 9 862 1 1 2 ASP H H 17.597 16.184 19.253 1.00 . A A . 2 ASP H 1 1 9 863 1 1 2 ASP HA H 15.154 14.647 18.921 1.00 . A A . 2 ASP HA 1 1 9 864 1 1 2 ASP HB2 H 14.837 16.980 20.214 1.00 . A A . 2 ASP HB2 1 1 9 865 1 1 2 ASP HB3 H 15.193 17.651 18.647 1.00 . A A . 2 ASP HB3 1 1 9 866 1 1 2 ASP N N 16.808 15.639 19.577 1.00 . A A . 2 ASP N 1 1 9 867 1 1 2 ASP O O 16.258 16.788 16.782 1.00 . A A . 2 ASP O 1 1 9 868 1 1 2 ASP OD1 O 13.051 15.414 18.080 1.00 . A A . 2 ASP OD1 1 1 9 869 1 1 2 ASP OD2 O 12.450 17.164 19.223 1.00 . A A . 2 ASP OD2 1 1 9 870 1 1 3 PRO C C 16.142 15.389 14.147 1.00 . A A . 3 PRO C 1 1 9 871 1 1 3 PRO CA C 16.874 14.578 15.212 1.00 . A A . 3 PRO CA 1 1 9 872 1 1 3 PRO CB C 17.019 13.118 14.778 1.00 . A A . 3 PRO CB 1 1 9 873 1 1 3 PRO CD C 16.195 13.232 16.986 1.00 . A A . 3 PRO CD 1 1 9 874 1 1 3 PRO CG C 16.100 12.353 15.738 1.00 . A A . 3 PRO CG 1 1 9 875 1 1 3 PRO HA H 17.911 14.905 15.254 1.00 . A A . 3 PRO HA 1 1 9 876 1 1 3 PRO HB2 H 16.764 12.975 13.734 1.00 . A A . 3 PRO HB2 1 1 9 877 1 1 3 PRO HB3 H 18.053 12.809 14.910 1.00 . A A . 3 PRO HB3 1 1 9 878 1 1 3 PRO HD2 H 15.309 12.998 17.584 1.00 . A A . 3 PRO HD2 1 1 9 879 1 1 3 PRO HD3 H 17.130 13.015 17.495 1.00 . A A . 3 PRO HD3 1 1 9 880 1 1 3 PRO HG2 H 15.108 12.324 15.303 1.00 . A A . 3 PRO HG2 1 1 9 881 1 1 3 PRO HG3 H 16.369 11.303 15.849 1.00 . A A . 3 PRO HG3 1 1 9 882 1 1 3 PRO N N 16.197 14.594 16.496 1.00 . A A . 3 PRO N 1 1 9 883 1 1 3 PRO O O 14.923 15.274 14.036 1.00 . A A . 3 PRO O 1 1 9 884 1 1 4 DPR C C 15.284 18.308 13.143 1.00 . A A . 4 DPR C 1 1 9 885 1 1 4 DPR CA C 16.112 17.186 12.533 1.00 . A A . 4 DPR CA 1 1 9 886 1 1 4 DPR CB C 17.176 17.918 11.716 1.00 . A A . 4 DPR CB 1 1 9 887 1 1 4 DPR CD C 18.261 16.416 13.287 1.00 . A A . 4 DPR CD 1 1 9 888 1 1 4 DPR CG C 18.460 17.119 11.953 1.00 . A A . 4 DPR CG 1 1 9 889 1 1 4 DPR HA H 15.409 16.635 11.914 1.00 . A A . 4 DPR HA 1 1 9 890 1 1 4 DPR HB2 H 17.390 18.875 12.179 1.00 . A A . 4 DPR HB2 1 1 9 891 1 1 4 DPR HB3 H 16.831 17.950 10.687 1.00 . A A . 4 DPR HB3 1 1 9 892 1 1 4 DPR HD2 H 18.621 17.049 14.099 1.00 . A A . 4 DPR HD2 1 1 9 893 1 1 4 DPR HD3 H 18.723 15.431 13.213 1.00 . A A . 4 DPR HD3 1 1 9 894 1 1 4 DPR HG2 H 19.302 17.805 12.022 1.00 . A A . 4 DPR HG2 1 1 9 895 1 1 4 DPR HG3 H 18.463 16.342 11.196 1.00 . A A . 4 DPR HG3 1 1 9 896 1 1 4 DPR N N 16.825 16.268 13.404 1.00 . A A . 4 DPR N 1 1 9 897 1 1 4 DPR O O 14.707 19.174 12.477 1.00 . A A . 4 DPR O 1 1 9 898 1 1 5 LYS C C 15.749 20.013 16.296 1.00 . A A . 5 LYS C 1 1 9 899 1 1 5 LYS CA C 14.774 19.375 15.318 1.00 . A A . 5 LYS CA 1 1 9 900 1 1 5 LYS CB C 13.677 18.682 16.122 1.00 . A A . 5 LYS CB 1 1 9 901 1 1 5 LYS CD C 11.230 17.885 16.123 1.00 . A A . 5 LYS CD 1 1 9 902 1 1 5 LYS CE C 10.764 18.804 17.249 1.00 . A A . 5 LYS CE 1 1 9 903 1 1 5 LYS CG C 12.344 18.601 15.373 1.00 . A A . 5 LYS CG 1 1 9 904 1 1 5 LYS H H 15.751 17.619 15.012 1.00 . A A . 5 LYS H 1 1 9 905 1 1 5 LYS HA H 14.332 20.210 14.784 1.00 . A A . 5 LYS HA 1 1 9 906 1 1 5 LYS HB2 H 13.976 17.673 16.409 1.00 . A A . 5 LYS HB2 1 1 9 907 1 1 5 LYS HB3 H 13.469 19.258 17.020 1.00 . A A . 5 LYS HB3 1 1 9 908 1 1 5 LYS HD2 H 10.395 17.605 15.474 1.00 . A A . 5 LYS HD2 1 1 9 909 1 1 5 LYS HD3 H 11.487 16.879 16.475 1.00 . A A . 5 LYS HD3 1 1 9 910 1 1 5 LYS HE2 H 11.565 18.864 17.983 1.00 . A A . 5 LYS HE2 1 1 9 911 1 1 5 LYS HE3 H 10.336 19.713 16.825 1.00 . A A . 5 LYS HE3 1 1 9 912 1 1 5 LYS HG2 H 12.023 19.613 15.151 1.00 . A A . 5 LYS HG2 1 1 9 913 1 1 5 LYS HG3 H 12.471 18.039 14.443 1.00 . A A . 5 LYS HG3 1 1 9 914 1 1 5 LYS HZ1 H 8.930 17.865 17.418 1.00 . A A . 5 LYS HZ1 1 1 9 915 1 1 5 LYS HZ2 H 9.321 18.845 18.696 1.00 . A A . 5 LYS HZ2 1 1 9 916 1 1 5 LYS HZ3 H 10.043 17.460 18.629 1.00 . A A . 5 LYS HZ3 1 1 9 917 1 1 5 LYS N N 15.417 18.392 14.463 1.00 . A A . 5 LYS N 1 1 9 918 1 1 5 LYS NZ N 9.676 18.182 18.026 1.00 . A A . 5 LYS NZ 1 1 9 919 1 1 5 LYS O O 15.401 21.006 16.927 1.00 . A A . 5 LYS O 1 1 9 920 1 1 6 DTH C C 18.537 19.036 18.375 1.00 . A A . 6 DTH C 1 1 9 921 1 1 6 DTH CA C 18.106 19.974 17.256 1.00 . A A . 6 DTH CA 1 1 9 922 1 1 6 DTH CB C 19.268 20.295 16.320 1.00 . A A . 6 DTH CB 1 1 9 923 1 1 6 DTH CG2 C 19.565 19.176 15.332 1.00 . A A . 6 DTH CG2 1 1 9 924 1 1 6 DTH H H 17.001 18.510 16.264 1.00 . A A . 6 DTH H 1 1 9 925 1 1 6 DTH HA H 17.803 20.919 17.721 1.00 . A A . 6 DTH HA 1 1 9 926 1 1 6 DTH HB H 20.156 20.474 16.929 1.00 . A A . 6 DTH HB 1 1 9 927 1 1 6 DTH HG1 H 19.742 21.686 14.979 1.00 . A A . 6 DTH HG1 1 1 9 928 1 1 6 DTH HG21 H 18.838 19.124 14.517 1.00 . A A . 6 DTH HG21 1 1 9 929 1 1 6 DTH HG22 H 19.708 18.155 15.686 1.00 . A A . 6 DTH HG22 1 1 9 930 1 1 6 DTH HG23 H 20.461 19.504 14.794 1.00 . A A . 6 DTH HG23 1 1 9 931 1 1 6 DTH N N 16.938 19.465 16.572 1.00 . A A . 6 DTH N 1 1 9 932 1 1 6 DTH O O 18.647 17.820 18.236 1.00 . A A . 6 DTH O 1 1 9 933 1 1 6 DTH OG1 O 19.020 21.479 15.590 1.00 . A A . 6 DTH OG1 1 1 9 934 1 1 7 . C C 18.468 17.896 21.309 1.00 . A A . 7 DAS C 1 1 9 935 1 1 7 . CA C 19.344 19.003 20.748 1.00 . A A . 7 DAS CA 1 1 9 936 1 1 7 . CB C 20.826 18.659 20.631 1.00 . A A . 7 DAS CB 1 1 9 937 1 1 7 . CG C 21.649 19.818 20.085 1.00 . A A . 7 DAS CG 1 1 9 938 1 1 7 . H H 18.951 20.640 19.471 1.00 . A A . 7 DAS H 1 1 9 939 1 1 7 . HA H 19.200 19.726 21.554 1.00 . A A . 7 DAS HA 1 1 9 940 1 1 7 . HB2 H 21.060 17.812 19.995 1.00 . A A . 7 DAS HB2 1 1 9 941 1 1 7 . HB3 H 21.199 18.333 21.598 1.00 . A A . 7 DAS HB3 1 1 9 942 1 1 7 . N N 18.965 19.628 19.497 1.00 . A A . 7 DAS N 1 1 9 943 1 1 7 . O O 17.367 18.240 21.735 1.00 . A A . 7 DAS O 1 1 9 944 1 1 7 . OD1 O 22.394 19.594 19.100 1.00 . A A . 7 DAS OD1 1 1 9 945 1 1 7 . OD2 O 21.587 20.940 20.619 1.00 . A A . 7 DAS OD2 1 1 10 946 1 1 1 GLN C C 17.422 14.847 20.454 1.00 . A A . 1 GLN C 1 1 10 947 1 1 1 GLN CA C 18.439 15.280 21.500 1.00 . A A . 1 GLN CA 1 1 10 948 1 1 1 GLN CB C 17.930 15.154 22.931 1.00 . A A . 1 GLN CB 1 1 10 949 1 1 1 GLN CD C 19.818 13.989 24.100 1.00 . A A . 1 GLN CD 1 1 10 950 1 1 1 GLN CG C 18.990 15.257 24.024 1.00 . A A . 1 GLN CG 1 1 10 951 1 1 1 GLN H1 H 19.841 16.537 20.732 1.00 . A A . 1 GLN H1 1 1 10 952 1 1 1 GLN HA H 19.156 14.467 21.356 1.00 . A A . 1 GLN HA 1 1 10 953 1 1 1 GLN HB2 H 17.091 15.789 23.168 1.00 . A A . 1 GLN HB2 1 1 10 954 1 1 1 GLN HB3 H 17.409 14.205 23.100 1.00 . A A . 1 GLN HB3 1 1 10 955 1 1 1 GLN HE21 H 20.982 14.825 25.538 1.00 . A A . 1 GLN HE21 1 1 10 956 1 1 1 GLN HE22 H 21.284 13.134 25.198 1.00 . A A . 1 GLN HE22 1 1 10 957 1 1 1 GLN HG2 H 19.529 16.196 23.921 1.00 . A A . 1 GLN HG2 1 1 10 958 1 1 1 GLN HG3 H 18.441 15.356 24.964 1.00 . A A . 1 GLN HG3 1 1 10 959 1 1 1 GLN N N 19.007 16.591 21.294 1.00 . A A . 1 GLN N 1 1 10 960 1 1 1 GLN NE2 N 20.853 14.019 24.948 1.00 . A A . 1 GLN NE2 1 1 10 961 1 1 1 GLN O O 16.958 13.713 20.498 1.00 . A A . 1 GLN O 1 1 10 962 1 1 1 GLN OE1 O 19.795 13.062 23.297 1.00 . A A . 1 GLN OE1 1 1 10 963 1 1 2 ASP C C 16.198 15.644 17.302 1.00 . A A . 2 ASP C 1 1 10 964 1 1 2 ASP CA C 15.795 15.661 18.766 1.00 . A A . 2 ASP CA 1 1 10 965 1 1 2 ASP CB C 14.894 16.824 19.156 1.00 . A A . 2 ASP CB 1 1 10 966 1 1 2 ASP CG C 13.533 16.850 18.469 1.00 . A A . 2 ASP CG 1 1 10 967 1 1 2 ASP H H 17.529 16.610 19.466 1.00 . A A . 2 ASP H 1 1 10 968 1 1 2 ASP HA H 15.227 14.758 18.987 1.00 . A A . 2 ASP HA 1 1 10 969 1 1 2 ASP HB2 H 14.710 16.839 20.235 1.00 . A A . 2 ASP HB2 1 1 10 970 1 1 2 ASP HB3 H 15.410 17.757 18.955 1.00 . A A . 2 ASP HB3 1 1 10 971 1 1 2 ASP N N 17.013 15.749 19.552 1.00 . A A . 2 ASP N 1 1 10 972 1 1 2 ASP O O 16.389 16.734 16.762 1.00 . A A . 2 ASP O 1 1 10 973 1 1 2 ASP OD1 O 13.107 15.743 18.056 1.00 . A A . 2 ASP OD1 1 1 10 974 1 1 2 ASP OD2 O 12.827 17.869 18.565 1.00 . A A . 2 ASP OD2 1 1 10 975 1 1 3 PRO C C 15.987 15.348 14.263 1.00 . A A . 3 PRO C 1 1 10 976 1 1 3 PRO CA C 16.720 14.411 15.217 1.00 . A A . 3 PRO CA 1 1 10 977 1 1 3 PRO CB C 16.465 12.975 14.774 1.00 . A A . 3 PRO CB 1 1 10 978 1 1 3 PRO CD C 16.077 13.177 17.108 1.00 . A A . 3 PRO CD 1 1 10 979 1 1 3 PRO CG C 16.626 12.190 16.076 1.00 . A A . 3 PRO CG 1 1 10 980 1 1 3 PRO HA H 17.774 14.677 15.109 1.00 . A A . 3 PRO HA 1 1 10 981 1 1 3 PRO HB2 H 15.450 12.811 14.404 1.00 . A A . 3 PRO HB2 1 1 10 982 1 1 3 PRO HB3 H 17.220 12.673 14.042 1.00 . A A . 3 PRO HB3 1 1 10 983 1 1 3 PRO HD2 H 15.002 13.029 17.227 1.00 . A A . 3 PRO HD2 1 1 10 984 1 1 3 PRO HD3 H 16.591 13.041 18.056 1.00 . A A . 3 PRO HD3 1 1 10 985 1 1 3 PRO HG2 H 16.080 11.247 16.022 1.00 . A A . 3 PRO HG2 1 1 10 986 1 1 3 PRO HG3 H 17.691 11.997 16.246 1.00 . A A . 3 PRO HG3 1 1 10 987 1 1 3 PRO N N 16.291 14.511 16.596 1.00 . A A . 3 PRO N 1 1 10 988 1 1 3 PRO O O 14.759 15.331 14.328 1.00 . A A . 3 PRO O 1 1 10 989 1 1 4 DPR C C 15.445 18.215 13.115 1.00 . A A . 4 DPR C 1 1 10 990 1 1 4 DPR CA C 15.965 16.941 12.459 1.00 . A A . 4 DPR CA 1 1 10 991 1 1 4 DPR CB C 17.015 17.227 11.382 1.00 . A A . 4 DPR CB 1 1 10 992 1 1 4 DPR CD C 18.100 16.355 13.295 1.00 . A A . 4 DPR CD 1 1 10 993 1 1 4 DPR CG C 18.287 17.391 12.194 1.00 . A A . 4 DPR CG 1 1 10 994 1 1 4 DPR HA H 15.043 16.464 12.135 1.00 . A A . 4 DPR HA 1 1 10 995 1 1 4 DPR HB2 H 16.849 18.096 10.753 1.00 . A A . 4 DPR HB2 1 1 10 996 1 1 4 DPR HB3 H 17.144 16.382 10.705 1.00 . A A . 4 DPR HB3 1 1 10 997 1 1 4 DPR HD2 H 18.579 16.701 14.215 1.00 . A A . 4 DPR HD2 1 1 10 998 1 1 4 DPR HD3 H 18.541 15.407 12.989 1.00 . A A . 4 DPR HD3 1 1 10 999 1 1 4 DPR HG2 H 18.396 18.322 12.754 1.00 . A A . 4 DPR HG2 1 1 10 1000 1 1 4 DPR HG3 H 19.214 17.203 11.649 1.00 . A A . 4 DPR HG3 1 1 10 1001 1 1 4 DPR N N 16.677 16.096 13.401 1.00 . A A . 4 DPR N 1 1 10 1002 1 1 4 DPR O O 15.052 19.079 12.329 1.00 . A A . 4 DPR O 1 1 10 1003 1 1 5 LYS C C 15.941 20.380 16.043 1.00 . A A . 5 LYS C 1 1 10 1004 1 1 5 LYS CA C 15.002 19.679 15.064 1.00 . A A . 5 LYS CA 1 1 10 1005 1 1 5 LYS CB C 13.777 19.170 15.813 1.00 . A A . 5 LYS CB 1 1 10 1006 1 1 5 LYS CD C 11.254 18.571 15.831 1.00 . A A . 5 LYS CD 1 1 10 1007 1 1 5 LYS CE C 10.695 19.596 16.809 1.00 . A A . 5 LYS CE 1 1 10 1008 1 1 5 LYS CG C 12.445 19.111 15.054 1.00 . A A . 5 LYS CG 1 1 10 1009 1 1 5 LYS H H 15.777 17.704 14.973 1.00 . A A . 5 LYS H 1 1 10 1010 1 1 5 LYS HA H 14.669 20.435 14.351 1.00 . A A . 5 LYS HA 1 1 10 1011 1 1 5 LYS HB2 H 13.959 18.111 16.024 1.00 . A A . 5 LYS HB2 1 1 10 1012 1 1 5 LYS HB3 H 13.667 19.772 16.713 1.00 . A A . 5 LYS HB3 1 1 10 1013 1 1 5 LYS HD2 H 10.528 18.294 15.062 1.00 . A A . 5 LYS HD2 1 1 10 1014 1 1 5 LYS HD3 H 11.500 17.697 16.438 1.00 . A A . 5 LYS HD3 1 1 10 1015 1 1 5 LYS HE2 H 11.415 19.732 17.613 1.00 . A A . 5 LYS HE2 1 1 10 1016 1 1 5 LYS HE3 H 10.488 20.486 16.205 1.00 . A A . 5 LYS HE3 1 1 10 1017 1 1 5 LYS HG2 H 12.174 20.146 14.843 1.00 . A A . 5 LYS HG2 1 1 10 1018 1 1 5 LYS HG3 H 12.556 18.576 14.122 1.00 . A A . 5 LYS HG3 1 1 10 1019 1 1 5 LYS HZ1 H 8.976 19.948 17.962 1.00 . A A . 5 LYS HZ1 1 1 10 1020 1 1 5 LYS HZ2 H 9.297 18.394 17.845 1.00 . A A . 5 LYS HZ2 1 1 10 1021 1 1 5 LYS HZ3 H 8.689 19.149 16.579 1.00 . A A . 5 LYS HZ3 1 1 10 1022 1 1 5 LYS N N 15.565 18.513 14.411 1.00 . A A . 5 LYS N 1 1 10 1023 1 1 5 LYS NZ N 9.359 19.256 17.330 1.00 . A A . 5 LYS NZ 1 1 10 1024 1 1 5 LYS O O 15.759 21.552 16.340 1.00 . A A . 5 LYS O 1 1 10 1025 1 1 6 DTH C C 18.382 19.187 18.562 1.00 . A A . 6 DTH C 1 1 10 1026 1 1 6 DTH CA C 18.002 20.162 17.452 1.00 . A A . 6 DTH CA 1 1 10 1027 1 1 6 DTH CB C 19.254 20.520 16.653 1.00 . A A . 6 DTH CB 1 1 10 1028 1 1 6 DTH CG2 C 19.824 19.375 15.834 1.00 . A A . 6 DTH CG2 1 1 10 1029 1 1 6 DTH H H 16.924 18.671 16.528 1.00 . A A . 6 DTH H 1 1 10 1030 1 1 6 DTH HA H 17.700 21.084 17.957 1.00 . A A . 6 DTH HA 1 1 10 1031 1 1 6 DTH HB H 20.083 20.879 17.269 1.00 . A A . 6 DTH HB 1 1 10 1032 1 1 6 DTH HG1 H 19.453 22.226 15.945 1.00 . A A . 6 DTH HG1 1 1 10 1033 1 1 6 DTH HG21 H 20.465 18.779 16.474 1.00 . A A . 6 DTH HG21 1 1 10 1034 1 1 6 DTH HG22 H 20.436 19.765 15.017 1.00 . A A . 6 DTH HG22 1 1 10 1035 1 1 6 DTH HG23 H 19.081 18.705 15.412 1.00 . A A . 6 DTH HG23 1 1 10 1036 1 1 6 DTH N N 16.897 19.673 16.643 1.00 . A A . 6 DTH N 1 1 10 1037 1 1 6 DTH O O 18.614 18.007 18.292 1.00 . A A . 6 DTH O 1 1 10 1038 1 1 6 DTH OG1 O 18.968 21.451 15.637 1.00 . A A . 6 DTH OG1 1 1 10 1039 1 1 7 . C C 18.348 17.756 21.356 1.00 . A A . 7 DAS C 1 1 10 1040 1 1 7 . CA C 19.136 18.986 20.922 1.00 . A A . 7 DAS CA 1 1 10 1041 1 1 7 . CB C 20.648 18.810 20.793 1.00 . A A . 7 DAS CB 1 1 10 1042 1 1 7 . CG C 21.443 20.089 20.552 1.00 . A A . 7 DAS CG 1 1 10 1043 1 1 7 . H H 18.356 20.652 19.872 1.00 . A A . 7 DAS H 1 1 10 1044 1 1 7 . HA H 19.023 19.658 21.779 1.00 . A A . 7 DAS HA 1 1 10 1045 1 1 7 . HB2 H 20.894 18.167 19.945 1.00 . A A . 7 DAS HB2 1 1 10 1046 1 1 7 . HB3 H 21.043 18.367 21.700 1.00 . A A . 7 DAS HB3 1 1 10 1047 1 1 7 . N N 18.528 19.663 19.802 1.00 . A A . 7 DAS N 1 1 10 1048 1 1 7 . O O 17.177 17.871 21.706 1.00 . A A . 7 DAS O 1 1 10 1049 1 1 7 . OD1 O 22.506 19.949 19.914 1.00 . A A . 7 DAS OD1 1 1 10 1050 1 1 7 . OD2 O 21.141 21.216 21.002 1.00 . A A . 7 DAS OD2 1 1 11 1051 1 1 1 GLN C C 17.089 15.023 20.571 1.00 . A A . 1 GLN C 1 1 11 1052 1 1 1 GLN CA C 18.394 15.234 21.315 1.00 . A A . 1 GLN CA 1 1 11 1053 1 1 1 GLN CB C 18.360 14.812 22.782 1.00 . A A . 1 GLN CB 1 1 11 1054 1 1 1 GLN CD C 20.751 13.894 23.007 1.00 . A A . 1 GLN CD 1 1 11 1055 1 1 1 GLN CG C 19.704 14.876 23.507 1.00 . A A . 1 GLN CG 1 1 11 1056 1 1 1 GLN H1 H 19.827 16.509 20.659 1.00 . A A . 1 GLN H1 1 1 11 1057 1 1 1 GLN HA H 19.147 14.629 20.816 1.00 . A A . 1 GLN HA 1 1 11 1058 1 1 1 GLN HB2 H 17.688 15.467 23.331 1.00 . A A . 1 GLN HB2 1 1 11 1059 1 1 1 GLN HB3 H 17.987 13.798 22.885 1.00 . A A . 1 GLN HB3 1 1 11 1060 1 1 1 GLN HE21 H 22.131 15.312 23.080 1.00 . A A . 1 GLN HE21 1 1 11 1061 1 1 1 GLN HE22 H 22.733 13.748 22.462 1.00 . A A . 1 GLN HE22 1 1 11 1062 1 1 1 GLN HG2 H 20.007 15.912 23.378 1.00 . A A . 1 GLN HG2 1 1 11 1063 1 1 1 GLN HG3 H 19.571 14.785 24.582 1.00 . A A . 1 GLN HG3 1 1 11 1064 1 1 1 GLN N N 18.946 16.575 21.148 1.00 . A A . 1 GLN N 1 1 11 1065 1 1 1 GLN NE2 N 22.014 14.327 22.877 1.00 . A A . 1 GLN NE2 1 1 11 1066 1 1 1 GLN O O 16.304 14.142 20.892 1.00 . A A . 1 GLN O 1 1 11 1067 1 1 1 GLN OE1 O 20.485 12.784 22.539 1.00 . A A . 1 GLN OE1 1 1 11 1068 1 1 2 ASP C C 15.914 15.760 17.301 1.00 . A A . 2 ASP C 1 1 11 1069 1 1 2 ASP CA C 15.578 15.772 18.787 1.00 . A A . 2 ASP CA 1 1 11 1070 1 1 2 ASP CB C 14.710 16.979 19.110 1.00 . A A . 2 ASP CB 1 1 11 1071 1 1 2 ASP CG C 13.276 17.080 18.589 1.00 . A A . 2 ASP CG 1 1 11 1072 1 1 2 ASP H H 17.478 16.549 19.291 1.00 . A A . 2 ASP H 1 1 11 1073 1 1 2 ASP HA H 14.913 14.941 19.004 1.00 . A A . 2 ASP HA 1 1 11 1074 1 1 2 ASP HB2 H 14.616 16.939 20.197 1.00 . A A . 2 ASP HB2 1 1 11 1075 1 1 2 ASP HB3 H 15.230 17.920 18.960 1.00 . A A . 2 ASP HB3 1 1 11 1076 1 1 2 ASP N N 16.837 15.801 19.510 1.00 . A A . 2 ASP N 1 1 11 1077 1 1 2 ASP O O 15.808 16.795 16.658 1.00 . A A . 2 ASP O 1 1 11 1078 1 1 2 ASP OD1 O 12.749 16.233 17.853 1.00 . A A . 2 ASP OD1 1 1 11 1079 1 1 2 ASP OD2 O 12.505 17.936 19.082 1.00 . A A . 2 ASP OD2 1 1 11 1080 1 1 3 PRO C C 16.171 15.397 14.359 1.00 . A A . 3 PRO C 1 1 11 1081 1 1 3 PRO CA C 16.968 14.656 15.420 1.00 . A A . 3 PRO CA 1 1 11 1082 1 1 3 PRO CB C 17.259 13.202 15.043 1.00 . A A . 3 PRO CB 1 1 11 1083 1 1 3 PRO CD C 16.260 13.305 17.278 1.00 . A A . 3 PRO CD 1 1 11 1084 1 1 3 PRO CG C 17.147 12.456 16.367 1.00 . A A . 3 PRO CG 1 1 11 1085 1 1 3 PRO HA H 17.908 15.173 15.626 1.00 . A A . 3 PRO HA 1 1 11 1086 1 1 3 PRO HB2 H 16.451 12.801 14.431 1.00 . A A . 3 PRO HB2 1 1 11 1087 1 1 3 PRO HB3 H 18.203 13.163 14.496 1.00 . A A . 3 PRO HB3 1 1 11 1088 1 1 3 PRO HD2 H 15.231 12.935 17.204 1.00 . A A . 3 PRO HD2 1 1 11 1089 1 1 3 PRO HD3 H 16.629 13.269 18.296 1.00 . A A . 3 PRO HD3 1 1 11 1090 1 1 3 PRO HG2 H 16.683 11.487 16.208 1.00 . A A . 3 PRO HG2 1 1 11 1091 1 1 3 PRO HG3 H 18.116 12.375 16.855 1.00 . A A . 3 PRO HG3 1 1 11 1092 1 1 3 PRO N N 16.290 14.632 16.697 1.00 . A A . 3 PRO N 1 1 11 1093 1 1 3 PRO O O 14.948 15.281 14.374 1.00 . A A . 3 PRO O 1 1 11 1094 1 1 4 DPR C C 15.469 18.260 13.043 1.00 . A A . 4 DPR C 1 1 11 1095 1 1 4 DPR CA C 16.070 16.960 12.515 1.00 . A A . 4 DPR CA 1 1 11 1096 1 1 4 DPR CB C 17.137 17.236 11.464 1.00 . A A . 4 DPR CB 1 1 11 1097 1 1 4 DPR CD C 18.242 16.308 13.329 1.00 . A A . 4 DPR CD 1 1 11 1098 1 1 4 DPR CG C 18.422 17.389 12.264 1.00 . A A . 4 DPR CG 1 1 11 1099 1 1 4 DPR HA H 15.283 16.369 12.053 1.00 . A A . 4 DPR HA 1 1 11 1100 1 1 4 DPR HB2 H 16.851 18.148 10.927 1.00 . A A . 4 DPR HB2 1 1 11 1101 1 1 4 DPR HB3 H 17.141 16.334 10.850 1.00 . A A . 4 DPR HB3 1 1 11 1102 1 1 4 DPR HD2 H 18.565 16.610 14.319 1.00 . A A . 4 DPR HD2 1 1 11 1103 1 1 4 DPR HD3 H 18.586 15.353 12.954 1.00 . A A . 4 DPR HD3 1 1 11 1104 1 1 4 DPR HG2 H 18.428 18.360 12.753 1.00 . A A . 4 DPR HG2 1 1 11 1105 1 1 4 DPR HG3 H 19.327 17.174 11.685 1.00 . A A . 4 DPR HG3 1 1 11 1106 1 1 4 DPR N N 16.807 16.178 13.487 1.00 . A A . 4 DPR N 1 1 11 1107 1 1 4 DPR O O 15.344 19.261 12.355 1.00 . A A . 4 DPR O 1 1 11 1108 1 1 5 LYS C C 15.899 20.161 16.052 1.00 . A A . 5 LYS C 1 1 11 1109 1 1 5 LYS CA C 14.837 19.591 15.123 1.00 . A A . 5 LYS CA 1 1 11 1110 1 1 5 LYS CB C 13.490 19.279 15.770 1.00 . A A . 5 LYS CB 1 1 11 1111 1 1 5 LYS CD C 11.143 18.422 15.376 1.00 . A A . 5 LYS CD 1 1 11 1112 1 1 5 LYS CE C 10.519 19.135 16.575 1.00 . A A . 5 LYS CE 1 1 11 1113 1 1 5 LYS CG C 12.313 19.227 14.807 1.00 . A A . 5 LYS CG 1 1 11 1114 1 1 5 LYS H H 15.544 17.602 14.826 1.00 . A A . 5 LYS H 1 1 11 1115 1 1 5 LYS HA H 14.669 20.421 14.449 1.00 . A A . 5 LYS HA 1 1 11 1116 1 1 5 LYS HB2 H 13.641 18.292 16.225 1.00 . A A . 5 LYS HB2 1 1 11 1117 1 1 5 LYS HB3 H 13.240 19.931 16.610 1.00 . A A . 5 LYS HB3 1 1 11 1118 1 1 5 LYS HD2 H 10.367 18.337 14.616 1.00 . A A . 5 LYS HD2 1 1 11 1119 1 1 5 LYS HD3 H 11.457 17.420 15.663 1.00 . A A . 5 LYS HD3 1 1 11 1120 1 1 5 LYS HE2 H 11.129 19.917 17.006 1.00 . A A . 5 LYS HE2 1 1 11 1121 1 1 5 LYS HE3 H 9.641 19.669 16.217 1.00 . A A . 5 LYS HE3 1 1 11 1122 1 1 5 LYS HG2 H 11.977 20.250 14.598 1.00 . A A . 5 LYS HG2 1 1 11 1123 1 1 5 LYS HG3 H 12.596 18.833 13.827 1.00 . A A . 5 LYS HG3 1 1 11 1124 1 1 5 LYS HZ1 H 9.693 17.387 17.197 1.00 . A A . 5 LYS HZ1 1 1 11 1125 1 1 5 LYS HZ2 H 9.594 18.633 18.313 1.00 . A A . 5 LYS HZ2 1 1 11 1126 1 1 5 LYS HZ3 H 11.029 17.838 18.035 1.00 . A A . 5 LYS HZ3 1 1 11 1127 1 1 5 LYS N N 15.218 18.427 14.346 1.00 . A A . 5 LYS N 1 1 11 1128 1 1 5 LYS NZ N 10.170 18.174 17.630 1.00 . A A . 5 LYS NZ 1 1 11 1129 1 1 5 LYS O O 15.813 21.375 16.221 1.00 . A A . 5 LYS O 1 1 11 1130 1 1 6 DTH C C 18.365 19.050 18.550 1.00 . A A . 6 DTH C 1 1 11 1131 1 1 6 DTH CA C 17.969 19.935 17.380 1.00 . A A . 6 DTH CA 1 1 11 1132 1 1 6 DTH CB C 19.287 20.227 16.672 1.00 . A A . 6 DTH CB 1 1 11 1133 1 1 6 DTH CG2 C 19.836 19.076 15.841 1.00 . A A . 6 DTH CG2 1 1 11 1134 1 1 6 DTH H H 16.818 18.425 16.390 1.00 . A A . 6 DTH H 1 1 11 1135 1 1 6 DTH HA H 17.725 20.935 17.742 1.00 . A A . 6 DTH HA 1 1 11 1136 1 1 6 DTH HB H 20.020 20.462 17.441 1.00 . A A . 6 DTH HB 1 1 11 1137 1 1 6 DTH HG1 H 19.033 22.105 16.135 1.00 . A A . 6 DTH HG1 1 1 11 1138 1 1 6 DTH HG21 H 19.292 18.964 14.910 1.00 . A A . 6 DTH HG21 1 1 11 1139 1 1 6 DTH HG22 H 19.852 18.170 16.450 1.00 . A A . 6 DTH HG22 1 1 11 1140 1 1 6 DTH HG23 H 20.852 19.370 15.562 1.00 . A A . 6 DTH HG23 1 1 11 1141 1 1 6 DTH N N 16.860 19.409 16.598 1.00 . A A . 6 DTH N 1 1 11 1142 1 1 6 DTH O O 18.395 17.837 18.335 1.00 . A A . 6 DTH O 1 1 11 1143 1 1 6 DTH OG1 O 19.215 21.263 15.714 1.00 . A A . 6 DTH OG1 1 1 11 1144 1 1 7 . C C 18.476 17.796 21.416 1.00 . A A . 7 DAS C 1 1 11 1145 1 1 7 . CA C 19.243 18.971 20.841 1.00 . A A . 7 DAS CA 1 1 11 1146 1 1 7 . CB C 20.723 18.845 20.514 1.00 . A A . 7 DAS CB 1 1 11 1147 1 1 7 . CG C 21.416 20.169 20.230 1.00 . A A . 7 DAS CG 1 1 11 1148 1 1 7 . H H 18.349 20.607 19.816 1.00 . A A . 7 DAS H 1 1 11 1149 1 1 7 . HA H 19.195 19.705 21.645 1.00 . A A . 7 DAS HA 1 1 11 1150 1 1 7 . HB2 H 20.875 18.181 19.660 1.00 . A A . 7 DAS HB2 1 1 11 1151 1 1 7 . HB3 H 21.158 18.370 21.396 1.00 . A A . 7 DAS HB3 1 1 11 1152 1 1 7 . N N 18.572 19.636 19.729 1.00 . A A . 7 DAS N 1 1 11 1153 1 1 7 . O O 17.424 17.908 22.040 1.00 . A A . 7 DAS O 1 1 11 1154 1 1 7 . OD1 O 22.441 20.191 19.519 1.00 . A A . 7 DAS OD1 1 1 11 1155 1 1 7 . OD2 O 20.932 21.230 20.690 1.00 . A A . 7 DAS OD2 1 1 12 1156 1 1 1 GLN C C 17.005 14.999 20.827 1.00 . A A . 1 GLN C 1 1 12 1157 1 1 1 GLN CA C 18.376 15.278 21.445 1.00 . A A . 1 GLN CA 1 1 12 1158 1 1 1 GLN CB C 18.444 15.211 22.970 1.00 . A A . 1 GLN CB 1 1 12 1159 1 1 1 GLN CD C 20.974 14.708 23.370 1.00 . A A . 1 GLN CD 1 1 12 1160 1 1 1 GLN CG C 19.775 15.623 23.583 1.00 . A A . 1 GLN CG 1 1 12 1161 1 1 1 GLN H1 H 19.834 16.522 20.471 1.00 . A A . 1 GLN H1 1 1 12 1162 1 1 1 GLN HA H 19.072 14.532 21.075 1.00 . A A . 1 GLN HA 1 1 12 1163 1 1 1 GLN HB2 H 17.693 15.892 23.360 1.00 . A A . 1 GLN HB2 1 1 12 1164 1 1 1 GLN HB3 H 18.137 14.229 23.336 1.00 . A A . 1 GLN HB3 1 1 12 1165 1 1 1 GLN HE21 H 22.364 16.228 23.501 1.00 . A A . 1 GLN HE21 1 1 12 1166 1 1 1 GLN HE22 H 22.881 14.541 23.255 1.00 . A A . 1 GLN HE22 1 1 12 1167 1 1 1 GLN HG2 H 20.116 16.553 23.140 1.00 . A A . 1 GLN HG2 1 1 12 1168 1 1 1 GLN HG3 H 19.682 15.845 24.649 1.00 . A A . 1 GLN HG3 1 1 12 1169 1 1 1 GLN N N 18.968 16.521 20.999 1.00 . A A . 1 GLN N 1 1 12 1170 1 1 1 GLN NE2 N 22.186 15.230 23.497 1.00 . A A . 1 GLN NE2 1 1 12 1171 1 1 1 GLN O O 16.139 14.313 21.361 1.00 . A A . 1 GLN O 1 1 12 1172 1 1 1 GLN OE1 O 20.916 13.507 23.107 1.00 . A A . 1 GLN OE1 1 1 12 1173 1 1 2 ASP C C 15.980 15.738 17.329 1.00 . A A . 2 ASP C 1 1 12 1174 1 1 2 ASP CA C 15.596 15.648 18.792 1.00 . A A . 2 ASP CA 1 1 12 1175 1 1 2 ASP CB C 14.848 16.869 19.298 1.00 . A A . 2 ASP CB 1 1 12 1176 1 1 2 ASP CG C 13.458 17.188 18.757 1.00 . A A . 2 ASP CG 1 1 12 1177 1 1 2 ASP H H 17.525 16.154 19.304 1.00 . A A . 2 ASP H 1 1 12 1178 1 1 2 ASP HA H 15.056 14.726 19.017 1.00 . A A . 2 ASP HA 1 1 12 1179 1 1 2 ASP HB2 H 14.735 16.810 20.376 1.00 . A A . 2 ASP HB2 1 1 12 1180 1 1 2 ASP HB3 H 15.468 17.737 19.095 1.00 . A A . 2 ASP HB3 1 1 12 1181 1 1 2 ASP N N 16.760 15.598 19.658 1.00 . A A . 2 ASP N 1 1 12 1182 1 1 2 ASP O O 15.870 16.788 16.687 1.00 . A A . 2 ASP O 1 1 12 1183 1 1 2 ASP OD1 O 12.897 16.289 18.104 1.00 . A A . 2 ASP OD1 1 1 12 1184 1 1 2 ASP OD2 O 12.924 18.284 19.041 1.00 . A A . 2 ASP OD2 1 1 12 1185 1 1 3 PRO C C 15.994 15.368 14.386 1.00 . A A . 3 PRO C 1 1 12 1186 1 1 3 PRO CA C 16.927 14.728 15.403 1.00 . A A . 3 PRO CA 1 1 12 1187 1 1 3 PRO CB C 17.201 13.275 15.018 1.00 . A A . 3 PRO CB 1 1 12 1188 1 1 3 PRO CD C 16.472 13.270 17.277 1.00 . A A . 3 PRO CD 1 1 12 1189 1 1 3 PRO CG C 17.398 12.505 16.325 1.00 . A A . 3 PRO CG 1 1 12 1190 1 1 3 PRO HA H 17.855 15.298 15.426 1.00 . A A . 3 PRO HA 1 1 12 1191 1 1 3 PRO HB2 H 16.337 12.851 14.509 1.00 . A A . 3 PRO HB2 1 1 12 1192 1 1 3 PRO HB3 H 18.022 13.174 14.299 1.00 . A A . 3 PRO HB3 1 1 12 1193 1 1 3 PRO HD2 H 15.455 12.904 17.144 1.00 . A A . 3 PRO HD2 1 1 12 1194 1 1 3 PRO HD3 H 16.749 13.320 18.329 1.00 . A A . 3 PRO HD3 1 1 12 1195 1 1 3 PRO HG2 H 17.126 11.459 16.204 1.00 . A A . 3 PRO HG2 1 1 12 1196 1 1 3 PRO HG3 H 18.412 12.639 16.713 1.00 . A A . 3 PRO HG3 1 1 12 1197 1 1 3 PRO N N 16.397 14.613 16.748 1.00 . A A . 3 PRO N 1 1 12 1198 1 1 3 PRO O O 14.788 15.291 14.582 1.00 . A A . 3 PRO O 1 1 12 1199 1 1 4 DPR C C 15.521 18.244 13.029 1.00 . A A . 4 DPR C 1 1 12 1200 1 1 4 DPR CA C 15.993 16.938 12.405 1.00 . A A . 4 DPR CA 1 1 12 1201 1 1 4 DPR CB C 17.090 17.393 11.450 1.00 . A A . 4 DPR CB 1 1 12 1202 1 1 4 DPR CD C 17.902 15.779 12.845 1.00 . A A . 4 DPR CD 1 1 12 1203 1 1 4 DPR CG C 17.923 16.117 11.364 1.00 . A A . 4 DPR CG 1 1 12 1204 1 1 4 DPR HA H 15.172 16.476 11.856 1.00 . A A . 4 DPR HA 1 1 12 1205 1 1 4 DPR HB2 H 17.570 18.221 11.971 1.00 . A A . 4 DPR HB2 1 1 12 1206 1 1 4 DPR HB3 H 16.769 17.685 10.444 1.00 . A A . 4 DPR HB3 1 1 12 1207 1 1 4 DPR HD2 H 18.546 16.511 13.341 1.00 . A A . 4 DPR HD2 1 1 12 1208 1 1 4 DPR HD3 H 18.251 14.763 13.006 1.00 . A A . 4 DPR HD3 1 1 12 1209 1 1 4 DPR HG2 H 18.934 16.354 11.035 1.00 . A A . 4 DPR HG2 1 1 12 1210 1 1 4 DPR HG3 H 17.542 15.309 10.740 1.00 . A A . 4 DPR HG3 1 1 12 1211 1 1 4 DPR N N 16.559 16.004 13.355 1.00 . A A . 4 DPR N 1 1 12 1212 1 1 4 DPR O O 15.181 19.179 12.306 1.00 . A A . 4 DPR O 1 1 12 1213 1 1 5 LYS C C 15.801 20.167 16.115 1.00 . A A . 5 LYS C 1 1 12 1214 1 1 5 LYS CA C 14.946 19.585 14.994 1.00 . A A . 5 LYS CA 1 1 12 1215 1 1 5 LYS CB C 13.612 19.243 15.662 1.00 . A A . 5 LYS CB 1 1 12 1216 1 1 5 LYS CD C 11.212 18.552 15.165 1.00 . A A . 5 LYS CD 1 1 12 1217 1 1 5 LYS CE C 10.686 18.609 16.592 1.00 . A A . 5 LYS CE 1 1 12 1218 1 1 5 LYS CG C 12.689 18.305 14.883 1.00 . A A . 5 LYS CG 1 1 12 1219 1 1 5 LYS H H 15.795 17.655 14.937 1.00 . A A . 5 LYS H 1 1 12 1220 1 1 5 LYS HA H 14.736 20.380 14.279 1.00 . A A . 5 LYS HA 1 1 12 1221 1 1 5 LYS HB2 H 13.865 18.788 16.615 1.00 . A A . 5 LYS HB2 1 1 12 1222 1 1 5 LYS HB3 H 13.050 20.167 15.764 1.00 . A A . 5 LYS HB3 1 1 12 1223 1 1 5 LYS HD2 H 11.022 19.517 14.690 1.00 . A A . 5 LYS HD2 1 1 12 1224 1 1 5 LYS HD3 H 10.696 17.729 14.662 1.00 . A A . 5 LYS HD3 1 1 12 1225 1 1 5 LYS HE2 H 11.246 19.294 17.232 1.00 . A A . 5 LYS HE2 1 1 12 1226 1 1 5 LYS HE3 H 9.715 19.064 16.419 1.00 . A A . 5 LYS HE3 1 1 12 1227 1 1 5 LYS HG2 H 12.884 18.388 13.809 1.00 . A A . 5 LYS HG2 1 1 12 1228 1 1 5 LYS HG3 H 12.904 17.268 15.120 1.00 . A A . 5 LYS HG3 1 1 12 1229 1 1 5 LYS HZ1 H 10.012 16.712 16.537 1.00 . A A . 5 LYS HZ1 1 1 12 1230 1 1 5 LYS HZ2 H 9.776 17.312 17.956 1.00 . A A . 5 LYS HZ2 1 1 12 1231 1 1 5 LYS HZ3 H 11.374 16.925 17.519 1.00 . A A . 5 LYS HZ3 1 1 12 1232 1 1 5 LYS N N 15.552 18.438 14.349 1.00 . A A . 5 LYS N 1 1 12 1233 1 1 5 LYS NZ N 10.477 17.288 17.220 1.00 . A A . 5 LYS NZ 1 1 12 1234 1 1 5 LYS O O 15.573 21.341 16.392 1.00 . A A . 5 LYS O 1 1 12 1235 1 1 6 DTH C C 18.323 19.046 18.591 1.00 . A A . 6 DTH C 1 1 12 1236 1 1 6 DTH CA C 17.835 19.999 17.514 1.00 . A A . 6 DTH CA 1 1 12 1237 1 1 6 DTH CB C 19.059 20.325 16.656 1.00 . A A . 6 DTH CB 1 1 12 1238 1 1 6 DTH CG2 C 19.433 19.311 15.564 1.00 . A A . 6 DTH CG2 1 1 12 1239 1 1 6 DTH H H 16.798 18.457 16.611 1.00 . A A . 6 DTH H 1 1 12 1240 1 1 6 DTH HA H 17.458 20.880 18.033 1.00 . A A . 6 DTH HA 1 1 12 1241 1 1 6 DTH HB H 19.873 20.395 17.376 1.00 . A A . 6 DTH HB 1 1 12 1242 1 1 6 DTH HG1 H 19.677 21.715 15.620 1.00 . A A . 6 DTH HG1 1 1 12 1243 1 1 6 DTH HG21 H 19.414 18.248 15.780 1.00 . A A . 6 DTH HG21 1 1 12 1244 1 1 6 DTH HG22 H 20.449 19.597 15.306 1.00 . A A . 6 DTH HG22 1 1 12 1245 1 1 6 DTH HG23 H 18.721 19.362 14.741 1.00 . A A . 6 DTH HG23 1 1 12 1246 1 1 6 DTH N N 16.728 19.450 16.753 1.00 . A A . 6 DTH N 1 1 12 1247 1 1 6 DTH O O 18.234 17.828 18.410 1.00 . A A . 6 DTH O 1 1 12 1248 1 1 6 DTH OG1 O 18.803 21.508 15.949 1.00 . A A . 6 DTH OG1 1 1 12 1249 1 1 7 . C C 18.493 17.762 21.176 1.00 . A A . 7 DAS C 1 1 12 1250 1 1 7 . CA C 19.387 18.944 20.827 1.00 . A A . 7 DAS CA 1 1 12 1251 1 1 7 . CB C 20.855 18.525 20.698 1.00 . A A . 7 DAS CB 1 1 12 1252 1 1 7 . CG C 21.753 19.686 20.338 1.00 . A A . 7 DAS CG 1 1 12 1253 1 1 7 . H H 19.005 20.623 19.724 1.00 . A A . 7 DAS H 1 1 12 1254 1 1 7 . HA H 19.331 19.650 21.665 1.00 . A A . 7 DAS HA 1 1 12 1255 1 1 7 . HB2 H 20.943 17.827 19.855 1.00 . A A . 7 DAS HB2 1 1 12 1256 1 1 7 . HB3 H 21.132 18.078 21.650 1.00 . A A . 7 DAS HB3 1 1 12 1257 1 1 7 . N N 18.910 19.619 19.638 1.00 . A A . 7 DAS N 1 1 12 1258 1 1 7 . O O 17.366 17.961 21.609 1.00 . A A . 7 DAS O 1 1 12 1259 1 1 7 . OD1 O 21.364 20.873 20.380 1.00 . A A . 7 DAS OD1 1 1 12 1260 1 1 7 . OD2 O 22.911 19.347 20.014 1.00 . A A . 7 DAS OD2 1 1 13 1261 1 1 1 GLN C C 17.205 14.872 20.646 1.00 . A A . 1 GLN C 1 1 13 1262 1 1 1 GLN CA C 18.462 15.241 21.423 1.00 . A A . 1 GLN CA 1 1 13 1263 1 1 1 GLN CB C 18.135 15.227 22.911 1.00 . A A . 1 GLN CB 1 1 13 1264 1 1 1 GLN CD C 20.200 14.086 23.798 1.00 . A A . 1 GLN CD 1 1 13 1265 1 1 1 GLN CG C 19.343 15.345 23.829 1.00 . A A . 1 GLN CG 1 1 13 1266 1 1 1 GLN H1 H 20.060 16.321 20.724 1.00 . A A . 1 GLN H1 1 1 13 1267 1 1 1 GLN HA H 19.104 14.372 21.242 1.00 . A A . 1 GLN HA 1 1 13 1268 1 1 1 GLN HB2 H 17.320 15.901 23.165 1.00 . A A . 1 GLN HB2 1 1 13 1269 1 1 1 GLN HB3 H 17.798 14.210 23.143 1.00 . A A . 1 GLN HB3 1 1 13 1270 1 1 1 GLN HE21 H 19.499 13.276 25.516 1.00 . A A . 1 GLN HE21 1 1 13 1271 1 1 1 GLN HE22 H 20.607 12.254 24.695 1.00 . A A . 1 GLN HE22 1 1 13 1272 1 1 1 GLN HG2 H 19.942 16.249 23.659 1.00 . A A . 1 GLN HG2 1 1 13 1273 1 1 1 GLN HG3 H 18.895 15.284 24.820 1.00 . A A . 1 GLN HG3 1 1 13 1274 1 1 1 GLN N N 19.118 16.480 21.065 1.00 . A A . 1 GLN N 1 1 13 1275 1 1 1 GLN NE2 N 20.121 13.145 24.740 1.00 . A A . 1 GLN NE2 1 1 13 1276 1 1 1 GLN O O 16.656 13.808 20.920 1.00 . A A . 1 GLN O 1 1 13 1277 1 1 1 GLN OE1 O 20.945 13.918 22.828 1.00 . A A . 1 GLN OE1 1 1 13 1278 1 1 2 ASP C C 15.838 15.686 17.395 1.00 . A A . 2 ASP C 1 1 13 1279 1 1 2 ASP CA C 15.599 15.640 18.896 1.00 . A A . 2 ASP CA 1 1 13 1280 1 1 2 ASP CB C 14.750 16.729 19.551 1.00 . A A . 2 ASP CB 1 1 13 1281 1 1 2 ASP CG C 13.393 16.843 18.865 1.00 . A A . 2 ASP CG 1 1 13 1282 1 1 2 ASP H H 17.503 16.389 19.388 1.00 . A A . 2 ASP H 1 1 13 1283 1 1 2 ASP HA H 15.105 14.690 19.078 1.00 . A A . 2 ASP HA 1 1 13 1284 1 1 2 ASP HB2 H 14.566 16.421 20.582 1.00 . A A . 2 ASP HB2 1 1 13 1285 1 1 2 ASP HB3 H 15.277 17.673 19.521 1.00 . A A . 2 ASP HB3 1 1 13 1286 1 1 2 ASP N N 16.837 15.669 19.645 1.00 . A A . 2 ASP N 1 1 13 1287 1 1 2 ASP O O 15.876 16.779 16.847 1.00 . A A . 2 ASP O 1 1 13 1288 1 1 2 ASP OD1 O 12.805 17.946 18.943 1.00 . A A . 2 ASP OD1 1 1 13 1289 1 1 2 ASP OD2 O 12.853 15.809 18.434 1.00 . A A . 2 ASP OD2 1 1 13 1290 1 1 3 PRO C C 16.076 15.527 14.471 1.00 . A A . 3 PRO C 1 1 13 1291 1 1 3 PRO CA C 16.675 14.514 15.437 1.00 . A A . 3 PRO CA 1 1 13 1292 1 1 3 PRO CB C 16.560 13.072 14.960 1.00 . A A . 3 PRO CB 1 1 13 1293 1 1 3 PRO CD C 16.018 13.151 17.186 1.00 . A A . 3 PRO CD 1 1 13 1294 1 1 3 PRO CG C 16.841 12.287 16.242 1.00 . A A . 3 PRO CG 1 1 13 1295 1 1 3 PRO HA H 17.729 14.769 15.581 1.00 . A A . 3 PRO HA 1 1 13 1296 1 1 3 PRO HB2 H 15.544 12.841 14.632 1.00 . A A . 3 PRO HB2 1 1 13 1297 1 1 3 PRO HB3 H 17.255 12.782 14.166 1.00 . A A . 3 PRO HB3 1 1 13 1298 1 1 3 PRO HD2 H 14.997 12.748 17.193 1.00 . A A . 3 PRO HD2 1 1 13 1299 1 1 3 PRO HD3 H 16.544 13.082 18.132 1.00 . A A . 3 PRO HD3 1 1 13 1300 1 1 3 PRO HG2 H 16.520 11.256 16.113 1.00 . A A . 3 PRO HG2 1 1 13 1301 1 1 3 PRO HG3 H 17.920 12.242 16.365 1.00 . A A . 3 PRO HG3 1 1 13 1302 1 1 3 PRO N N 16.075 14.535 16.760 1.00 . A A . 3 PRO N 1 1 13 1303 1 1 3 PRO O O 14.870 15.749 14.382 1.00 . A A . 3 PRO O 1 1 13 1304 1 1 4 DPR C C 15.743 18.427 13.080 1.00 . A A . 4 DPR C 1 1 13 1305 1 1 4 DPR CA C 16.460 17.158 12.653 1.00 . A A . 4 DPR CA 1 1 13 1306 1 1 4 DPR CB C 17.687 17.475 11.801 1.00 . A A . 4 DPR CB 1 1 13 1307 1 1 4 DPR CD C 18.322 16.041 13.458 1.00 . A A . 4 DPR CD 1 1 13 1308 1 1 4 DPR CG C 18.684 16.333 12.012 1.00 . A A . 4 DPR CG 1 1 13 1309 1 1 4 DPR HA H 15.794 16.577 12.023 1.00 . A A . 4 DPR HA 1 1 13 1310 1 1 4 DPR HB2 H 18.113 18.440 12.067 1.00 . A A . 4 DPR HB2 1 1 13 1311 1 1 4 DPR HB3 H 17.377 17.482 10.756 1.00 . A A . 4 DPR HB3 1 1 13 1312 1 1 4 DPR HD2 H 18.878 16.732 14.103 1.00 . A A . 4 DPR HD2 1 1 13 1313 1 1 4 DPR HD3 H 18.472 14.985 13.682 1.00 . A A . 4 DPR HD3 1 1 13 1314 1 1 4 DPR HG2 H 19.694 16.614 11.728 1.00 . A A . 4 DPR HG2 1 1 13 1315 1 1 4 DPR HG3 H 18.365 15.460 11.445 1.00 . A A . 4 DPR HG3 1 1 13 1316 1 1 4 DPR N N 16.895 16.187 13.645 1.00 . A A . 4 DPR N 1 1 13 1317 1 1 4 DPR O O 15.689 19.352 12.274 1.00 . A A . 4 DPR O 1 1 13 1318 1 1 5 LYS C C 15.589 20.255 16.121 1.00 . A A . 5 LYS C 1 1 13 1319 1 1 5 LYS CA C 14.772 19.643 14.990 1.00 . A A . 5 LYS CA 1 1 13 1320 1 1 5 LYS CB C 13.395 19.194 15.450 1.00 . A A . 5 LYS CB 1 1 13 1321 1 1 5 LYS CD C 10.998 18.868 14.731 1.00 . A A . 5 LYS CD 1 1 13 1322 1 1 5 LYS CE C 10.760 17.850 15.846 1.00 . A A . 5 LYS CE 1 1 13 1323 1 1 5 LYS CG C 12.453 18.960 14.271 1.00 . A A . 5 LYS CG 1 1 13 1324 1 1 5 LYS H H 15.374 17.605 14.799 1.00 . A A . 5 LYS H 1 1 13 1325 1 1 5 LYS HA H 14.706 20.499 14.318 1.00 . A A . 5 LYS HA 1 1 13 1326 1 1 5 LYS HB2 H 13.376 18.296 16.071 1.00 . A A . 5 LYS HB2 1 1 13 1327 1 1 5 LYS HB3 H 12.960 20.048 15.973 1.00 . A A . 5 LYS HB3 1 1 13 1328 1 1 5 LYS HD2 H 10.588 19.829 15.034 1.00 . A A . 5 LYS HD2 1 1 13 1329 1 1 5 LYS HD3 H 10.392 18.597 13.860 1.00 . A A . 5 LYS HD3 1 1 13 1330 1 1 5 LYS HE2 H 11.237 16.886 15.645 1.00 . A A . 5 LYS HE2 1 1 13 1331 1 1 5 LYS HE3 H 11.160 18.260 16.781 1.00 . A A . 5 LYS HE3 1 1 13 1332 1 1 5 LYS HG2 H 12.585 19.741 13.536 1.00 . A A . 5 LYS HG2 1 1 13 1333 1 1 5 LYS HG3 H 12.784 18.086 13.719 1.00 . A A . 5 LYS HG3 1 1 13 1334 1 1 5 LYS HZ1 H 8.999 17.002 15.198 1.00 . A A . 5 LYS HZ1 1 1 13 1335 1 1 5 LYS HZ2 H 8.809 18.303 16.351 1.00 . A A . 5 LYS HZ2 1 1 13 1336 1 1 5 LYS HZ3 H 9.189 16.897 16.774 1.00 . A A . 5 LYS HZ3 1 1 13 1337 1 1 5 LYS N N 15.434 18.514 14.378 1.00 . A A . 5 LYS N 1 1 13 1338 1 1 5 LYS NZ N 9.336 17.512 15.992 1.00 . A A . 5 LYS NZ 1 1 13 1339 1 1 5 LYS O O 15.395 21.399 16.531 1.00 . A A . 5 LYS O 1 1 13 1340 1 1 6 DTH C C 18.351 19.070 18.354 1.00 . A A . 6 DTH C 1 1 13 1341 1 1 6 DTH CA C 17.706 20.034 17.369 1.00 . A A . 6 DTH CA 1 1 13 1342 1 1 6 DTH CB C 18.901 20.489 16.535 1.00 . A A . 6 DTH CB 1 1 13 1343 1 1 6 DTH CG2 C 19.396 19.497 15.503 1.00 . A A . 6 DTH CG2 1 1 13 1344 1 1 6 DTH H H 16.716 18.563 16.227 1.00 . A A . 6 DTH H 1 1 13 1345 1 1 6 DTH HA H 17.390 20.901 17.940 1.00 . A A . 6 DTH HA 1 1 13 1346 1 1 6 DTH HB H 19.747 20.807 17.154 1.00 . A A . 6 DTH HB 1 1 13 1347 1 1 6 DTH HG1 H 18.340 22.351 16.536 1.00 . A A . 6 DTH HG1 1 1 13 1348 1 1 6 DTH HG21 H 19.644 18.553 16.004 1.00 . A A . 6 DTH HG21 1 1 13 1349 1 1 6 DTH HG22 H 20.308 19.930 15.100 1.00 . A A . 6 DTH HG22 1 1 13 1350 1 1 6 DTH HG23 H 18.728 19.363 14.646 1.00 . A A . 6 DTH HG23 1 1 13 1351 1 1 6 DTH N N 16.634 19.527 16.539 1.00 . A A . 6 DTH N 1 1 13 1352 1 1 6 DTH O O 18.444 17.869 18.111 1.00 . A A . 6 DTH O 1 1 13 1353 1 1 6 DTH OG1 O 18.577 21.695 15.874 1.00 . A A . 6 DTH OG1 1 1 13 1354 1 1 7 . C C 18.552 17.691 21.068 1.00 . A A . 7 DAS C 1 1 13 1355 1 1 7 . CA C 19.385 18.889 20.612 1.00 . A A . 7 DAS CA 1 1 13 1356 1 1 7 . CB C 20.826 18.570 20.254 1.00 . A A . 7 DAS CB 1 1 13 1357 1 1 7 . CG C 21.448 19.745 19.525 1.00 . A A . 7 DAS CG 1 1 13 1358 1 1 7 . H H 18.521 20.566 19.675 1.00 . A A . 7 DAS H 1 1 13 1359 1 1 7 . HA H 19.501 19.593 21.437 1.00 . A A . 7 DAS HA 1 1 13 1360 1 1 7 . HB2 H 20.790 17.749 19.535 1.00 . A A . 7 DAS HB2 1 1 13 1361 1 1 7 . HB3 H 21.511 18.259 21.041 1.00 . A A . 7 DAS HB3 1 1 13 1362 1 1 7 . N N 18.726 19.593 19.527 1.00 . A A . 7 DAS N 1 1 13 1363 1 1 7 . O O 17.391 17.933 21.359 1.00 . A A . 7 DAS O 1 1 13 1364 1 1 7 . OD1 O 21.299 20.891 20.002 1.00 . A A . 7 DAS OD1 1 1 13 1365 1 1 7 . OD2 O 22.085 19.589 18.455 1.00 . A A . 7 DAS OD2 1 1 14 1366 1 1 1 GLN C C 17.072 15.072 20.704 1.00 . A A . 1 GLN C 1 1 14 1367 1 1 1 GLN CA C 18.395 15.295 21.401 1.00 . A A . 1 GLN CA 1 1 14 1368 1 1 1 GLN CB C 18.287 15.150 22.927 1.00 . A A . 1 GLN CB 1 1 14 1369 1 1 1 GLN CD C 20.619 14.142 23.302 1.00 . A A . 1 GLN CD 1 1 14 1370 1 1 1 GLN CG C 19.649 15.288 23.588 1.00 . A A . 1 GLN CG 1 1 14 1371 1 1 1 GLN H1 H 19.930 16.389 20.560 1.00 . A A . 1 GLN H1 1 1 14 1372 1 1 1 GLN HA H 19.053 14.486 21.088 1.00 . A A . 1 GLN HA 1 1 14 1373 1 1 1 GLN HB2 H 17.622 15.920 23.314 1.00 . A A . 1 GLN HB2 1 1 14 1374 1 1 1 GLN HB3 H 17.857 14.157 23.011 1.00 . A A . 1 GLN HB3 1 1 14 1375 1 1 1 GLN HE21 H 19.897 12.977 24.857 1.00 . A A . 1 GLN HE21 1 1 14 1376 1 1 1 GLN HE22 H 21.211 12.323 23.936 1.00 . A A . 1 GLN HE22 1 1 14 1377 1 1 1 GLN HG2 H 20.159 16.219 23.344 1.00 . A A . 1 GLN HG2 1 1 14 1378 1 1 1 GLN HG3 H 19.474 15.485 24.648 1.00 . A A . 1 GLN HG3 1 1 14 1379 1 1 1 GLN N N 19.040 16.538 21.015 1.00 . A A . 1 GLN N 1 1 14 1380 1 1 1 GLN NE2 N 20.573 13.084 24.114 1.00 . A A . 1 GLN NE2 1 1 14 1381 1 1 1 GLN O O 16.210 14.345 21.213 1.00 . A A . 1 GLN O 1 1 14 1382 1 1 1 GLN OE1 O 21.415 14.158 22.368 1.00 . A A . 1 GLN OE1 1 1 14 1383 1 1 2 ASP C C 15.788 15.635 17.316 1.00 . A A . 2 ASP C 1 1 14 1384 1 1 2 ASP CA C 15.567 15.615 18.826 1.00 . A A . 2 ASP CA 1 1 14 1385 1 1 2 ASP CB C 14.749 16.816 19.282 1.00 . A A . 2 ASP CB 1 1 14 1386 1 1 2 ASP CG C 13.277 16.639 18.944 1.00 . A A . 2 ASP CG 1 1 14 1387 1 1 2 ASP H H 17.607 16.143 19.161 1.00 . A A . 2 ASP H 1 1 14 1388 1 1 2 ASP HA H 15.060 14.685 19.098 1.00 . A A . 2 ASP HA 1 1 14 1389 1 1 2 ASP HB2 H 14.758 16.870 20.373 1.00 . A A . 2 ASP HB2 1 1 14 1390 1 1 2 ASP HB3 H 15.259 17.703 18.912 1.00 . A A . 2 ASP HB3 1 1 14 1391 1 1 2 ASP N N 16.864 15.534 19.464 1.00 . A A . 2 ASP N 1 1 14 1392 1 1 2 ASP O O 16.009 16.718 16.793 1.00 . A A . 2 ASP O 1 1 14 1393 1 1 2 ASP OD1 O 12.522 17.455 19.514 1.00 . A A . 2 ASP OD1 1 1 14 1394 1 1 2 ASP OD2 O 12.929 15.715 18.173 1.00 . A A . 2 ASP OD2 1 1 14 1395 1 1 3 PRO C C 16.128 15.415 14.319 1.00 . A A . 3 PRO C 1 1 14 1396 1 1 3 PRO CA C 16.712 14.511 15.399 1.00 . A A . 3 PRO CA 1 1 14 1397 1 1 3 PRO CB C 16.644 13.052 14.942 1.00 . A A . 3 PRO CB 1 1 14 1398 1 1 3 PRO CD C 16.070 13.223 17.342 1.00 . A A . 3 PRO CD 1 1 14 1399 1 1 3 PRO CG C 16.583 12.279 16.257 1.00 . A A . 3 PRO CG 1 1 14 1400 1 1 3 PRO HA H 17.749 14.755 15.651 1.00 . A A . 3 PRO HA 1 1 14 1401 1 1 3 PRO HB2 H 15.695 12.922 14.416 1.00 . A A . 3 PRO HB2 1 1 14 1402 1 1 3 PRO HB3 H 17.438 12.792 14.244 1.00 . A A . 3 PRO HB3 1 1 14 1403 1 1 3 PRO HD2 H 15.033 13.017 17.636 1.00 . A A . 3 PRO HD2 1 1 14 1404 1 1 3 PRO HD3 H 16.697 13.214 18.226 1.00 . A A . 3 PRO HD3 1 1 14 1405 1 1 3 PRO HG2 H 15.963 11.388 16.076 1.00 . A A . 3 PRO HG2 1 1 14 1406 1 1 3 PRO HG3 H 17.577 11.972 16.559 1.00 . A A . 3 PRO HG3 1 1 14 1407 1 1 3 PRO N N 15.985 14.496 16.655 1.00 . A A . 3 PRO N 1 1 14 1408 1 1 3 PRO O O 14.923 15.391 14.088 1.00 . A A . 3 PRO O 1 1 14 1409 1 1 4 DPR C C 15.462 18.181 13.163 1.00 . A A . 4 DPR C 1 1 14 1410 1 1 4 DPR CA C 16.378 17.110 12.595 1.00 . A A . 4 DPR CA 1 1 14 1411 1 1 4 DPR CB C 17.577 17.876 12.042 1.00 . A A . 4 DPR CB 1 1 14 1412 1 1 4 DPR CD C 18.365 16.152 13.530 1.00 . A A . 4 DPR CD 1 1 14 1413 1 1 4 DPR CG C 18.845 17.139 12.470 1.00 . A A . 4 DPR CG 1 1 14 1414 1 1 4 DPR HA H 15.918 16.480 11.845 1.00 . A A . 4 DPR HA 1 1 14 1415 1 1 4 DPR HB2 H 17.644 18.849 12.537 1.00 . A A . 4 DPR HB2 1 1 14 1416 1 1 4 DPR HB3 H 17.472 18.159 10.998 1.00 . A A . 4 DPR HB3 1 1 14 1417 1 1 4 DPR HD2 H 18.776 16.391 14.517 1.00 . A A . 4 DPR HD2 1 1 14 1418 1 1 4 DPR HD3 H 18.708 15.154 13.235 1.00 . A A . 4 DPR HD3 1 1 14 1419 1 1 4 DPR HG2 H 19.593 17.792 12.917 1.00 . A A . 4 DPR HG2 1 1 14 1420 1 1 4 DPR HG3 H 19.344 16.539 11.709 1.00 . A A . 4 DPR HG3 1 1 14 1421 1 1 4 DPR N N 16.921 16.207 13.594 1.00 . A A . 4 DPR N 1 1 14 1422 1 1 4 DPR O O 14.823 19.006 12.516 1.00 . A A . 4 DPR O 1 1 14 1423 1 1 5 LYS C C 15.749 20.185 16.155 1.00 . A A . 5 LYS C 1 1 14 1424 1 1 5 LYS CA C 14.814 19.557 15.133 1.00 . A A . 5 LYS CA 1 1 14 1425 1 1 5 LYS CB C 13.536 19.143 15.858 1.00 . A A . 5 LYS CB 1 1 14 1426 1 1 5 LYS CD C 11.870 19.660 14.080 1.00 . A A . 5 LYS CD 1 1 14 1427 1 1 5 LYS CE C 10.667 19.187 13.267 1.00 . A A . 5 LYS CE 1 1 14 1428 1 1 5 LYS CG C 12.403 18.575 15.015 1.00 . A A . 5 LYS CG 1 1 14 1429 1 1 5 LYS H H 15.953 17.785 15.059 1.00 . A A . 5 LYS H 1 1 14 1430 1 1 5 LYS HA H 14.707 20.375 14.419 1.00 . A A . 5 LYS HA 1 1 14 1431 1 1 5 LYS HB2 H 13.805 18.376 16.585 1.00 . A A . 5 LYS HB2 1 1 14 1432 1 1 5 LYS HB3 H 13.222 19.939 16.526 1.00 . A A . 5 LYS HB3 1 1 14 1433 1 1 5 LYS HD2 H 11.539 20.427 14.772 1.00 . A A . 5 LYS HD2 1 1 14 1434 1 1 5 LYS HD3 H 12.639 19.936 13.360 1.00 . A A . 5 LYS HD3 1 1 14 1435 1 1 5 LYS HE2 H 10.964 18.317 12.681 1.00 . A A . 5 LYS HE2 1 1 14 1436 1 1 5 LYS HE3 H 9.897 18.800 13.942 1.00 . A A . 5 LYS HE3 1 1 14 1437 1 1 5 LYS HG2 H 12.777 17.711 14.464 1.00 . A A . 5 LYS HG2 1 1 14 1438 1 1 5 LYS HG3 H 11.620 18.316 15.729 1.00 . A A . 5 LYS HG3 1 1 14 1439 1 1 5 LYS HZ1 H 9.377 19.749 11.782 1.00 . A A . 5 LYS HZ1 1 1 14 1440 1 1 5 LYS HZ2 H 10.754 20.683 11.841 1.00 . A A . 5 LYS HZ2 1 1 14 1441 1 1 5 LYS HZ3 H 9.499 20.864 12.886 1.00 . A A . 5 LYS HZ3 1 1 14 1442 1 1 5 LYS N N 15.425 18.422 14.472 1.00 . A A . 5 LYS N 1 1 14 1443 1 1 5 LYS NZ N 10.053 20.193 12.385 1.00 . A A . 5 LYS NZ 1 1 14 1444 1 1 5 LYS O O 15.527 21.338 16.498 1.00 . A A . 5 LYS O 1 1 14 1445 1 1 6 DTH C C 18.454 19.113 18.367 1.00 . A A . 6 DTH C 1 1 14 1446 1 1 6 DTH CA C 17.814 20.103 17.409 1.00 . A A . 6 DTH CA 1 1 14 1447 1 1 6 DTH CB C 18.946 20.730 16.590 1.00 . A A . 6 DTH CB 1 1 14 1448 1 1 6 DTH CG2 C 19.694 19.789 15.655 1.00 . A A . 6 DTH CG2 1 1 14 1449 1 1 6 DTH H H 17.003 18.511 16.387 1.00 . A A . 6 DTH H 1 1 14 1450 1 1 6 DTH HA H 17.486 20.982 17.976 1.00 . A A . 6 DTH HA 1 1 14 1451 1 1 6 DTH HB H 19.604 21.086 17.381 1.00 . A A . 6 DTH HB 1 1 14 1452 1 1 6 DTH HG1 H 17.921 21.589 15.122 1.00 . A A . 6 DTH HG1 1 1 14 1453 1 1 6 DTH HG21 H 19.915 18.820 16.101 1.00 . A A . 6 DTH HG21 1 1 14 1454 1 1 6 DTH HG22 H 20.638 20.213 15.306 1.00 . A A . 6 DTH HG22 1 1 14 1455 1 1 6 DTH HG23 H 19.065 19.642 14.783 1.00 . A A . 6 DTH HG23 1 1 14 1456 1 1 6 DTH N N 16.786 19.474 16.601 1.00 . A A . 6 DTH N 1 1 14 1457 1 1 6 DTH O O 18.661 17.928 18.111 1.00 . A A . 6 DTH O 1 1 14 1458 1 1 6 DTH OG1 O 18.552 21.835 15.806 1.00 . A A . 6 DTH OG1 1 1 14 1459 1 1 7 . C C 18.493 17.751 21.007 1.00 . A A . 7 DAS C 1 1 14 1460 1 1 7 . CA C 19.380 18.929 20.616 1.00 . A A . 7 DAS CA 1 1 14 1461 1 1 7 . CB C 20.872 18.627 20.727 1.00 . A A . 7 DAS CB 1 1 14 1462 1 1 7 . CG C 21.773 19.850 20.667 1.00 . A A . 7 DAS CG 1 1 14 1463 1 1 7 . H H 18.711 20.676 19.657 1.00 . A A . 7 DAS H 1 1 14 1464 1 1 7 . HA H 19.134 19.567 21.468 1.00 . A A . 7 DAS HA 1 1 14 1465 1 1 7 . HB2 H 21.175 17.943 19.928 1.00 . A A . 7 DAS HB2 1 1 14 1466 1 1 7 . HB3 H 21.026 18.055 21.648 1.00 . A A . 7 DAS HB3 1 1 14 1467 1 1 7 . N N 18.884 19.693 19.490 1.00 . A A . 7 DAS N 1 1 14 1468 1 1 7 . O O 17.373 17.909 21.466 1.00 . A A . 7 DAS O 1 1 14 1469 1 1 7 . OD1 O 23.001 19.702 20.511 1.00 . A A . 7 DAS OD1 1 1 14 1470 1 1 7 . OD2 O 21.269 20.993 20.729 1.00 . A A . 7 DAS OD2 1 1 15 1471 1 1 1 GLN C C 17.308 14.971 20.320 1.00 . A A . 1 GLN C 1 1 15 1472 1 1 1 GLN CA C 18.706 15.285 20.832 1.00 . A A . 1 GLN CA 1 1 15 1473 1 1 1 GLN CB C 19.022 14.728 22.223 1.00 . A A . 1 GLN CB 1 1 15 1474 1 1 1 GLN CD C 21.524 14.309 21.833 1.00 . A A . 1 GLN CD 1 1 15 1475 1 1 1 GLN CG C 20.455 14.968 22.709 1.00 . A A . 1 GLN CG 1 1 15 1476 1 1 1 GLN H1 H 19.830 16.909 19.977 1.00 . A A . 1 GLN H1 1 1 15 1477 1 1 1 GLN HA H 19.370 14.743 20.162 1.00 . A A . 1 GLN HA 1 1 15 1478 1 1 1 GLN HB2 H 18.325 15.211 22.909 1.00 . A A . 1 GLN HB2 1 1 15 1479 1 1 1 GLN HB3 H 18.792 13.661 22.193 1.00 . A A . 1 GLN HB3 1 1 15 1480 1 1 1 GLN HE21 H 22.913 15.797 22.190 1.00 . A A . 1 GLN HE21 1 1 15 1481 1 1 1 GLN HE22 H 23.313 14.652 20.961 1.00 . A A . 1 GLN HE22 1 1 15 1482 1 1 1 GLN HG2 H 20.608 16.041 22.687 1.00 . A A . 1 GLN HG2 1 1 15 1483 1 1 1 GLN HG3 H 20.647 14.605 23.719 1.00 . A A . 1 GLN HG3 1 1 15 1484 1 1 1 GLN N N 19.119 16.655 20.650 1.00 . A A . 1 GLN N 1 1 15 1485 1 1 1 GLN NE2 N 22.629 15.026 21.605 1.00 . A A . 1 GLN NE2 1 1 15 1486 1 1 1 GLN O O 16.800 13.878 20.529 1.00 . A A . 1 GLN O 1 1 15 1487 1 1 1 GLN OE1 O 21.384 13.272 21.209 1.00 . A A . 1 GLN OE1 1 1 15 1488 1 1 2 ASP C C 15.740 15.619 17.342 1.00 . A A . 2 ASP C 1 1 15 1489 1 1 2 ASP CA C 15.495 15.661 18.844 1.00 . A A . 2 ASP CA 1 1 15 1490 1 1 2 ASP CB C 14.536 16.785 19.262 1.00 . A A . 2 ASP CB 1 1 15 1491 1 1 2 ASP CG C 13.191 16.760 18.555 1.00 . A A . 2 ASP CG 1 1 15 1492 1 1 2 ASP H H 17.315 16.697 19.248 1.00 . A A . 2 ASP H 1 1 15 1493 1 1 2 ASP HA H 15.044 14.722 19.145 1.00 . A A . 2 ASP HA 1 1 15 1494 1 1 2 ASP HB2 H 14.384 16.746 20.337 1.00 . A A . 2 ASP HB2 1 1 15 1495 1 1 2 ASP HB3 H 14.987 17.747 19.024 1.00 . A A . 2 ASP HB3 1 1 15 1496 1 1 2 ASP N N 16.760 15.890 19.519 1.00 . A A . 2 ASP N 1 1 15 1497 1 1 2 ASP O O 16.054 16.650 16.763 1.00 . A A . 2 ASP O 1 1 15 1498 1 1 2 ASP OD1 O 12.444 17.759 18.660 1.00 . A A . 2 ASP OD1 1 1 15 1499 1 1 2 ASP OD2 O 12.776 15.708 18.022 1.00 . A A . 2 ASP OD2 1 1 15 1500 1 1 3 PRO C C 15.963 15.344 14.364 1.00 . A A . 3 PRO C 1 1 15 1501 1 1 3 PRO CA C 16.362 14.301 15.395 1.00 . A A . 3 PRO CA 1 1 15 1502 1 1 3 PRO CB C 16.184 12.852 14.972 1.00 . A A . 3 PRO CB 1 1 15 1503 1 1 3 PRO CD C 15.168 13.220 17.150 1.00 . A A . 3 PRO CD 1 1 15 1504 1 1 3 PRO CG C 15.869 12.162 16.295 1.00 . A A . 3 PRO CG 1 1 15 1505 1 1 3 PRO HA H 17.370 14.487 15.756 1.00 . A A . 3 PRO HA 1 1 15 1506 1 1 3 PRO HB2 H 15.347 12.759 14.272 1.00 . A A . 3 PRO HB2 1 1 15 1507 1 1 3 PRO HB3 H 17.049 12.448 14.447 1.00 . A A . 3 PRO HB3 1 1 15 1508 1 1 3 PRO HD2 H 14.087 13.241 16.976 1.00 . A A . 3 PRO HD2 1 1 15 1509 1 1 3 PRO HD3 H 15.507 13.111 18.178 1.00 . A A . 3 PRO HD3 1 1 15 1510 1 1 3 PRO HG2 H 15.227 11.286 16.184 1.00 . A A . 3 PRO HG2 1 1 15 1511 1 1 3 PRO HG3 H 16.766 11.798 16.788 1.00 . A A . 3 PRO HG3 1 1 15 1512 1 1 3 PRO N N 15.639 14.486 16.642 1.00 . A A . 3 PRO N 1 1 15 1513 1 1 3 PRO O O 14.758 15.556 14.253 1.00 . A A . 3 PRO O 1 1 15 1514 1 1 4 DPR C C 15.744 18.198 13.160 1.00 . A A . 4 DPR C 1 1 15 1515 1 1 4 DPR CA C 16.462 16.938 12.724 1.00 . A A . 4 DPR CA 1 1 15 1516 1 1 4 DPR CB C 17.720 17.251 11.919 1.00 . A A . 4 DPR CB 1 1 15 1517 1 1 4 DPR CD C 18.334 15.878 13.763 1.00 . A A . 4 DPR CD 1 1 15 1518 1 1 4 DPR CG C 18.916 16.927 12.805 1.00 . A A . 4 DPR CG 1 1 15 1519 1 1 4 DPR HA H 15.916 16.305 12.017 1.00 . A A . 4 DPR HA 1 1 15 1520 1 1 4 DPR HB2 H 17.697 18.257 11.492 1.00 . A A . 4 DPR HB2 1 1 15 1521 1 1 4 DPR HB3 H 17.750 16.609 11.039 1.00 . A A . 4 DPR HB3 1 1 15 1522 1 1 4 DPR HD2 H 18.757 16.002 14.758 1.00 . A A . 4 DPR HD2 1 1 15 1523 1 1 4 DPR HD3 H 18.528 14.863 13.439 1.00 . A A . 4 DPR HD3 1 1 15 1524 1 1 4 DPR HG2 H 19.171 17.840 13.339 1.00 . A A . 4 DPR HG2 1 1 15 1525 1 1 4 DPR HG3 H 19.765 16.590 12.203 1.00 . A A . 4 DPR HG3 1 1 15 1526 1 1 4 DPR N N 16.910 16.128 13.841 1.00 . A A . 4 DPR N 1 1 15 1527 1 1 4 DPR O O 15.065 18.800 12.327 1.00 . A A . 4 DPR O 1 1 15 1528 1 1 5 LYS C C 15.855 20.355 16.088 1.00 . A A . 5 LYS C 1 1 15 1529 1 1 5 LYS CA C 15.043 19.567 15.070 1.00 . A A . 5 LYS CA 1 1 15 1530 1 1 5 LYS CB C 13.698 19.100 15.632 1.00 . A A . 5 LYS CB 1 1 15 1531 1 1 5 LYS CD C 11.414 18.150 15.194 1.00 . A A . 5 LYS CD 1 1 15 1532 1 1 5 LYS CE C 10.421 17.625 14.152 1.00 . A A . 5 LYS CE 1 1 15 1533 1 1 5 LYS CG C 12.712 18.631 14.561 1.00 . A A . 5 LYS CG 1 1 15 1534 1 1 5 LYS H H 16.221 17.779 15.061 1.00 . A A . 5 LYS H 1 1 15 1535 1 1 5 LYS HA H 14.796 20.216 14.231 1.00 . A A . 5 LYS HA 1 1 15 1536 1 1 5 LYS HB2 H 13.831 18.221 16.262 1.00 . A A . 5 LYS HB2 1 1 15 1537 1 1 5 LYS HB3 H 13.216 19.896 16.201 1.00 . A A . 5 LYS HB3 1 1 15 1538 1 1 5 LYS HD2 H 11.689 17.414 15.950 1.00 . A A . 5 LYS HD2 1 1 15 1539 1 1 5 LYS HD3 H 10.963 18.943 15.790 1.00 . A A . 5 LYS HD3 1 1 15 1540 1 1 5 LYS HE2 H 9.715 17.110 14.795 1.00 . A A . 5 LYS HE2 1 1 15 1541 1 1 5 LYS HE3 H 10.030 18.474 13.579 1.00 . A A . 5 LYS HE3 1 1 15 1542 1 1 5 LYS HG2 H 12.549 19.480 13.887 1.00 . A A . 5 LYS HG2 1 1 15 1543 1 1 5 LYS HG3 H 13.171 17.849 13.967 1.00 . A A . 5 LYS HG3 1 1 15 1544 1 1 5 LYS HZ1 H 11.379 17.012 12.397 1.00 . A A . 5 LYS HZ1 1 1 15 1545 1 1 5 LYS HZ2 H 10.308 15.983 12.946 1.00 . A A . 5 LYS HZ2 1 1 15 1546 1 1 5 LYS HZ3 H 11.728 16.060 13.693 1.00 . A A . 5 LYS HZ3 1 1 15 1547 1 1 5 LYS N N 15.740 18.438 14.476 1.00 . A A . 5 LYS N 1 1 15 1548 1 1 5 LYS NZ N 11.020 16.627 13.259 1.00 . A A . 5 LYS NZ 1 1 15 1549 1 1 5 LYS O O 15.614 21.512 16.419 1.00 . A A . 5 LYS O 1 1 15 1550 1 1 6 DTH C C 18.434 19.261 18.553 1.00 . A A . 6 DTH C 1 1 15 1551 1 1 6 DTH CA C 17.863 20.251 17.547 1.00 . A A . 6 DTH CA 1 1 15 1552 1 1 6 DTH CB C 19.051 20.740 16.721 1.00 . A A . 6 DTH CB 1 1 15 1553 1 1 6 DTH CG2 C 19.824 19.755 15.856 1.00 . A A . 6 DTH CG2 1 1 15 1554 1 1 6 DTH H H 16.892 18.711 16.424 1.00 . A A . 6 DTH H 1 1 15 1555 1 1 6 DTH HA H 17.380 21.057 18.114 1.00 . A A . 6 DTH HA 1 1 15 1556 1 1 6 DTH HB H 19.711 21.208 17.447 1.00 . A A . 6 DTH HB 1 1 15 1557 1 1 6 DTH HG1 H 17.915 22.283 16.410 1.00 . A A . 6 DTH HG1 1 1 15 1558 1 1 6 DTH HG21 H 19.220 19.056 15.290 1.00 . A A . 6 DTH HG21 1 1 15 1559 1 1 6 DTH HG22 H 20.533 19.251 16.506 1.00 . A A . 6 DTH HG22 1 1 15 1560 1 1 6 DTH HG23 H 20.386 20.399 15.175 1.00 . A A . 6 DTH HG23 1 1 15 1561 1 1 6 DTH N N 16.873 19.693 16.649 1.00 . A A . 6 DTH N 1 1 15 1562 1 1 6 DTH O O 18.858 18.131 18.320 1.00 . A A . 6 DTH O 1 1 15 1563 1 1 6 DTH OG1 O 18.544 21.760 15.901 1.00 . A A . 6 DTH OG1 1 1 15 1564 1 1 7 . C C 18.589 17.723 21.261 1.00 . A A . 7 DAS C 1 1 15 1565 1 1 7 . CA C 19.129 19.116 20.969 1.00 . A A . 7 DAS CA 1 1 15 1566 1 1 7 . CB C 20.641 19.270 21.057 1.00 . A A . 7 DAS CB 1 1 15 1567 1 1 7 . CG C 21.286 20.583 20.639 1.00 . A A . 7 DAS CG 1 1 15 1568 1 1 7 . H H 18.301 20.702 19.932 1.00 . A A . 7 DAS H 1 1 15 1569 1 1 7 . HA H 18.686 19.569 21.856 1.00 . A A . 7 DAS HA 1 1 15 1570 1 1 7 . HB2 H 21.120 18.466 20.499 1.00 . A A . 7 DAS HB2 1 1 15 1571 1 1 7 . HB3 H 20.792 19.038 22.114 1.00 . A A . 7 DAS HB3 1 1 15 1572 1 1 7 . N N 18.558 19.736 19.790 1.00 . A A . 7 DAS N 1 1 15 1573 1 1 7 . O O 17.670 17.671 22.076 1.00 . A A . 7 DAS O 1 1 15 1574 1 1 7 . OD1 O 21.387 20.835 19.421 1.00 . A A . 7 DAS OD1 1 1 15 1575 1 1 7 . OD2 O 21.672 21.351 21.548 1.00 . A A . 7 DAS OD2 1 1 16 1576 1 1 1 GLN C C 17.059 15.212 20.722 1.00 . A A . 1 GLN C 1 1 16 1577 1 1 1 GLN CA C 18.524 15.291 21.154 1.00 . A A . 1 GLN CA 1 1 16 1578 1 1 1 GLN CB C 18.764 14.965 22.629 1.00 . A A . 1 GLN CB 1 1 16 1579 1 1 1 GLN CD C 20.494 14.723 24.476 1.00 . A A . 1 GLN CD 1 1 16 1580 1 1 1 GLN CG C 20.246 14.911 22.983 1.00 . A A . 1 GLN CG 1 1 16 1581 1 1 1 GLN H1 H 20.145 16.495 20.680 1.00 . A A . 1 GLN H1 1 1 16 1582 1 1 1 GLN HA H 19.036 14.523 20.576 1.00 . A A . 1 GLN HA 1 1 16 1583 1 1 1 GLN HB2 H 18.353 15.703 23.315 1.00 . A A . 1 GLN HB2 1 1 16 1584 1 1 1 GLN HB3 H 18.290 14.000 22.847 1.00 . A A . 1 GLN HB3 1 1 16 1585 1 1 1 GLN HE21 H 22.593 14.810 24.344 1.00 . A A . 1 GLN HE21 1 1 16 1586 1 1 1 GLN HE22 H 21.816 14.377 25.874 1.00 . A A . 1 GLN HE22 1 1 16 1587 1 1 1 GLN HG2 H 20.604 14.002 22.504 1.00 . A A . 1 GLN HG2 1 1 16 1588 1 1 1 GLN HG3 H 20.796 15.774 22.601 1.00 . A A . 1 GLN HG3 1 1 16 1589 1 1 1 GLN N N 19.147 16.563 20.846 1.00 . A A . 1 GLN N 1 1 16 1590 1 1 1 GLN NE2 N 21.764 14.631 24.895 1.00 . A A . 1 GLN NE2 1 1 16 1591 1 1 1 GLN O O 16.171 14.763 21.445 1.00 . A A . 1 GLN O 1 1 16 1592 1 1 1 GLN OE1 O 19.575 14.705 25.288 1.00 . A A . 1 GLN OE1 1 1 16 1593 1 1 2 ASP C C 15.897 15.716 17.334 1.00 . A A . 2 ASP C 1 1 16 1594 1 1 2 ASP CA C 15.566 15.755 18.819 1.00 . A A . 2 ASP CA 1 1 16 1595 1 1 2 ASP CB C 14.696 16.950 19.181 1.00 . A A . 2 ASP CB 1 1 16 1596 1 1 2 ASP CG C 13.292 16.923 18.589 1.00 . A A . 2 ASP CG 1 1 16 1597 1 1 2 ASP H H 17.599 16.145 18.985 1.00 . A A . 2 ASP H 1 1 16 1598 1 1 2 ASP HA H 14.961 14.907 19.136 1.00 . A A . 2 ASP HA 1 1 16 1599 1 1 2 ASP HB2 H 14.704 17.144 20.254 1.00 . A A . 2 ASP HB2 1 1 16 1600 1 1 2 ASP HB3 H 15.201 17.864 18.882 1.00 . A A . 2 ASP HB3 1 1 16 1601 1 1 2 ASP N N 16.839 15.732 19.514 1.00 . A A . 2 ASP N 1 1 16 1602 1 1 2 ASP O O 16.264 16.753 16.796 1.00 . A A . 2 ASP O 1 1 16 1603 1 1 2 ASP OD1 O 12.626 17.977 18.677 1.00 . A A . 2 ASP OD1 1 1 16 1604 1 1 2 ASP OD2 O 12.830 15.854 18.118 1.00 . A A . 2 ASP OD2 1 1 16 1605 1 1 3 PRO C C 15.958 15.363 14.292 1.00 . A A . 3 PRO C 1 1 16 1606 1 1 3 PRO CA C 16.440 14.369 15.335 1.00 . A A . 3 PRO CA 1 1 16 1607 1 1 3 PRO CB C 16.015 12.939 14.997 1.00 . A A . 3 PRO CB 1 1 16 1608 1 1 3 PRO CD C 15.645 13.284 17.320 1.00 . A A . 3 PRO CD 1 1 16 1609 1 1 3 PRO CG C 16.233 12.263 16.346 1.00 . A A . 3 PRO CG 1 1 16 1610 1 1 3 PRO HA H 17.523 14.393 15.458 1.00 . A A . 3 PRO HA 1 1 16 1611 1 1 3 PRO HB2 H 14.956 12.925 14.736 1.00 . A A . 3 PRO HB2 1 1 16 1612 1 1 3 PRO HB3 H 16.700 12.509 14.258 1.00 . A A . 3 PRO HB3 1 1 16 1613 1 1 3 PRO HD2 H 14.583 13.067 17.382 1.00 . A A . 3 PRO HD2 1 1 16 1614 1 1 3 PRO HD3 H 16.077 13.192 18.314 1.00 . A A . 3 PRO HD3 1 1 16 1615 1 1 3 PRO HG2 H 15.676 11.337 16.482 1.00 . A A . 3 PRO HG2 1 1 16 1616 1 1 3 PRO HG3 H 17.293 12.080 16.502 1.00 . A A . 3 PRO HG3 1 1 16 1617 1 1 3 PRO N N 15.909 14.554 16.666 1.00 . A A . 3 PRO N 1 1 16 1618 1 1 3 PRO O O 14.768 15.604 14.128 1.00 . A A . 3 PRO O 1 1 16 1619 1 1 4 DPR C C 15.762 18.205 13.118 1.00 . A A . 4 DPR C 1 1 16 1620 1 1 4 DPR CA C 16.512 17.006 12.545 1.00 . A A . 4 DPR CA 1 1 16 1621 1 1 4 DPR CB C 17.802 17.449 11.859 1.00 . A A . 4 DPR CB 1 1 16 1622 1 1 4 DPR CD C 18.286 15.853 13.519 1.00 . A A . 4 DPR CD 1 1 16 1623 1 1 4 DPR CG C 18.790 16.332 12.158 1.00 . A A . 4 DPR CG 1 1 16 1624 1 1 4 DPR HA H 15.937 16.405 11.842 1.00 . A A . 4 DPR HA 1 1 16 1625 1 1 4 DPR HB2 H 18.075 18.378 12.357 1.00 . A A . 4 DPR HB2 1 1 16 1626 1 1 4 DPR HB3 H 17.768 17.534 10.773 1.00 . A A . 4 DPR HB3 1 1 16 1627 1 1 4 DPR HD2 H 18.845 16.339 14.314 1.00 . A A . 4 DPR HD2 1 1 16 1628 1 1 4 DPR HD3 H 18.551 14.808 13.642 1.00 . A A . 4 DPR HD3 1 1 16 1629 1 1 4 DPR HG2 H 19.810 16.706 12.102 1.00 . A A . 4 DPR HG2 1 1 16 1630 1 1 4 DPR HG3 H 18.615 15.569 11.394 1.00 . A A . 4 DPR HG3 1 1 16 1631 1 1 4 DPR N N 16.854 16.046 13.580 1.00 . A A . 4 DPR N 1 1 16 1632 1 1 4 DPR O O 15.278 19.006 12.328 1.00 . A A . 4 DPR O 1 1 16 1633 1 1 5 LYS C C 15.643 20.180 16.252 1.00 . A A . 5 LYS C 1 1 16 1634 1 1 5 LYS CA C 14.885 19.471 15.138 1.00 . A A . 5 LYS CA 1 1 16 1635 1 1 5 LYS CB C 13.486 19.042 15.549 1.00 . A A . 5 LYS CB 1 1 16 1636 1 1 5 LYS CD C 11.206 18.573 14.555 1.00 . A A . 5 LYS CD 1 1 16 1637 1 1 5 LYS CE C 10.986 17.172 15.104 1.00 . A A . 5 LYS CE 1 1 16 1638 1 1 5 LYS CG C 12.689 18.780 14.268 1.00 . A A . 5 LYS CG 1 1 16 1639 1 1 5 LYS H H 15.715 17.567 14.964 1.00 . A A . 5 LYS H 1 1 16 1640 1 1 5 LYS HA H 14.716 20.241 14.387 1.00 . A A . 5 LYS HA 1 1 16 1641 1 1 5 LYS HB2 H 13.520 18.154 16.182 1.00 . A A . 5 LYS HB2 1 1 16 1642 1 1 5 LYS HB3 H 12.950 19.829 16.079 1.00 . A A . 5 LYS HB3 1 1 16 1643 1 1 5 LYS HD2 H 10.801 19.303 15.243 1.00 . A A . 5 LYS HD2 1 1 16 1644 1 1 5 LYS HD3 H 10.650 18.648 13.616 1.00 . A A . 5 LYS HD3 1 1 16 1645 1 1 5 LYS HE2 H 11.520 16.413 14.530 1.00 . A A . 5 LYS HE2 1 1 16 1646 1 1 5 LYS HE3 H 11.409 17.203 16.114 1.00 . A A . 5 LYS HE3 1 1 16 1647 1 1 5 LYS HG2 H 12.712 19.664 13.630 1.00 . A A . 5 LYS HG2 1 1 16 1648 1 1 5 LYS HG3 H 13.048 17.862 13.804 1.00 . A A . 5 LYS HG3 1 1 16 1649 1 1 5 LYS HZ1 H 9.194 17.593 15.902 1.00 . A A . 5 LYS HZ1 1 1 16 1650 1 1 5 LYS HZ2 H 9.415 15.992 15.790 1.00 . A A . 5 LYS HZ2 1 1 16 1651 1 1 5 LYS HZ3 H 9.111 16.858 14.407 1.00 . A A . 5 LYS HZ3 1 1 16 1652 1 1 5 LYS N N 15.571 18.406 14.420 1.00 . A A . 5 LYS N 1 1 16 1653 1 1 5 LYS NZ N 9.557 16.864 15.305 1.00 . A A . 5 LYS NZ 1 1 16 1654 1 1 5 LYS O O 15.205 21.246 16.709 1.00 . A A . 5 LYS O 1 1 16 1655 1 1 6 DTH C C 18.296 19.201 18.566 1.00 . A A . 6 DTH C 1 1 16 1656 1 1 6 DTH CA C 17.734 20.205 17.573 1.00 . A A . 6 DTH CA 1 1 16 1657 1 1 6 DTH CB C 18.824 21.064 16.939 1.00 . A A . 6 DTH CB 1 1 16 1658 1 1 6 DTH CG2 C 19.954 20.342 16.218 1.00 . A A . 6 DTH CG2 1 1 16 1659 1 1 6 DTH H H 16.885 18.603 16.511 1.00 . A A . 6 DTH H 1 1 16 1660 1 1 6 DTH HA H 17.215 20.935 18.189 1.00 . A A . 6 DTH HA 1 1 16 1661 1 1 6 DTH HB H 19.175 21.616 17.810 1.00 . A A . 6 DTH HB 1 1 16 1662 1 1 6 DTH HG1 H 18.994 22.788 15.980 1.00 . A A . 6 DTH HG1 1 1 16 1663 1 1 6 DTH HG21 H 20.616 19.723 16.823 1.00 . A A . 6 DTH HG21 1 1 16 1664 1 1 6 DTH HG22 H 20.658 21.055 15.792 1.00 . A A . 6 DTH HG22 1 1 16 1665 1 1 6 DTH HG23 H 19.548 19.764 15.387 1.00 . A A . 6 DTH HG23 1 1 16 1666 1 1 6 DTH N N 16.744 19.592 16.711 1.00 . A A . 6 DTH N 1 1 16 1667 1 1 6 DTH O O 18.499 18.016 18.308 1.00 . A A . 6 DTH O 1 1 16 1668 1 1 6 DTH OG1 O 18.358 22.066 16.064 1.00 . A A . 6 DTH OG1 1 1 16 1669 1 1 7 . C C 18.627 17.758 21.141 1.00 . A A . 7 DAS C 1 1 16 1670 1 1 7 . CA C 19.398 19.023 20.816 1.00 . A A . 7 DAS CA 1 1 16 1671 1 1 7 . CB C 20.877 18.894 20.439 1.00 . A A . 7 DAS CB 1 1 16 1672 1 1 7 . CG C 21.578 20.092 19.814 1.00 . A A . 7 DAS CG 1 1 16 1673 1 1 7 . H H 18.559 20.664 19.826 1.00 . A A . 7 DAS H 1 1 16 1674 1 1 7 . HA H 19.387 19.651 21.713 1.00 . A A . 7 DAS HA 1 1 16 1675 1 1 7 . HB2 H 20.922 18.180 19.616 1.00 . A A . 7 DAS HB2 1 1 16 1676 1 1 7 . HB3 H 21.468 18.464 21.247 1.00 . A A . 7 DAS HB3 1 1 16 1677 1 1 7 . N N 18.626 19.664 19.771 1.00 . A A . 7 DAS N 1 1 16 1678 1 1 7 . O O 17.581 17.838 21.787 1.00 . A A . 7 DAS O 1 1 16 1679 1 1 7 . OD1 O 22.679 19.904 19.248 1.00 . A A . 7 DAS OD1 1 1 16 1680 1 1 7 . OD2 O 21.026 21.216 19.826 1.00 . A A . 7 DAS OD2 1 1 17 1681 1 1 1 GLN C C 17.093 15.212 20.714 1.00 . A A . 1 GLN C 1 1 17 1682 1 1 1 GLN CA C 18.364 15.429 21.525 1.00 . A A . 1 GLN CA 1 1 17 1683 1 1 1 GLN CB C 18.134 15.261 23.029 1.00 . A A . 1 GLN CB 1 1 17 1684 1 1 1 GLN CD C 20.589 15.003 23.648 1.00 . A A . 1 GLN CD 1 1 17 1685 1 1 1 GLN CG C 19.282 15.759 23.901 1.00 . A A . 1 GLN CG 1 1 17 1686 1 1 1 GLN H1 H 19.899 16.734 21.073 1.00 . A A . 1 GLN H1 1 1 17 1687 1 1 1 GLN HA H 18.932 14.626 21.072 1.00 . A A . 1 GLN HA 1 1 17 1688 1 1 1 GLN HB2 H 17.243 15.821 23.313 1.00 . A A . 1 GLN HB2 1 1 17 1689 1 1 1 GLN HB3 H 17.919 14.224 23.276 1.00 . A A . 1 GLN HB3 1 1 17 1690 1 1 1 GLN HE21 H 21.431 15.490 25.471 1.00 . A A . 1 GLN HE21 1 1 17 1691 1 1 1 GLN HE22 H 22.240 14.319 24.415 1.00 . A A . 1 GLN HE22 1 1 17 1692 1 1 1 GLN HG2 H 19.421 16.827 23.753 1.00 . A A . 1 GLN HG2 1 1 17 1693 1 1 1 GLN HG3 H 18.984 15.623 24.939 1.00 . A A . 1 GLN HG3 1 1 17 1694 1 1 1 GLN N N 18.904 16.753 21.281 1.00 . A A . 1 GLN N 1 1 17 1695 1 1 1 GLN NE2 N 21.552 15.047 24.563 1.00 . A A . 1 GLN NE2 1 1 17 1696 1 1 1 GLN O O 16.201 14.469 21.139 1.00 . A A . 1 GLN O 1 1 17 1697 1 1 1 GLN OE1 O 20.781 14.287 22.669 1.00 . A A . 1 GLN OE1 1 1 17 1698 1 1 2 ASP C C 16.113 15.513 17.216 1.00 . A A . 2 ASP C 1 1 17 1699 1 1 2 ASP CA C 15.790 15.440 18.708 1.00 . A A . 2 ASP CA 1 1 17 1700 1 1 2 ASP CB C 14.740 16.470 19.094 1.00 . A A . 2 ASP CB 1 1 17 1701 1 1 2 ASP CG C 13.400 16.290 18.403 1.00 . A A . 2 ASP CG 1 1 17 1702 1 1 2 ASP H H 17.638 16.399 19.150 1.00 . A A . 2 ASP H 1 1 17 1703 1 1 2 ASP HA H 15.322 14.489 18.956 1.00 . A A . 2 ASP HA 1 1 17 1704 1 1 2 ASP HB2 H 14.594 16.402 20.169 1.00 . A A . 2 ASP HB2 1 1 17 1705 1 1 2 ASP HB3 H 15.083 17.483 18.884 1.00 . A A . 2 ASP HB3 1 1 17 1706 1 1 2 ASP N N 16.946 15.771 19.514 1.00 . A A . 2 ASP N 1 1 17 1707 1 1 2 ASP O O 16.219 16.584 16.623 1.00 . A A . 2 ASP O 1 1 17 1708 1 1 2 ASP OD1 O 12.427 16.748 19.038 1.00 . A A . 2 ASP OD1 1 1 17 1709 1 1 2 ASP OD2 O 13.243 15.587 17.380 1.00 . A A . 2 ASP OD2 1 1 17 1710 1 1 3 PRO C C 15.902 15.304 14.154 1.00 . A A . 3 PRO C 1 1 17 1711 1 1 3 PRO CA C 16.549 14.328 15.128 1.00 . A A . 3 PRO CA 1 1 17 1712 1 1 3 PRO CB C 16.251 12.877 14.756 1.00 . A A . 3 PRO CB 1 1 17 1713 1 1 3 PRO CD C 16.109 13.048 17.101 1.00 . A A . 3 PRO CD 1 1 17 1714 1 1 3 PRO CG C 16.560 12.073 16.018 1.00 . A A . 3 PRO CG 1 1 17 1715 1 1 3 PRO HA H 17.636 14.426 15.111 1.00 . A A . 3 PRO HA 1 1 17 1716 1 1 3 PRO HB2 H 15.212 12.739 14.442 1.00 . A A . 3 PRO HB2 1 1 17 1717 1 1 3 PRO HB3 H 16.904 12.523 13.958 1.00 . A A . 3 PRO HB3 1 1 17 1718 1 1 3 PRO HD2 H 15.116 12.859 17.510 1.00 . A A . 3 PRO HD2 1 1 17 1719 1 1 3 PRO HD3 H 16.802 12.999 17.941 1.00 . A A . 3 PRO HD3 1 1 17 1720 1 1 3 PRO HG2 H 16.012 11.128 16.036 1.00 . A A . 3 PRO HG2 1 1 17 1721 1 1 3 PRO HG3 H 17.627 11.861 16.112 1.00 . A A . 3 PRO HG3 1 1 17 1722 1 1 3 PRO N N 16.142 14.374 16.517 1.00 . A A . 3 PRO N 1 1 17 1723 1 1 3 PRO O O 14.677 15.215 14.039 1.00 . A A . 3 PRO O 1 1 17 1724 1 1 4 DPR C C 15.604 18.436 13.196 1.00 . A A . 4 DPR C 1 1 17 1725 1 1 4 DPR CA C 16.157 17.145 12.587 1.00 . A A . 4 DPR CA 1 1 17 1726 1 1 4 DPR CB C 17.247 17.338 11.543 1.00 . A A . 4 DPR CB 1 1 17 1727 1 1 4 DPR CD C 18.113 16.355 13.592 1.00 . A A . 4 DPR CD 1 1 17 1728 1 1 4 DPR CG C 18.486 17.281 12.439 1.00 . A A . 4 DPR CG 1 1 17 1729 1 1 4 DPR HA H 15.327 16.633 12.089 1.00 . A A . 4 DPR HA 1 1 17 1730 1 1 4 DPR HB2 H 17.067 18.214 10.922 1.00 . A A . 4 DPR HB2 1 1 17 1731 1 1 4 DPR HB3 H 17.115 16.534 10.824 1.00 . A A . 4 DPR HB3 1 1 17 1732 1 1 4 DPR HD2 H 18.554 16.585 14.557 1.00 . A A . 4 DPR HD2 1 1 17 1733 1 1 4 DPR HD3 H 18.482 15.352 13.346 1.00 . A A . 4 DPR HD3 1 1 17 1734 1 1 4 DPR HG2 H 18.695 18.288 12.805 1.00 . A A . 4 DPR HG2 1 1 17 1735 1 1 4 DPR HG3 H 19.303 16.939 11.794 1.00 . A A . 4 DPR HG3 1 1 17 1736 1 1 4 DPR N N 16.673 16.226 13.580 1.00 . A A . 4 DPR N 1 1 17 1737 1 1 4 DPR O O 15.481 19.455 12.538 1.00 . A A . 4 DPR O 1 1 17 1738 1 1 5 LYS C C 16.064 20.303 15.931 1.00 . A A . 5 LYS C 1 1 17 1739 1 1 5 LYS CA C 14.900 19.590 15.249 1.00 . A A . 5 LYS CA 1 1 17 1740 1 1 5 LYS CB C 13.692 19.287 16.126 1.00 . A A . 5 LYS CB 1 1 17 1741 1 1 5 LYS CD C 11.213 18.523 16.379 1.00 . A A . 5 LYS CD 1 1 17 1742 1 1 5 LYS CE C 10.363 17.260 16.297 1.00 . A A . 5 LYS CE 1 1 17 1743 1 1 5 LYS CG C 12.492 18.534 15.546 1.00 . A A . 5 LYS CG 1 1 17 1744 1 1 5 LYS H H 15.311 17.500 14.921 1.00 . A A . 5 LYS H 1 1 17 1745 1 1 5 LYS HA H 14.494 20.276 14.514 1.00 . A A . 5 LYS HA 1 1 17 1746 1 1 5 LYS HB2 H 13.951 18.742 17.035 1.00 . A A . 5 LYS HB2 1 1 17 1747 1 1 5 LYS HB3 H 13.267 20.244 16.437 1.00 . A A . 5 LYS HB3 1 1 17 1748 1 1 5 LYS HD2 H 11.535 18.687 17.408 1.00 . A A . 5 LYS HD2 1 1 17 1749 1 1 5 LYS HD3 H 10.572 19.376 16.143 1.00 . A A . 5 LYS HD3 1 1 17 1750 1 1 5 LYS HE2 H 9.382 17.672 16.033 1.00 . A A . 5 LYS HE2 1 1 17 1751 1 1 5 LYS HE3 H 10.702 16.641 15.475 1.00 . A A . 5 LYS HE3 1 1 17 1752 1 1 5 LYS HG2 H 12.267 18.885 14.535 1.00 . A A . 5 LYS HG2 1 1 17 1753 1 1 5 LYS HG3 H 12.889 17.519 15.520 1.00 . A A . 5 LYS HG3 1 1 17 1754 1 1 5 LYS HZ1 H 11.108 16.405 18.080 1.00 . A A . 5 LYS HZ1 1 1 17 1755 1 1 5 LYS HZ2 H 9.916 15.627 17.441 1.00 . A A . 5 LYS HZ2 1 1 17 1756 1 1 5 LYS HZ3 H 9.640 17.024 18.259 1.00 . A A . 5 LYS HZ3 1 1 17 1757 1 1 5 LYS N N 15.279 18.408 14.491 1.00 . A A . 5 LYS N 1 1 17 1758 1 1 5 LYS NZ N 10.241 16.572 17.585 1.00 . A A . 5 LYS NZ 1 1 17 1759 1 1 5 LYS O O 16.248 21.500 15.755 1.00 . A A . 5 LYS O 1 1 17 1760 1 1 6 DTH C C 18.497 19.152 18.486 1.00 . A A . 6 DTH C 1 1 17 1761 1 1 6 DTH CA C 18.140 20.037 17.305 1.00 . A A . 6 DTH CA 1 1 17 1762 1 1 6 DTH CB C 19.271 20.143 16.287 1.00 . A A . 6 DTH CB 1 1 17 1763 1 1 6 DTH CG2 C 20.632 20.461 16.906 1.00 . A A . 6 DTH CG2 1 1 17 1764 1 1 6 DTH H H 16.821 18.595 16.511 1.00 . A A . 6 DTH H 1 1 17 1765 1 1 6 DTH HA H 17.917 21.023 17.726 1.00 . A A . 6 DTH HA 1 1 17 1766 1 1 6 DTH HB H 19.040 20.946 15.586 1.00 . A A . 6 DTH HB 1 1 17 1767 1 1 6 DTH HG1 H 20.227 18.903 15.035 1.00 . A A . 6 DTH HG1 1 1 17 1768 1 1 6 DTH HG21 H 21.019 19.627 17.495 1.00 . A A . 6 DTH HG21 1 1 17 1769 1 1 6 DTH HG22 H 20.482 21.230 17.665 1.00 . A A . 6 DTH HG22 1 1 17 1770 1 1 6 DTH HG23 H 21.382 20.837 16.214 1.00 . A A . 6 DTH HG23 1 1 17 1771 1 1 6 DTH N N 16.927 19.592 16.664 1.00 . A A . 6 DTH N 1 1 17 1772 1 1 6 DTH O O 18.594 17.939 18.378 1.00 . A A . 6 DTH O 1 1 17 1773 1 1 6 DTH OG1 O 19.438 18.932 15.578 1.00 . A A . 6 DTH OG1 1 1 17 1774 1 1 7 . C C 18.315 17.949 21.264 1.00 . A A . 7 DAS C 1 1 17 1775 1 1 7 . CA C 19.160 19.151 20.877 1.00 . A A . 7 DAS CA 1 1 17 1776 1 1 7 . CB C 20.644 18.805 20.892 1.00 . A A . 7 DAS CB 1 1 17 1777 1 1 7 . CG C 21.561 20.003 20.701 1.00 . A A . 7 DAS CG 1 1 17 1778 1 1 7 . H H 18.681 20.785 19.605 1.00 . A A . 7 DAS H 1 1 17 1779 1 1 7 . HA H 19.047 19.860 21.705 1.00 . A A . 7 DAS HA 1 1 17 1780 1 1 7 . HB2 H 20.792 18.065 20.110 1.00 . A A . 7 DAS HB2 1 1 17 1781 1 1 7 . HB3 H 20.950 18.281 21.804 1.00 . A A . 7 DAS HB3 1 1 17 1782 1 1 7 . N N 18.672 19.770 19.656 1.00 . A A . 7 DAS N 1 1 17 1783 1 1 7 . O O 17.180 18.200 21.671 1.00 . A A . 7 DAS O 1 1 17 1784 1 1 7 . OD1 O 22.642 19.783 20.123 1.00 . A A . 7 DAS OD1 1 1 17 1785 1 1 7 . OD2 O 21.078 21.126 20.979 1.00 . A A . 7 DAS OD2 1 1 18 1786 1 1 1 GLN C C 17.378 15.000 20.481 1.00 . A A . 1 GLN C 1 1 18 1787 1 1 1 GLN CA C 18.736 15.294 21.098 1.00 . A A . 1 GLN CA 1 1 18 1788 1 1 1 GLN CB C 18.844 14.752 22.523 1.00 . A A . 1 GLN CB 1 1 18 1789 1 1 1 GLN CD C 20.318 13.793 24.368 1.00 . A A . 1 GLN CD 1 1 18 1790 1 1 1 GLN CG C 20.259 14.594 23.077 1.00 . A A . 1 GLN CG 1 1 18 1791 1 1 1 GLN H1 H 20.016 16.796 20.413 1.00 . A A . 1 GLN H1 1 1 18 1792 1 1 1 GLN HA H 19.456 14.717 20.525 1.00 . A A . 1 GLN HA 1 1 18 1793 1 1 1 GLN HB2 H 18.142 15.277 23.165 1.00 . A A . 1 GLN HB2 1 1 18 1794 1 1 1 GLN HB3 H 18.527 13.706 22.580 1.00 . A A . 1 GLN HB3 1 1 18 1795 1 1 1 GLN HE21 H 22.304 14.131 24.881 1.00 . A A . 1 GLN HE21 1 1 18 1796 1 1 1 GLN HE22 H 21.424 13.013 25.861 1.00 . A A . 1 GLN HE22 1 1 18 1797 1 1 1 GLN HG2 H 20.935 14.118 22.361 1.00 . A A . 1 GLN HG2 1 1 18 1798 1 1 1 GLN HG3 H 20.630 15.598 23.269 1.00 . A A . 1 GLN HG3 1 1 18 1799 1 1 1 GLN N N 19.171 16.670 20.949 1.00 . A A . 1 GLN N 1 1 18 1800 1 1 1 GLN NE2 N 21.450 13.617 25.058 1.00 . A A . 1 GLN NE2 1 1 18 1801 1 1 1 GLN O O 16.687 14.134 21.020 1.00 . A A . 1 GLN O 1 1 18 1802 1 1 1 GLN OE1 O 19.371 13.107 24.754 1.00 . A A . 1 GLN OE1 1 1 18 1803 1 1 2 ASP C C 16.068 15.589 17.201 1.00 . A A . 2 ASP C 1 1 18 1804 1 1 2 ASP CA C 15.814 15.725 18.700 1.00 . A A . 2 ASP CA 1 1 18 1805 1 1 2 ASP CB C 15.095 17.039 19.004 1.00 . A A . 2 ASP CB 1 1 18 1806 1 1 2 ASP CG C 13.748 17.133 18.319 1.00 . A A . 2 ASP CG 1 1 18 1807 1 1 2 ASP H H 17.837 16.221 18.943 1.00 . A A . 2 ASP H 1 1 18 1808 1 1 2 ASP HA H 15.255 14.880 19.108 1.00 . A A . 2 ASP HA 1 1 18 1809 1 1 2 ASP HB2 H 14.985 17.189 20.079 1.00 . A A . 2 ASP HB2 1 1 18 1810 1 1 2 ASP HB3 H 15.692 17.845 18.573 1.00 . A A . 2 ASP HB3 1 1 18 1811 1 1 2 ASP N N 17.097 15.664 19.355 1.00 . A A . 2 ASP N 1 1 18 1812 1 1 2 ASP O O 16.637 16.456 16.530 1.00 . A A . 2 ASP O 1 1 18 1813 1 1 2 ASP OD1 O 13.178 18.234 18.453 1.00 . A A . 2 ASP OD1 1 1 18 1814 1 1 2 ASP OD2 O 13.232 16.224 17.624 1.00 . A A . 2 ASP OD2 1 1 18 1815 1 1 3 PRO C C 15.790 15.116 14.170 1.00 . A A . 3 PRO C 1 1 18 1816 1 1 3 PRO CA C 16.147 14.130 15.279 1.00 . A A . 3 PRO CA 1 1 18 1817 1 1 3 PRO CB C 15.527 12.769 14.962 1.00 . A A . 3 PRO CB 1 1 18 1818 1 1 3 PRO CD C 15.068 13.317 17.274 1.00 . A A . 3 PRO CD 1 1 18 1819 1 1 3 PRO CG C 15.126 12.152 16.291 1.00 . A A . 3 PRO CG 1 1 18 1820 1 1 3 PRO HA H 17.209 13.993 15.412 1.00 . A A . 3 PRO HA 1 1 18 1821 1 1 3 PRO HB2 H 14.610 12.911 14.392 1.00 . A A . 3 PRO HB2 1 1 18 1822 1 1 3 PRO HB3 H 16.240 12.133 14.441 1.00 . A A . 3 PRO HB3 1 1 18 1823 1 1 3 PRO HD2 H 14.025 13.570 17.507 1.00 . A A . 3 PRO HD2 1 1 18 1824 1 1 3 PRO HD3 H 15.578 13.088 18.211 1.00 . A A . 3 PRO HD3 1 1 18 1825 1 1 3 PRO HG2 H 14.067 11.883 16.231 1.00 . A A . 3 PRO HG2 1 1 18 1826 1 1 3 PRO HG3 H 15.919 11.435 16.513 1.00 . A A . 3 PRO HG3 1 1 18 1827 1 1 3 PRO N N 15.698 14.445 16.625 1.00 . A A . 3 PRO N 1 1 18 1828 1 1 3 PRO O O 14.609 15.290 13.868 1.00 . A A . 3 PRO O 1 1 18 1829 1 1 4 DPR C C 15.827 18.270 13.160 1.00 . A A . 4 DPR C 1 1 18 1830 1 1 4 DPR CA C 16.409 16.957 12.654 1.00 . A A . 4 DPR CA 1 1 18 1831 1 1 4 DPR CB C 17.733 17.138 11.916 1.00 . A A . 4 DPR CB 1 1 18 1832 1 1 4 DPR CD C 18.125 15.961 13.916 1.00 . A A . 4 DPR CD 1 1 18 1833 1 1 4 DPR CG C 18.742 17.058 13.061 1.00 . A A . 4 DPR CG 1 1 18 1834 1 1 4 DPR HA H 15.634 16.606 11.965 1.00 . A A . 4 DPR HA 1 1 18 1835 1 1 4 DPR HB2 H 17.815 18.042 11.311 1.00 . A A . 4 DPR HB2 1 1 18 1836 1 1 4 DPR HB3 H 17.803 16.269 11.271 1.00 . A A . 4 DPR HB3 1 1 18 1837 1 1 4 DPR HD2 H 18.325 16.236 14.958 1.00 . A A . 4 DPR HD2 1 1 18 1838 1 1 4 DPR HD3 H 18.506 14.962 13.709 1.00 . A A . 4 DPR HD3 1 1 18 1839 1 1 4 DPR HG2 H 18.717 17.966 13.660 1.00 . A A . 4 DPR HG2 1 1 18 1840 1 1 4 DPR HG3 H 19.733 16.774 12.717 1.00 . A A . 4 DPR HG3 1 1 18 1841 1 1 4 DPR N N 16.705 15.929 13.632 1.00 . A A . 4 DPR N 1 1 18 1842 1 1 4 DPR O O 15.536 19.191 12.384 1.00 . A A . 4 DPR O 1 1 18 1843 1 1 5 LYS C C 15.854 20.249 16.253 1.00 . A A . 5 LYS C 1 1 18 1844 1 1 5 LYS CA C 15.066 19.653 15.096 1.00 . A A . 5 LYS CA 1 1 18 1845 1 1 5 LYS CB C 13.646 19.355 15.566 1.00 . A A . 5 LYS CB 1 1 18 1846 1 1 5 LYS CD C 11.219 19.016 14.680 1.00 . A A . 5 LYS CD 1 1 18 1847 1 1 5 LYS CE C 10.636 17.850 15.478 1.00 . A A . 5 LYS CE 1 1 18 1848 1 1 5 LYS CG C 12.700 19.196 14.371 1.00 . A A . 5 LYS CG 1 1 18 1849 1 1 5 LYS H H 15.718 17.655 15.046 1.00 . A A . 5 LYS H 1 1 18 1850 1 1 5 LYS HA H 14.970 20.474 14.386 1.00 . A A . 5 LYS HA 1 1 18 1851 1 1 5 LYS HB2 H 13.642 18.455 16.183 1.00 . A A . 5 LYS HB2 1 1 18 1852 1 1 5 LYS HB3 H 13.218 20.199 16.110 1.00 . A A . 5 LYS HB3 1 1 18 1853 1 1 5 LYS HD2 H 10.797 19.934 15.093 1.00 . A A . 5 LYS HD2 1 1 18 1854 1 1 5 LYS HD3 H 10.832 18.930 13.673 1.00 . A A . 5 LYS HD3 1 1 18 1855 1 1 5 LYS HE2 H 9.554 17.808 15.393 1.00 . A A . 5 LYS HE2 1 1 18 1856 1 1 5 LYS HE3 H 10.995 16.899 15.080 1.00 . A A . 5 LYS HE3 1 1 18 1857 1 1 5 LYS HG2 H 12.793 20.111 13.799 1.00 . A A . 5 LYS HG2 1 1 18 1858 1 1 5 LYS HG3 H 13.034 18.311 13.819 1.00 . A A . 5 LYS HG3 1 1 18 1859 1 1 5 LYS HZ1 H 10.434 17.138 17.414 1.00 . A A . 5 LYS HZ1 1 1 18 1860 1 1 5 LYS HZ2 H 10.917 18.725 17.327 1.00 . A A . 5 LYS HZ2 1 1 18 1861 1 1 5 LYS HZ3 H 11.952 17.591 17.140 1.00 . A A . 5 LYS HZ3 1 1 18 1862 1 1 5 LYS N N 15.615 18.465 14.460 1.00 . A A . 5 LYS N 1 1 18 1863 1 1 5 LYS NZ N 10.998 17.812 16.904 1.00 . A A . 5 LYS NZ 1 1 18 1864 1 1 5 LYS O O 15.529 21.371 16.622 1.00 . A A . 5 LYS O 1 1 18 1865 1 1 6 DTH C C 18.445 19.343 18.624 1.00 . A A . 6 DTH C 1 1 18 1866 1 1 6 DTH CA C 17.907 20.238 17.527 1.00 . A A . 6 DTH CA 1 1 18 1867 1 1 6 DTH CB C 19.010 20.841 16.650 1.00 . A A . 6 DTH CB 1 1 18 1868 1 1 6 DTH CG2 C 20.289 21.206 17.393 1.00 . A A . 6 DTH CG2 1 1 18 1869 1 1 6 DTH H H 17.163 18.640 16.426 1.00 . A A . 6 DTH H 1 1 18 1870 1 1 6 DTH HA H 17.405 21.085 17.979 1.00 . A A . 6 DTH HA 1 1 18 1871 1 1 6 DTH HB H 18.643 21.700 16.086 1.00 . A A . 6 DTH HB 1 1 18 1872 1 1 6 DTH HG1 H 20.049 19.339 16.020 1.00 . A A . 6 DTH HG1 1 1 18 1873 1 1 6 DTH HG21 H 21.033 21.409 16.625 1.00 . A A . 6 DTH HG21 1 1 18 1874 1 1 6 DTH HG22 H 20.679 20.460 18.096 1.00 . A A . 6 DTH HG22 1 1 18 1875 1 1 6 DTH HG23 H 20.176 22.047 18.077 1.00 . A A . 6 DTH HG23 1 1 18 1876 1 1 6 DTH N N 16.909 19.569 16.714 1.00 . A A . 6 DTH N 1 1 18 1877 1 1 6 DTH O O 18.855 18.222 18.331 1.00 . A A . 6 DTH O 1 1 18 1878 1 1 6 DTH OG1 O 19.390 19.930 15.653 1.00 . A A . 6 DTH OG1 1 1 18 1879 1 1 7 . C C 18.410 17.719 21.241 1.00 . A A . 7 DAS C 1 1 18 1880 1 1 7 . CA C 18.980 19.123 21.026 1.00 . A A . 7 DAS CA 1 1 18 1881 1 1 7 . CB C 20.498 19.176 21.028 1.00 . A A . 7 DAS CB 1 1 18 1882 1 1 7 . CG C 21.171 20.545 21.044 1.00 . A A . 7 DAS CG 1 1 18 1883 1 1 7 . H H 18.131 20.761 20.048 1.00 . A A . 7 DAS H 1 1 18 1884 1 1 7 . HA H 18.651 19.592 21.947 1.00 . A A . 7 DAS HA 1 1 18 1885 1 1 7 . HB2 H 20.770 18.722 20.076 1.00 . A A . 7 DAS HB2 1 1 18 1886 1 1 7 . HB3 H 20.904 18.565 21.836 1.00 . A A . 7 DAS HB3 1 1 18 1887 1 1 7 . N N 18.472 19.831 19.871 1.00 . A A . 7 DAS N 1 1 18 1888 1 1 7 . O O 17.292 17.541 21.709 1.00 . A A . 7 DAS O 1 1 18 1889 1 1 7 . OD1 O 21.969 20.799 20.119 1.00 . A A . 7 DAS OD1 1 1 18 1890 1 1 7 . OD2 O 20.740 21.399 21.864 1.00 . A A . 7 DAS OD2 1 1 19 1891 1 1 1 GLN C C 17.139 15.071 20.763 1.00 . A A . 1 GLN C 1 1 19 1892 1 1 1 GLN CA C 18.531 15.315 21.343 1.00 . A A . 1 GLN CA 1 1 19 1893 1 1 1 GLN CB C 18.652 14.946 22.820 1.00 . A A . 1 GLN CB 1 1 19 1894 1 1 1 GLN CD C 20.972 14.003 22.786 1.00 . A A . 1 GLN CD 1 1 19 1895 1 1 1 GLN CG C 20.056 15.045 23.410 1.00 . A A . 1 GLN CG 1 1 19 1896 1 1 1 GLN H1 H 19.979 16.698 20.581 1.00 . A A . 1 GLN H1 1 1 19 1897 1 1 1 GLN HA H 19.103 14.580 20.779 1.00 . A A . 1 GLN HA 1 1 19 1898 1 1 1 GLN HB2 H 18.084 15.582 23.502 1.00 . A A . 1 GLN HB2 1 1 19 1899 1 1 1 GLN HB3 H 18.306 13.922 22.908 1.00 . A A . 1 GLN HB3 1 1 19 1900 1 1 1 GLN HE21 H 20.063 12.660 23.930 1.00 . A A . 1 GLN HE21 1 1 19 1901 1 1 1 GLN HE22 H 21.187 11.973 22.707 1.00 . A A . 1 GLN HE22 1 1 19 1902 1 1 1 GLN HG2 H 20.406 16.046 23.153 1.00 . A A . 1 GLN HG2 1 1 19 1903 1 1 1 GLN HG3 H 19.893 14.875 24.480 1.00 . A A . 1 GLN HG3 1 1 19 1904 1 1 1 GLN N N 19.100 16.617 21.056 1.00 . A A . 1 GLN N 1 1 19 1905 1 1 1 GLN NE2 N 20.739 12.742 23.181 1.00 . A A . 1 GLN NE2 1 1 19 1906 1 1 1 GLN O O 16.418 14.203 21.255 1.00 . A A . 1 GLN O 1 1 19 1907 1 1 1 GLN OE1 O 21.779 14.279 21.909 1.00 . A A . 1 GLN OE1 1 1 19 1908 1 1 2 ASP C C 15.947 15.684 17.342 1.00 . A A . 2 ASP C 1 1 19 1909 1 1 2 ASP CA C 15.644 15.591 18.821 1.00 . A A . 2 ASP CA 1 1 19 1910 1 1 2 ASP CB C 14.498 16.505 19.241 1.00 . A A . 2 ASP CB 1 1 19 1911 1 1 2 ASP CG C 13.098 16.147 18.767 1.00 . A A . 2 ASP CG 1 1 19 1912 1 1 2 ASP H H 17.434 16.522 19.441 1.00 . A A . 2 ASP H 1 1 19 1913 1 1 2 ASP HA H 15.210 14.616 19.063 1.00 . A A . 2 ASP HA 1 1 19 1914 1 1 2 ASP HB2 H 14.462 16.528 20.332 1.00 . A A . 2 ASP HB2 1 1 19 1915 1 1 2 ASP HB3 H 14.662 17.562 19.023 1.00 . A A . 2 ASP HB3 1 1 19 1916 1 1 2 ASP N N 16.812 15.748 19.670 1.00 . A A . 2 ASP N 1 1 19 1917 1 1 2 ASP O O 16.234 16.789 16.867 1.00 . A A . 2 ASP O 1 1 19 1918 1 1 2 ASP OD1 O 12.193 16.986 18.967 1.00 . A A . 2 ASP OD1 1 1 19 1919 1 1 2 ASP OD2 O 12.935 15.180 17.990 1.00 . A A . 2 ASP OD2 1 1 19 1920 1 1 3 PRO C C 15.962 15.376 14.319 1.00 . A A . 3 PRO C 1 1 19 1921 1 1 3 PRO CA C 16.601 14.438 15.331 1.00 . A A . 3 PRO CA 1 1 19 1922 1 1 3 PRO CB C 16.353 13.023 14.826 1.00 . A A . 3 PRO CB 1 1 19 1923 1 1 3 PRO CD C 15.675 13.229 17.127 1.00 . A A . 3 PRO CD 1 1 19 1924 1 1 3 PRO CG C 16.345 12.263 16.145 1.00 . A A . 3 PRO CG 1 1 19 1925 1 1 3 PRO HA H 17.685 14.563 15.426 1.00 . A A . 3 PRO HA 1 1 19 1926 1 1 3 PRO HB2 H 15.363 12.908 14.385 1.00 . A A . 3 PRO HB2 1 1 19 1927 1 1 3 PRO HB3 H 17.126 12.631 14.152 1.00 . A A . 3 PRO HB3 1 1 19 1928 1 1 3 PRO HD2 H 14.608 13.045 17.051 1.00 . A A . 3 PRO HD2 1 1 19 1929 1 1 3 PRO HD3 H 15.997 13.057 18.153 1.00 . A A . 3 PRO HD3 1 1 19 1930 1 1 3 PRO HG2 H 15.778 11.334 16.044 1.00 . A A . 3 PRO HG2 1 1 19 1931 1 1 3 PRO HG3 H 17.368 12.067 16.463 1.00 . A A . 3 PRO HG3 1 1 19 1932 1 1 3 PRO N N 15.973 14.551 16.625 1.00 . A A . 3 PRO N 1 1 19 1933 1 1 3 PRO O O 14.749 15.343 14.169 1.00 . A A . 3 PRO O 1 1 19 1934 1 1 4 DPR C C 15.539 18.300 13.080 1.00 . A A . 4 DPR C 1 1 19 1935 1 1 4 DPR CA C 16.282 17.064 12.591 1.00 . A A . 4 DPR CA 1 1 19 1936 1 1 4 DPR CB C 17.517 17.332 11.715 1.00 . A A . 4 DPR CB 1 1 19 1937 1 1 4 DPR CD C 18.224 16.255 13.650 1.00 . A A . 4 DPR CD 1 1 19 1938 1 1 4 DPR CG C 18.724 17.275 12.642 1.00 . A A . 4 DPR CG 1 1 19 1939 1 1 4 DPR HA H 15.549 16.678 11.877 1.00 . A A . 4 DPR HA 1 1 19 1940 1 1 4 DPR HB2 H 17.409 18.340 11.305 1.00 . A A . 4 DPR HB2 1 1 19 1941 1 1 4 DPR HB3 H 17.595 16.629 10.881 1.00 . A A . 4 DPR HB3 1 1 19 1942 1 1 4 DPR HD2 H 18.507 16.583 14.651 1.00 . A A . 4 DPR HD2 1 1 19 1943 1 1 4 DPR HD3 H 18.726 15.293 13.527 1.00 . A A . 4 DPR HD3 1 1 19 1944 1 1 4 DPR HG2 H 18.892 18.267 13.068 1.00 . A A . 4 DPR HG2 1 1 19 1945 1 1 4 DPR HG3 H 19.627 16.912 12.164 1.00 . A A . 4 DPR HG3 1 1 19 1946 1 1 4 DPR N N 16.781 16.155 13.599 1.00 . A A . 4 DPR N 1 1 19 1947 1 1 4 DPR O O 15.184 19.106 12.224 1.00 . A A . 4 DPR O 1 1 19 1948 1 1 5 LYS C C 15.678 20.236 16.248 1.00 . A A . 5 LYS C 1 1 19 1949 1 1 5 LYS CA C 14.930 19.678 15.050 1.00 . A A . 5 LYS CA 1 1 19 1950 1 1 5 LYS CB C 13.407 19.594 15.183 1.00 . A A . 5 LYS CB 1 1 19 1951 1 1 5 LYS CD C 11.231 18.594 15.854 1.00 . A A . 5 LYS CD 1 1 19 1952 1 1 5 LYS CE C 10.498 17.272 15.647 1.00 . A A . 5 LYS CE 1 1 19 1953 1 1 5 LYS CG C 12.750 18.393 15.851 1.00 . A A . 5 LYS CG 1 1 19 1954 1 1 5 LYS H H 15.921 17.843 15.011 1.00 . A A . 5 LYS H 1 1 19 1955 1 1 5 LYS HA H 15.169 20.486 14.353 1.00 . A A . 5 LYS HA 1 1 19 1956 1 1 5 LYS HB2 H 12.996 20.435 15.755 1.00 . A A . 5 LYS HB2 1 1 19 1957 1 1 5 LYS HB3 H 13.051 19.648 14.156 1.00 . A A . 5 LYS HB3 1 1 19 1958 1 1 5 LYS HD2 H 11.014 19.120 16.778 1.00 . A A . 5 LYS HD2 1 1 19 1959 1 1 5 LYS HD3 H 11.044 19.269 15.021 1.00 . A A . 5 LYS HD3 1 1 19 1960 1 1 5 LYS HE2 H 9.472 17.425 15.325 1.00 . A A . 5 LYS HE2 1 1 19 1961 1 1 5 LYS HE3 H 10.959 16.768 14.789 1.00 . A A . 5 LYS HE3 1 1 19 1962 1 1 5 LYS HG2 H 13.135 17.495 15.367 1.00 . A A . 5 LYS HG2 1 1 19 1963 1 1 5 LYS HG3 H 13.057 18.442 16.893 1.00 . A A . 5 LYS HG3 1 1 19 1964 1 1 5 LYS HZ1 H 11.469 16.252 17.072 1.00 . A A . 5 LYS HZ1 1 1 19 1965 1 1 5 LYS HZ2 H 9.938 15.620 16.722 1.00 . A A . 5 LYS HZ2 1 1 19 1966 1 1 5 LYS HZ3 H 10.137 16.984 17.642 1.00 . A A . 5 LYS HZ3 1 1 19 1967 1 1 5 LYS N N 15.452 18.499 14.401 1.00 . A A . 5 LYS N 1 1 19 1968 1 1 5 LYS NZ N 10.502 16.447 16.863 1.00 . A A . 5 LYS NZ 1 1 19 1969 1 1 5 LYS O O 15.713 21.462 16.339 1.00 . A A . 5 LYS O 1 1 19 1970 1 1 6 DTH C C 18.352 19.046 18.496 1.00 . A A . 6 DTH C 1 1 19 1971 1 1 6 DTH CA C 17.846 19.998 17.423 1.00 . A A . 6 DTH CA 1 1 19 1972 1 1 6 DTH CB C 18.850 20.231 16.292 1.00 . A A . 6 DTH CB 1 1 19 1973 1 1 6 DTH CG2 C 20.076 20.958 16.835 1.00 . A A . 6 DTH CG2 1 1 19 1974 1 1 6 DTH H H 16.561 18.489 16.846 1.00 . A A . 6 DTH H 1 1 19 1975 1 1 6 DTH HA H 17.604 20.950 17.886 1.00 . A A . 6 DTH HA 1 1 19 1976 1 1 6 DTH HB H 18.386 20.857 15.527 1.00 . A A . 6 DTH HB 1 1 19 1977 1 1 6 DTH HG1 H 19.800 19.403 14.835 1.00 . A A . 6 DTH HG1 1 1 19 1978 1 1 6 DTH HG21 H 20.795 21.113 16.034 1.00 . A A . 6 DTH HG21 1 1 19 1979 1 1 6 DTH HG22 H 20.518 20.297 17.588 1.00 . A A . 6 DTH HG22 1 1 19 1980 1 1 6 DTH HG23 H 19.781 21.891 17.314 1.00 . A A . 6 DTH HG23 1 1 19 1981 1 1 6 DTH N N 16.617 19.491 16.847 1.00 . A A . 6 DTH N 1 1 19 1982 1 1 6 DTH O O 18.388 17.848 18.274 1.00 . A A . 6 DTH O 1 1 19 1983 1 1 6 DTH OG1 O 19.232 19.104 15.547 1.00 . A A . 6 DTH OG1 1 1 19 1984 1 1 7 . C C 18.461 17.780 21.229 1.00 . A A . 7 DAS C 1 1 19 1985 1 1 7 . CA C 19.226 19.035 20.821 1.00 . A A . 7 DAS CA 1 1 19 1986 1 1 7 . CB C 20.744 18.904 20.858 1.00 . A A . 7 DAS CB 1 1 19 1987 1 1 7 . CG C 21.598 20.165 20.916 1.00 . A A . 7 DAS CG 1 1 19 1988 1 1 7 . H H 18.777 20.679 19.591 1.00 . A A . 7 DAS H 1 1 19 1989 1 1 7 . HA H 19.090 19.789 21.601 1.00 . A A . 7 DAS HA 1 1 19 1990 1 1 7 . HB2 H 21.082 18.364 19.971 1.00 . A A . 7 DAS HB2 1 1 19 1991 1 1 7 . HB3 H 21.019 18.306 21.720 1.00 . A A . 7 DAS HB3 1 1 19 1992 1 1 7 . N N 18.793 19.667 19.598 1.00 . A A . 7 DAS N 1 1 19 1993 1 1 7 . O O 17.309 17.851 21.659 1.00 . A A . 7 DAS O 1 1 19 1994 1 1 7 . OD1 O 21.090 21.301 20.775 1.00 . A A . 7 DAS OD1 1 1 19 1995 1 1 7 . OD2 O 22.837 20.031 20.979 1.00 . A A . 7 DAS OD2 1 1 20 1996 1 1 1 GLN C C 17.224 14.941 20.535 1.00 . A A . 1 GLN C 1 1 20 1997 1 1 1 GLN CA C 18.573 15.301 21.160 1.00 . A A . 1 GLN CA 1 1 20 1998 1 1 1 GLN CB C 18.665 14.894 22.625 1.00 . A A . 1 GLN CB 1 1 20 1999 1 1 1 GLN CD C 20.135 14.788 24.709 1.00 . A A . 1 GLN CD 1 1 20 2000 1 1 1 GLN CG C 20.086 14.839 23.193 1.00 . A A . 1 GLN CG 1 1 20 2001 1 1 1 GLN H1 H 19.751 16.631 20.269 1.00 . A A . 1 GLN H1 1 1 20 2002 1 1 1 GLN HA H 19.197 14.596 20.606 1.00 . A A . 1 GLN HA 1 1 20 2003 1 1 1 GLN HB2 H 18.083 15.586 23.238 1.00 . A A . 1 GLN HB2 1 1 20 2004 1 1 1 GLN HB3 H 18.226 13.906 22.677 1.00 . A A . 1 GLN HB3 1 1 20 2005 1 1 1 GLN HE21 H 20.080 16.779 25.034 1.00 . A A . 1 GLN HE21 1 1 20 2006 1 1 1 GLN HE22 H 20.394 15.729 26.453 1.00 . A A . 1 GLN HE22 1 1 20 2007 1 1 1 GLN HG2 H 20.508 13.963 22.703 1.00 . A A . 1 GLN HG2 1 1 20 2008 1 1 1 GLN HG3 H 20.646 15.728 22.894 1.00 . A A . 1 GLN HG3 1 1 20 2009 1 1 1 GLN N N 19.037 16.660 20.983 1.00 . A A . 1 GLN N 1 1 20 2010 1 1 1 GLN NE2 N 20.265 15.879 25.465 1.00 . A A . 1 GLN NE2 1 1 20 2011 1 1 1 GLN O O 16.720 13.863 20.836 1.00 . A A . 1 GLN O 1 1 20 2012 1 1 1 GLN OE1 O 20.186 13.712 25.310 1.00 . A A . 1 GLN OE1 1 1 20 2013 1 1 2 ASP C C 16.215 15.648 17.409 1.00 . A A . 2 ASP C 1 1 20 2014 1 1 2 ASP CA C 15.610 15.679 18.810 1.00 . A A . 2 ASP CA 1 1 20 2015 1 1 2 ASP CB C 14.585 16.811 18.879 1.00 . A A . 2 ASP CB 1 1 20 2016 1 1 2 ASP CG C 14.132 17.085 20.311 1.00 . A A . 2 ASP CG 1 1 20 2017 1 1 2 ASP H H 17.337 16.655 19.506 1.00 . A A . 2 ASP H 1 1 20 2018 1 1 2 ASP HA H 15.171 14.711 19.005 1.00 . A A . 2 ASP HA 1 1 20 2019 1 1 2 ASP HB2 H 15.013 17.691 18.393 1.00 . A A . 2 ASP HB2 1 1 20 2020 1 1 2 ASP HB3 H 13.811 16.574 18.155 1.00 . A A . 2 ASP HB3 1 1 20 2021 1 1 2 ASP N N 16.774 15.838 19.653 1.00 . A A . 2 ASP N 1 1 20 2022 1 1 2 ASP O O 16.457 16.692 16.811 1.00 . A A . 2 ASP O 1 1 20 2023 1 1 2 ASP OD1 O 14.097 18.267 20.719 1.00 . A A . 2 ASP OD1 1 1 20 2024 1 1 2 ASP OD2 O 13.629 16.097 20.882 1.00 . A A . 2 ASP OD2 1 1 20 2025 1 1 3 PRO C C 16.122 15.408 14.387 1.00 . A A . 3 PRO C 1 1 20 2026 1 1 3 PRO CA C 16.698 14.388 15.361 1.00 . A A . 3 PRO CA 1 1 20 2027 1 1 3 PRO CB C 16.568 12.957 14.859 1.00 . A A . 3 PRO CB 1 1 20 2028 1 1 3 PRO CD C 16.017 13.149 17.228 1.00 . A A . 3 PRO CD 1 1 20 2029 1 1 3 PRO CG C 16.436 12.156 16.154 1.00 . A A . 3 PRO CG 1 1 20 2030 1 1 3 PRO HA H 17.778 14.557 15.345 1.00 . A A . 3 PRO HA 1 1 20 2031 1 1 3 PRO HB2 H 15.648 12.846 14.273 1.00 . A A . 3 PRO HB2 1 1 20 2032 1 1 3 PRO HB3 H 17.441 12.733 14.258 1.00 . A A . 3 PRO HB3 1 1 20 2033 1 1 3 PRO HD2 H 14.942 13.107 17.418 1.00 . A A . 3 PRO HD2 1 1 20 2034 1 1 3 PRO HD3 H 16.632 13.029 18.113 1.00 . A A . 3 PRO HD3 1 1 20 2035 1 1 3 PRO HG2 H 15.621 11.443 16.013 1.00 . A A . 3 PRO HG2 1 1 20 2036 1 1 3 PRO HG3 H 17.378 11.641 16.387 1.00 . A A . 3 PRO HG3 1 1 20 2037 1 1 3 PRO N N 16.259 14.495 16.738 1.00 . A A . 3 PRO N 1 1 20 2038 1 1 3 PRO O O 14.887 15.375 14.394 1.00 . A A . 3 PRO O 1 1 20 2039 1 1 4 DPR C C 15.354 18.233 13.077 1.00 . A A . 4 DPR C 1 1 20 2040 1 1 4 DPR CA C 16.107 17.040 12.518 1.00 . A A . 4 DPR CA 1 1 20 2041 1 1 4 DPR CB C 17.284 17.601 11.721 1.00 . A A . 4 DPR CB 1 1 20 2042 1 1 4 DPR CD C 18.133 15.965 13.109 1.00 . A A . 4 DPR CD 1 1 20 2043 1 1 4 DPR CG C 18.407 16.575 11.743 1.00 . A A . 4 DPR CG 1 1 20 2044 1 1 4 DPR HA H 15.470 16.320 12.002 1.00 . A A . 4 DPR HA 1 1 20 2045 1 1 4 DPR HB2 H 17.581 18.548 12.173 1.00 . A A . 4 DPR HB2 1 1 20 2046 1 1 4 DPR HB3 H 17.006 17.830 10.697 1.00 . A A . 4 DPR HB3 1 1 20 2047 1 1 4 DPR HD2 H 18.841 16.467 13.765 1.00 . A A . 4 DPR HD2 1 1 20 2048 1 1 4 DPR HD3 H 18.418 14.918 13.127 1.00 . A A . 4 DPR HD3 1 1 20 2049 1 1 4 DPR HG2 H 19.438 16.939 11.653 1.00 . A A . 4 DPR HG2 1 1 20 2050 1 1 4 DPR HG3 H 18.290 15.902 10.895 1.00 . A A . 4 DPR HG3 1 1 20 2051 1 1 4 DPR N N 16.741 16.153 13.474 1.00 . A A . 4 DPR N 1 1 20 2052 1 1 4 DPR O O 14.793 19.026 12.327 1.00 . A A . 4 DPR O 1 1 20 2053 1 1 5 LYS C C 16.086 20.207 15.944 1.00 . A A . 5 LYS C 1 1 20 2054 1 1 5 LYS CA C 14.957 19.638 15.104 1.00 . A A . 5 LYS CA 1 1 20 2055 1 1 5 LYS CB C 13.695 19.305 15.904 1.00 . A A . 5 LYS CB 1 1 20 2056 1 1 5 LYS CD C 12.057 19.559 17.866 1.00 . A A . 5 LYS CD 1 1 20 2057 1 1 5 LYS CE C 11.708 20.466 19.041 1.00 . A A . 5 LYS CE 1 1 20 2058 1 1 5 LYS CG C 13.252 20.127 17.111 1.00 . A A . 5 LYS CG 1 1 20 2059 1 1 5 LYS H H 15.818 17.753 14.984 1.00 . A A . 5 LYS H 1 1 20 2060 1 1 5 LYS HA H 14.765 20.465 14.427 1.00 . A A . 5 LYS HA 1 1 20 2061 1 1 5 LYS HB2 H 12.885 19.318 15.173 1.00 . A A . 5 LYS HB2 1 1 20 2062 1 1 5 LYS HB3 H 13.898 18.291 16.260 1.00 . A A . 5 LYS HB3 1 1 20 2063 1 1 5 LYS HD2 H 11.167 19.380 17.271 1.00 . A A . 5 LYS HD2 1 1 20 2064 1 1 5 LYS HD3 H 12.408 18.589 18.217 1.00 . A A . 5 LYS HD3 1 1 20 2065 1 1 5 LYS HE2 H 11.454 21.461 18.667 1.00 . A A . 5 LYS HE2 1 1 20 2066 1 1 5 LYS HE3 H 10.849 20.024 19.565 1.00 . A A . 5 LYS HE3 1 1 20 2067 1 1 5 LYS HG2 H 14.139 20.246 17.722 1.00 . A A . 5 LYS HG2 1 1 20 2068 1 1 5 LYS HG3 H 13.048 21.133 16.740 1.00 . A A . 5 LYS HG3 1 1 20 2069 1 1 5 LYS HZ1 H 12.581 20.916 20.867 1.00 . A A . 5 LYS HZ1 1 1 20 2070 1 1 5 LYS HZ2 H 13.663 21.198 19.732 1.00 . A A . 5 LYS HZ2 1 1 20 2071 1 1 5 LYS HZ3 H 13.261 19.709 20.065 1.00 . A A . 5 LYS HZ3 1 1 20 2072 1 1 5 LYS N N 15.354 18.437 14.395 1.00 . A A . 5 LYS N 1 1 20 2073 1 1 5 LYS NZ N 12.857 20.620 19.949 1.00 . A A . 5 LYS NZ 1 1 20 2074 1 1 5 LYS O O 16.322 21.394 15.707 1.00 . A A . 5 LYS O 1 1 20 2075 1 1 6 DTH C C 18.422 19.106 18.619 1.00 . A A . 6 DTH C 1 1 20 2076 1 1 6 DTH CA C 18.063 19.939 17.403 1.00 . A A . 6 DTH CA 1 1 20 2077 1 1 6 DTH CB C 19.214 20.003 16.396 1.00 . A A . 6 DTH CB 1 1 20 2078 1 1 6 DTH CG2 C 20.659 20.075 16.877 1.00 . A A . 6 DTH CG2 1 1 20 2079 1 1 6 DTH H H 16.816 18.458 16.652 1.00 . A A . 6 DTH H 1 1 20 2080 1 1 6 DTH HA H 17.788 20.953 17.702 1.00 . A A . 6 DTH HA 1 1 20 2081 1 1 6 DTH HB H 19.007 20.821 15.705 1.00 . A A . 6 DTH HB 1 1 20 2082 1 1 6 DTH HG1 H 19.766 19.028 14.861 1.00 . A A . 6 DTH HG1 1 1 20 2083 1 1 6 DTH HG21 H 20.849 21.049 17.334 1.00 . A A . 6 DTH HG21 1 1 20 2084 1 1 6 DTH HG22 H 21.375 19.912 16.075 1.00 . A A . 6 DTH HG22 1 1 20 2085 1 1 6 DTH HG23 H 20.888 19.379 17.688 1.00 . A A . 6 DTH HG23 1 1 20 2086 1 1 6 DTH N N 16.900 19.461 16.687 1.00 . A A . 6 DTH N 1 1 20 2087 1 1 6 DTH O O 18.543 17.884 18.498 1.00 . A A . 6 DTH O 1 1 20 2088 1 1 6 DTH OG1 O 19.198 18.837 15.609 1.00 . A A . 6 DTH OG1 1 1 20 2089 1 1 7 . C C 18.449 17.779 21.385 1.00 . A A . 7 DAS C 1 1 20 2090 1 1 7 . CA C 19.052 19.135 21.023 1.00 . A A . 7 DAS CA 1 1 20 2091 1 1 7 . CB C 20.542 19.222 21.323 1.00 . A A . 7 DAS CB 1 1 20 2092 1 1 7 . CG C 21.188 20.525 20.875 1.00 . A A . 7 DAS CG 1 1 20 2093 1 1 7 . H H 18.517 20.737 19.787 1.00 . A A . 7 DAS H 1 1 20 2094 1 1 7 . HA H 18.632 19.821 21.769 1.00 . A A . 7 DAS HA 1 1 20 2095 1 1 7 . HB2 H 21.009 18.479 20.675 1.00 . A A . 7 DAS HB2 1 1 20 2096 1 1 7 . HB3 H 20.694 18.987 22.374 1.00 . A A . 7 DAS HB3 1 1 20 2097 1 1 7 . N N 18.585 19.736 19.787 1.00 . A A . 7 DAS N 1 1 20 2098 1 1 7 . O O 17.463 17.700 22.111 1.00 . A A . 7 DAS O 1 1 20 2099 1 1 7 . OD1 O 22.232 20.443 20.181 1.00 . A A . 7 DAS OD1 1 1 20 2100 1 1 7 . OD2 O 20.582 21.598 21.076 1.00 . A A . 7 DAS OD2 1 1 stop_ save_
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