NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
623814 | 6bes | 30361 | cing | 4-filtered-FRED | STAR | entry | full | 14 |
data_FRED_restraints_with_modified_coordinates_PDB_code_6bes # This FRED archive file contains, for PDB entry <6bes>: # # - 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_6bes _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 6bes _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 1178.29 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 $_DAL_Q_DPR__DCY__DLY_DS_DTY__DCY_P_DSN_ A . 1 1 stop_ save_ save__DAL_Q_DPR__DCY__DLY_DS_DTY__DCY_P_DSN_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name " DAL Q DPR DCY DLY DS DTY DCY P DSN " _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code XQXXXDSXXPX _Entity.Number_of_monomers 11 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 DAL $DAL 1 1 2 GLN . 1 1 3 DPR $DPR 1 1 4 . $. 1 1 5 . $. 1 1 6 ASP . 1 1 7 SER . 1 1 8 . $. 1 1 9 . $. 1 1 10 PRO . 1 1 11 . $. 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 DAL 1 1 1 1 GLN 2 2 1 1 DPR 3 3 1 1 . 4 4 1 1 . 5 5 1 1 ASP 6 6 1 1 SER 7 7 1 1 . 8 8 1 1 . 9 9 1 1 PRO 10 10 1 1 . 11 11 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_DAL _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID DAL _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 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 2 GLN H . 2 . HN 1 1 1 1 2 1 1 2 GLN HA . 2 . HA 1 1 2 1 1 1 1 2 GLN H . 2 . HN 1 1 2 1 2 1 1 2 GLN HB2 . 2 . HB1 1 1 3 1 1 1 1 2 GLN H . 2 . HN 1 1 3 1 2 1 1 2 GLN HB3 . 2 . HB2 1 1 4 1 1 1 1 2 GLN H . 2 . HN 1 1 4 1 2 1 1 2 GLN HG2 . 2 . HG2 1 1 5 1 1 1 1 2 GLN H . 2 . HN 1 1 5 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1 6 1 1 1 1 3 DPR HA . 3 . HA 1 1 6 1 2 1 1 3 DPR HB3 . 3 . HB2 1 1 7 1 1 1 1 6 ASP H . 6 . HN 1 1 7 1 2 1 1 6 ASP HA . 6 . HA 1 1 8 1 1 1 1 6 ASP H . 6 . HN 1 1 8 1 2 1 1 6 ASP HB2 . 6 . HB1 1 1 9 1 1 1 1 6 ASP H . 6 . HN 1 1 9 1 2 1 1 6 ASP HB3 . 6 . HB2 1 1 10 1 1 1 1 7 SER H . 7 . HN 1 1 10 1 2 1 1 7 SER HA . 7 . HA 1 1 11 1 1 1 1 7 SER H . 7 . HN 1 1 11 1 2 1 1 7 SER HB2 . 7 . HB# 1 1 12 1 1 1 1 10 PRO HA . 10 . HA 1 1 12 1 2 1 1 10 PRO HB3 . 10 . HB2 1 1 13 1 1 1 1 10 PRO HD3 . 10 . HD2 1 1 13 1 2 1 1 10 PRO HG2 . 10 . HG1 1 1 14 1 1 1 1 10 PRO HD3 . 10 . HD2 1 1 14 1 2 1 1 10 PRO HG3 . 10 . HG2 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 . . . . . 3.5 2.3 4.7 1 1 3 1 . . . . . 4.5 2.9 6.1 1 1 4 1 . . . . . 4.5 2.9 6.1 1 1 5 1 . . . . . 3.5 2.3 4.7 1 1 6 1 . . . . . 3.5 2.3 4.7 1 1 7 1 . . . . . 4.5 2.9 6.1 1 1 8 1 . . . . . 3.5 2.3 4.7 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 . . . . . 3.5 2.3 4.7 1 1 13 1 . . . . . 3.5 2.3 4.7 1 1 14 1 . . . . . 3.5 2.3 4.7 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 DAL C C 33.260 36.680 11.460 1.00 . A A . 1 DAL C 1 1 1 2 1 1 1 DAL CA C 31.770 36.340 11.490 1.00 . A A . 1 DAL CA 1 1 1 3 1 1 1 DAL CB C 31.460 34.860 11.270 1.00 . A A . 1 DAL CB 1 1 1 4 1 1 1 DAL H1 H 30.830 35.990 13.370 1.00 . A A . 1 DAL H1 1 1 1 5 1 1 1 DAL HA H 31.290 36.920 10.700 1.00 . A A . 1 DAL HA 1 1 1 6 1 1 1 DAL HB1 H 31.950 34.560 10.350 1.00 . A A . 1 DAL HB1 1 1 1 7 1 1 1 DAL HB2 H 30.410 34.560 11.330 1.00 . A A . 1 DAL HB2 1 1 1 8 1 1 1 DAL HB3 H 32.070 34.260 11.940 1.00 . A A . 1 DAL HB3 1 1 1 9 1 1 1 DAL N N 31.130 36.710 12.730 1.00 . A A . 1 DAL N 1 1 1 10 1 1 1 DAL O O 33.840 36.870 10.390 1.00 . A A . 1 DAL O 1 1 1 11 1 1 2 GLN C C 36.210 36.020 12.400 1.00 . A A . 2 GLN C 1 1 1 12 1 1 2 GLN CA C 35.310 37.190 12.760 1.00 . A A . 2 GLN CA 1 1 1 13 1 1 2 GLN CB C 35.610 37.580 14.200 1.00 . A A . 2 GLN CB 1 1 1 14 1 1 2 GLN CD C 35.130 38.820 16.320 1.00 . A A . 2 GLN CD 1 1 1 15 1 1 2 GLN CG C 34.930 38.800 14.810 1.00 . A A . 2 GLN CG 1 1 1 16 1 1 2 GLN H H 33.380 36.730 13.460 1.00 . A A . 2 GLN H 1 1 1 17 1 1 2 GLN HA H 35.530 37.990 12.050 1.00 . A A . 2 GLN HA 1 1 1 18 1 1 2 GLN HB2 H 35.400 36.700 14.810 1.00 . A A . 2 GLN HB2 1 1 1 19 1 1 2 GLN HB3 H 36.680 37.730 14.370 1.00 . A A . 2 GLN HB3 1 1 1 20 1 1 2 GLN HE21 H 33.730 37.340 16.640 1.00 . A A . 2 GLN HE21 1 1 1 21 1 1 2 GLN HE22 H 34.560 37.950 18.040 1.00 . A A . 2 GLN HE22 1 1 1 22 1 1 2 GLN HG2 H 35.360 39.730 14.430 1.00 . A A . 2 GLN HG2 1 1 1 23 1 1 2 GLN HG3 H 33.840 38.750 14.770 1.00 . A A . 2 GLN HG3 1 1 1 24 1 1 2 GLN N N 33.910 36.830 12.610 1.00 . A A . 2 GLN N 1 1 1 25 1 1 2 GLN NE2 N 34.380 37.990 17.050 1.00 . A A . 2 GLN NE2 1 1 1 26 1 1 2 GLN O O 35.950 34.960 12.980 1.00 . A A . 2 GLN O 1 1 1 27 1 1 2 GLN OE1 O 36.090 39.410 16.820 1.00 . A A . 2 GLN OE1 1 1 1 28 1 1 3 DPR C C 37.490 33.850 10.770 1.00 . A A . 3 DPR C 1 1 1 29 1 1 3 DPR CA C 38.200 35.080 11.320 1.00 . A A . 3 DPR CA 1 1 1 30 1 1 3 DPR CB C 39.390 35.630 10.540 1.00 . A A . 3 DPR CB 1 1 1 31 1 1 3 DPR CD C 37.530 37.210 10.640 1.00 . A A . 3 DPR CD 1 1 1 32 1 1 3 DPR CG C 38.650 36.700 9.740 1.00 . A A . 3 DPR CG 1 1 1 33 1 1 3 DPR HA H 38.560 34.820 12.320 1.00 . A A . 3 DPR HA 1 1 1 34 1 1 3 DPR HB2 H 39.760 34.870 9.850 1.00 . A A . 3 DPR HB2 1 1 1 35 1 1 3 DPR HB3 H 40.130 36.070 11.200 1.00 . A A . 3 DPR HB3 1 1 1 36 1 1 3 DPR HD2 H 36.640 37.500 10.080 1.00 . A A . 3 DPR HD2 1 1 1 37 1 1 3 DPR HD3 H 37.910 37.970 11.330 1.00 . A A . 3 DPR HD3 1 1 1 38 1 1 3 DPR HG2 H 38.230 36.350 8.800 1.00 . A A . 3 DPR HG2 1 1 1 39 1 1 3 DPR HG3 H 39.350 37.490 9.480 1.00 . A A . 3 DPR HG3 1 1 1 40 1 1 3 DPR N N 37.200 36.110 11.510 1.00 . A A . 3 DPR N 1 1 1 41 1 1 3 DPR O O 36.650 33.880 9.880 1.00 . A A . 3 DPR O 1 1 1 42 1 1 4 . C C 38.010 30.250 11.330 1.00 . A A . 4 DCY C 1 1 1 43 1 1 4 . CA C 37.080 31.450 11.280 1.00 . A A . 4 DCY CA 1 1 1 44 1 1 4 . CB C 36.060 31.380 12.410 1.00 . A A . 4 DCY CB 1 1 1 45 1 1 4 . H H 38.520 32.750 12.060 1.00 . A A . 4 DCY H 1 1 1 46 1 1 4 . HA H 36.490 31.380 10.370 1.00 . A A . 4 DCY HA 1 1 1 47 1 1 4 . HB2 H 35.520 32.320 12.300 1.00 . A A . 4 DCY HB2 1 1 1 48 1 1 4 . HB3 H 36.590 31.490 13.360 1.00 . A A . 4 DCY HB3 1 1 1 49 1 1 4 . N N 37.850 32.680 11.310 1.00 . A A . 4 DCY N 1 1 1 50 1 1 4 . O O 39.090 30.280 11.920 1.00 . A A . 4 DCY O 1 1 1 51 1 1 4 . SG S 34.720 30.170 12.580 1.00 . A A . 4 DCY SG 1 1 1 52 1 1 5 . C C 38.390 27.450 12.520 1.00 . A A . 5 DLY C 1 1 1 53 1 1 5 . CA C 38.250 27.850 11.060 1.00 . A A . 5 DLY CA 1 1 1 54 1 1 5 . CB C 37.530 26.790 10.230 1.00 . A A . 5 DLY CB 1 1 1 55 1 1 5 . CD C 37.070 25.700 8.040 1.00 . A A . 5 DLY CD 1 1 1 56 1 1 5 . CE C 37.300 25.820 6.540 1.00 . A A . 5 DLY CE 1 1 1 57 1 1 5 . CG C 37.790 26.860 8.720 1.00 . A A . 5 DLY CG 1 1 1 58 1 1 5 . H H 36.610 29.170 10.470 1.00 . A A . 5 DLY H 1 1 1 59 1 1 5 . HA H 39.220 28.060 10.610 1.00 . A A . 5 DLY HA 1 1 1 60 1 1 5 . HB2 H 36.450 26.840 10.390 1.00 . A A . 5 DLY HB2 1 1 1 61 1 1 5 . HB3 H 37.810 25.800 10.570 1.00 . A A . 5 DLY HB3 1 1 1 62 1 1 5 . HD2 H 36.010 25.760 8.310 1.00 . A A . 5 DLY HD2 1 1 1 63 1 1 5 . HD3 H 37.370 24.720 8.420 1.00 . A A . 5 DLY HD3 1 1 1 64 1 1 5 . HE2 H 37.210 24.810 6.150 1.00 . A A . 5 DLY HE2 1 1 1 65 1 1 5 . HE3 H 38.330 26.120 6.330 1.00 . A A . 5 DLY HE3 1 1 1 66 1 1 5 . HG2 H 38.840 26.890 8.430 1.00 . A A . 5 DLY HG2 1 1 1 67 1 1 5 . HG3 H 37.360 27.780 8.350 1.00 . A A . 5 DLY HG3 1 1 1 68 1 1 5 . HZ1 H 35.400 26.390 5.850 1.00 . A A . 5 DLY HZ1 1 1 1 69 1 1 5 . HZ2 H 36.680 26.740 4.860 1.00 . A A . 5 DLY HZ2 1 1 1 70 1 1 5 . HZ3 H 36.270 27.630 6.190 1.00 . A A . 5 DLY HZ3 1 1 1 71 1 1 5 . N N 37.490 29.080 10.960 1.00 . A A . 5 DLY N 1 1 1 72 1 1 5 . NZ N 36.360 26.690 5.820 1.00 . A A . 5 DLY NZ 1 1 1 73 1 1 5 . O O 37.420 27.290 13.250 1.00 . A A . 5 DLY O 1 1 1 74 1 1 6 ASP C C 39.910 28.540 15.300 1.00 . A A . 6 ASP C 1 1 1 75 1 1 6 ASP CA C 39.980 27.350 14.360 1.00 . A A . 6 ASP CA 1 1 1 76 1 1 6 ASP CB C 41.390 26.770 14.350 1.00 . A A . 6 ASP CB 1 1 1 77 1 1 6 ASP CG C 42.410 27.750 13.790 1.00 . A A . 6 ASP CG 1 1 1 78 1 1 6 ASP H H 40.400 27.670 12.320 1.00 . A A . 6 ASP H 1 1 1 79 1 1 6 ASP HA H 39.280 26.620 14.770 1.00 . A A . 6 ASP HA 1 1 1 80 1 1 6 ASP HB2 H 41.710 26.470 15.340 1.00 . A A . 6 ASP HB2 1 1 1 81 1 1 6 ASP HB3 H 41.400 25.820 13.800 1.00 . A A . 6 ASP HB3 1 1 1 82 1 1 6 ASP N N 39.640 27.590 12.980 1.00 . A A . 6 ASP N 1 1 1 83 1 1 6 ASP O O 39.810 28.340 16.510 1.00 . A A . 6 ASP O 1 1 1 84 1 1 6 ASP OD1 O 42.940 28.540 14.600 1.00 . A A . 6 ASP OD1 1 1 1 85 1 1 6 ASP OD2 O 42.540 27.870 12.550 1.00 . A A . 6 ASP OD2 1 1 1 86 1 1 7 SER C C 38.970 31.960 15.190 1.00 . A A . 7 SER C 1 1 1 87 1 1 7 SER CA C 40.050 30.990 15.630 1.00 . A A . 7 SER CA 1 1 1 88 1 1 7 SER CB C 41.440 31.630 15.640 1.00 . A A . 7 SER CB 1 1 1 89 1 1 7 SER H H 39.820 30.020 13.850 1.00 . A A . 7 SER H 1 1 1 90 1 1 7 SER HA H 39.860 30.790 16.690 1.00 . A A . 7 SER HA 1 1 1 91 1 1 7 SER HB2 H 41.700 31.910 14.620 1.00 . A A . 7 SER HB2 1 1 1 92 1 1 7 SER HB3 H 41.440 32.510 16.270 1.00 . A A . 7 SER HB3 1 1 1 93 1 1 7 SER HG H 42.650 30.160 15.290 1.00 . A A . 7 SER HG 1 1 1 94 1 1 7 SER N N 39.970 29.790 14.830 1.00 . A A . 7 SER N 1 1 1 95 1 1 7 SER O O 39.030 32.380 14.030 1.00 . A A . 7 SER O 1 1 1 96 1 1 7 SER OG O 42.420 30.700 16.050 1.00 . A A . 7 SER OG 1 1 1 97 1 1 8 . C C 35.890 33.480 16.390 1.00 . A A . 8 DTY C 1 1 1 98 1 1 8 . CA C 37.330 33.680 15.910 1.00 . A A . 8 DTY CA 1 1 1 99 1 1 8 . CB C 37.970 34.830 16.680 1.00 . A A . 8 DTY CB 1 1 1 100 1 1 8 . CD1 C 39.340 36.050 14.980 1.00 . A A . 8 DTY CD1 1 1 1 101 1 1 8 . CD2 C 40.480 34.990 16.850 1.00 . A A . 8 DTY CD2 1 1 1 102 1 1 8 . CE1 C 40.570 36.350 14.380 1.00 . A A . 8 DTY CE1 1 1 1 103 1 1 8 . CE2 C 41.720 35.470 16.400 1.00 . A A . 8 DTY CE2 1 1 1 104 1 1 8 . CG C 39.300 35.310 16.170 1.00 . A A . 8 DTY CG 1 1 1 105 1 1 8 . CZ C 41.720 36.160 15.170 1.00 . A A . 8 DTY CZ 1 1 1 106 1 1 8 . H H 37.940 31.950 16.920 1.00 . A A . 8 DTY H 1 1 1 107 1 1 8 . HA H 37.340 33.980 14.870 1.00 . A A . 8 DTY HA 1 1 1 108 1 1 8 . HB2 H 38.240 34.470 17.680 1.00 . A A . 8 DTY HB2 1 1 1 109 1 1 8 . HB3 H 37.320 35.700 16.680 1.00 . A A . 8 DTY HB3 1 1 1 110 1 1 8 . HD1 H 38.510 36.100 14.300 1.00 . A A . 8 DTY HD1 1 1 1 111 1 1 8 . HD2 H 40.460 34.440 17.770 1.00 . A A . 8 DTY HD2 1 1 1 112 1 1 8 . HE1 H 40.690 36.700 13.360 1.00 . A A . 8 DTY HE1 1 1 1 113 1 1 8 . HE2 H 42.620 35.300 16.970 1.00 . A A . 8 DTY HE2 1 1 1 114 1 1 8 . HH H 43.630 36.520 15.530 1.00 . A A . 8 DTY HH 1 1 1 115 1 1 8 . N N 38.110 32.470 16.070 1.00 . A A . 8 DTY N 1 1 1 116 1 1 8 . O O 35.700 33.140 17.550 1.00 . A A . 8 DTY O 1 1 1 117 1 1 8 . OH O 42.950 36.670 14.870 1.00 . A A . 8 DTY OH 1 1 1 118 1 1 9 . C C 32.530 34.020 15.630 1.00 . A A . 9 DCY C 1 1 1 119 1 1 9 . CA C 33.620 32.960 15.740 1.00 . A A . 9 DCY CA 1 1 1 120 1 1 9 . CB C 33.250 31.880 14.730 1.00 . A A . 9 DCY CB 1 1 1 121 1 1 9 . H H 35.110 33.750 14.500 1.00 . A A . 9 DCY H 1 1 1 122 1 1 9 . HA H 33.550 32.550 16.750 1.00 . A A . 9 DCY HA 1 1 1 123 1 1 9 . HB2 H 33.200 32.260 13.710 1.00 . A A . 9 DCY HB2 1 1 1 124 1 1 9 . HB3 H 32.240 31.480 14.870 1.00 . A A . 9 DCY HB3 1 1 1 125 1 1 9 . N N 34.940 33.480 15.450 1.00 . A A . 9 DCY N 1 1 1 126 1 1 9 . O O 32.410 34.620 14.570 1.00 . A A . 9 DCY O 1 1 1 127 1 1 9 . SG S 34.370 30.460 14.560 1.00 . A A . 9 DCY SG 1 1 1 128 1 1 10 PRO C C 30.850 36.560 15.940 1.00 . A A . 10 PRO C 1 1 1 129 1 1 10 PRO CA C 30.560 35.190 16.540 1.00 . A A . 10 PRO CA 1 1 1 130 1 1 10 PRO CB C 30.040 35.470 17.940 1.00 . A A . 10 PRO CB 1 1 1 131 1 1 10 PRO CD C 31.760 33.820 18.010 1.00 . A A . 10 PRO CD 1 1 1 132 1 1 10 PRO CG C 30.370 34.120 18.570 1.00 . A A . 10 PRO CG 1 1 1 133 1 1 10 PRO HA H 29.830 34.670 15.920 1.00 . A A . 10 PRO HA 1 1 1 134 1 1 10 PRO HB2 H 30.630 36.290 18.360 1.00 . A A . 10 PRO HB2 1 1 1 135 1 1 10 PRO HB3 H 28.980 35.740 17.860 1.00 . A A . 10 PRO HB3 1 1 1 136 1 1 10 PRO HD2 H 32.470 34.410 18.580 1.00 . A A . 10 PRO HD2 1 1 1 137 1 1 10 PRO HD3 H 32.040 32.780 18.190 1.00 . A A . 10 PRO HD3 1 1 1 138 1 1 10 PRO HG2 H 30.500 34.180 19.650 1.00 . A A . 10 PRO HG2 1 1 1 139 1 1 10 PRO HG3 H 29.660 33.330 18.340 1.00 . A A . 10 PRO HG3 1 1 1 140 1 1 10 PRO N N 31.720 34.320 16.650 1.00 . A A . 10 PRO N 1 1 1 141 1 1 10 PRO O O 31.980 37.050 15.950 1.00 . A A . 10 PRO O 1 1 1 142 1 1 11 . C C 30.760 37.970 13.000 1.00 . A A . 11 DSN C 1 1 1 143 1 1 11 . CA C 30.020 38.200 14.310 1.00 . A A . 11 DSN CA 1 1 1 144 1 1 11 . CB C 28.690 38.830 13.930 1.00 . A A . 11 DSN CB 1 1 1 145 1 1 11 . H H 28.920 36.740 15.330 1.00 . A A . 11 DSN H 1 1 1 146 1 1 11 . HA H 30.670 38.890 14.850 1.00 . A A . 11 DSN HA 1 1 1 147 1 1 11 . HB2 H 28.230 38.070 13.300 1.00 . A A . 11 DSN HB2 1 1 1 148 1 1 11 . HB3 H 28.710 39.690 13.250 1.00 . A A . 11 DSN HB3 1 1 1 149 1 1 11 . HG H 27.170 38.680 15.080 1.00 . A A . 11 DSN HG 1 1 1 150 1 1 11 . N N 29.870 37.060 15.190 1.00 . A A . 11 DSN N 1 1 1 151 1 1 11 . O O 31.060 38.900 12.250 1.00 . A A . 11 DSN O 1 1 1 152 1 1 11 . OG O 27.930 39.260 15.040 1.00 . A A . 11 DSN OG 1 1 2 153 1 1 1 DAL C C 33.079 36.636 11.409 1.00 . A A . 1 DAL C 1 1 2 154 1 1 1 DAL CA C 31.605 36.304 11.541 1.00 . A A . 1 DAL CA 1 1 2 155 1 1 1 DAL CB C 31.320 34.817 11.338 1.00 . A A . 1 DAL CB 1 1 2 156 1 1 1 DAL H1 H 30.939 36.110 13.602 1.00 . A A . 1 DAL H1 1 1 2 157 1 1 1 DAL HA H 31.073 36.902 10.797 1.00 . A A . 1 DAL HA 1 1 2 158 1 1 1 DAL HB1 H 32.147 34.280 11.819 1.00 . A A . 1 DAL HB1 1 1 2 159 1 1 1 DAL HB2 H 31.283 34.486 10.302 1.00 . A A . 1 DAL HB2 1 1 2 160 1 1 1 DAL HB3 H 30.351 34.482 11.710 1.00 . A A . 1 DAL HB3 1 1 2 161 1 1 1 DAL N N 30.934 36.678 12.772 1.00 . A A . 1 DAL N 1 1 2 162 1 1 1 DAL O O 33.639 36.814 10.329 1.00 . A A . 1 DAL O 1 1 2 163 1 1 2 GLN C C 35.973 36.007 12.572 1.00 . A A . 2 GLN C 1 1 2 164 1 1 2 GLN CA C 35.061 37.219 12.694 1.00 . A A . 2 GLN CA 1 1 2 165 1 1 2 GLN CB C 35.490 37.996 13.929 1.00 . A A . 2 GLN CB 1 1 2 166 1 1 2 GLN CD C 35.311 40.092 15.218 1.00 . A A . 2 GLN CD 1 1 2 167 1 1 2 GLN CG C 35.046 39.455 13.859 1.00 . A A . 2 GLN CG 1 1 2 168 1 1 2 GLN H H 33.126 36.771 13.435 1.00 . A A . 2 GLN H 1 1 2 169 1 1 2 GLN HA H 35.275 37.951 11.908 1.00 . A A . 2 GLN HA 1 1 2 170 1 1 2 GLN HB2 H 35.160 37.440 14.805 1.00 . A A . 2 GLN HB2 1 1 2 171 1 1 2 GLN HB3 H 36.585 38.014 13.945 1.00 . A A . 2 GLN HB3 1 1 2 172 1 1 2 GLN HE21 H 34.014 41.616 14.855 1.00 . A A . 2 GLN HE21 1 1 2 173 1 1 2 GLN HE22 H 34.771 41.594 16.427 1.00 . A A . 2 GLN HE22 1 1 2 174 1 1 2 GLN HG2 H 35.542 40.076 13.115 1.00 . A A . 2 GLN HG2 1 1 2 175 1 1 2 GLN HG3 H 33.959 39.563 13.743 1.00 . A A . 2 GLN HG3 1 1 2 176 1 1 2 GLN N N 33.659 36.899 12.586 1.00 . A A . 2 GLN N 1 1 2 177 1 1 2 GLN NE2 N 34.539 41.119 15.571 1.00 . A A . 2 GLN NE2 1 1 2 178 1 1 2 GLN O O 35.760 34.925 13.121 1.00 . A A . 2 GLN O 1 1 2 179 1 1 2 GLN OE1 O 36.186 39.727 15.990 1.00 . A A . 2 GLN OE1 1 1 2 180 1 1 3 DPR C C 37.450 33.852 11.033 1.00 . A A . 3 DPR C 1 1 2 181 1 1 3 DPR CA C 38.127 35.030 11.725 1.00 . A A . 3 DPR CA 1 1 2 182 1 1 3 DPR CB C 39.280 35.670 10.952 1.00 . A A . 3 DPR CB 1 1 2 183 1 1 3 DPR CD C 37.463 37.155 11.004 1.00 . A A . 3 DPR CD 1 1 2 184 1 1 3 DPR CG C 38.526 36.635 10.036 1.00 . A A . 3 DPR CG 1 1 2 185 1 1 3 DPR HA H 38.575 34.754 12.679 1.00 . A A . 3 DPR HA 1 1 2 186 1 1 3 DPR HB2 H 39.868 34.862 10.501 1.00 . A A . 3 DPR HB2 1 1 2 187 1 1 3 DPR HB3 H 39.968 36.204 11.601 1.00 . A A . 3 DPR HB3 1 1 2 188 1 1 3 DPR HD2 H 36.612 37.531 10.434 1.00 . A A . 3 DPR HD2 1 1 2 189 1 1 3 DPR HD3 H 37.735 38.074 11.521 1.00 . A A . 3 DPR HD3 1 1 2 190 1 1 3 DPR HG2 H 37.985 36.037 9.313 1.00 . A A . 3 DPR HG2 1 1 2 191 1 1 3 DPR HG3 H 39.125 37.460 9.677 1.00 . A A . 3 DPR HG3 1 1 2 192 1 1 3 DPR N N 37.120 36.054 11.884 1.00 . A A . 3 DPR N 1 1 2 193 1 1 3 DPR O O 36.531 33.962 10.228 1.00 . A A . 3 DPR O 1 1 2 194 1 1 4 . C C 38.131 30.195 11.328 1.00 . A A . 4 DCY C 1 1 2 195 1 1 4 . CA C 37.197 31.400 11.297 1.00 . A A . 4 DCY CA 1 1 2 196 1 1 4 . CB C 36.358 31.318 12.569 1.00 . A A . 4 DCY CB 1 1 2 197 1 1 4 . H H 38.753 32.625 11.968 1.00 . A A . 4 DCY H 1 1 2 198 1 1 4 . HA H 36.574 31.372 10.409 1.00 . A A . 4 DCY HA 1 1 2 199 1 1 4 . HB2 H 36.093 32.304 12.961 1.00 . A A . 4 DCY HB2 1 1 2 200 1 1 4 . HB3 H 36.980 30.960 13.400 1.00 . A A . 4 DCY HB3 1 1 2 201 1 1 4 . N N 37.897 32.659 11.444 1.00 . A A . 4 DCY N 1 1 2 202 1 1 4 . O O 39.165 30.283 11.995 1.00 . A A . 4 DCY O 1 1 2 203 1 1 4 . SG S 34.885 30.279 12.482 1.00 . A A . 4 DCY SG 1 1 2 204 1 1 5 . C C 38.330 27.636 12.551 1.00 . A A . 5 DLY C 1 1 2 205 1 1 5 . CA C 38.454 27.861 11.049 1.00 . A A . 5 DLY CA 1 1 2 206 1 1 5 . CB C 37.974 26.744 10.134 1.00 . A A . 5 DLY CB 1 1 2 207 1 1 5 . CD C 38.352 24.519 9.125 1.00 . A A . 5 DLY CD 1 1 2 208 1 1 5 . CE C 39.334 23.395 8.794 1.00 . A A . 5 DLY CE 1 1 2 209 1 1 5 . CG C 39.021 25.661 9.886 1.00 . A A . 5 DLY CG 1 1 2 210 1 1 5 . H H 36.804 29.140 10.354 1.00 . A A . 5 DLY H 1 1 2 211 1 1 5 . HA H 39.500 28.018 10.783 1.00 . A A . 5 DLY HA 1 1 2 212 1 1 5 . HB2 H 37.761 27.194 9.167 1.00 . A A . 5 DLY HB2 1 1 2 213 1 1 5 . HB3 H 37.159 26.232 10.657 1.00 . A A . 5 DLY HB3 1 1 2 214 1 1 5 . HD2 H 37.960 24.960 8.203 1.00 . A A . 5 DLY HD2 1 1 2 215 1 1 5 . HD3 H 37.638 24.065 9.805 1.00 . A A . 5 DLY HD3 1 1 2 216 1 1 5 . HE2 H 38.862 22.584 8.245 1.00 . A A . 5 DLY HE2 1 1 2 217 1 1 5 . HE3 H 39.809 22.944 9.669 1.00 . A A . 5 DLY HE3 1 1 2 218 1 1 5 . HG2 H 39.407 25.248 10.818 1.00 . A A . 5 DLY HG2 1 1 2 219 1 1 5 . HG3 H 39.829 26.158 9.339 1.00 . A A . 5 DLY HG3 1 1 2 220 1 1 5 . HZ1 H 40.625 23.179 7.222 1.00 . A A . 5 DLY HZ1 1 1 2 221 1 1 5 . HZ2 H 41.196 24.240 8.352 1.00 . A A . 5 DLY HZ2 1 1 2 222 1 1 5 . HZ3 H 40.044 24.486 7.127 1.00 . A A . 5 DLY HZ3 1 1 2 223 1 1 5 . N N 37.737 29.079 10.715 1.00 . A A . 5 DLY N 1 1 2 224 1 1 5 . NZ N 40.373 23.900 7.883 1.00 . A A . 5 DLY NZ 1 1 2 225 1 1 5 . O O 37.228 27.474 13.063 1.00 . A A . 5 DLY O 1 1 2 226 1 1 6 ASP C C 39.936 28.641 15.352 1.00 . A A . 6 ASP C 1 1 2 227 1 1 6 ASP CA C 39.776 27.336 14.577 1.00 . A A . 6 ASP CA 1 1 2 228 1 1 6 ASP CB C 41.053 26.510 14.779 1.00 . A A . 6 ASP CB 1 1 2 229 1 1 6 ASP CG C 42.195 27.180 14.025 1.00 . A A . 6 ASP CG 1 1 2 230 1 1 6 ASP H H 40.334 27.776 12.645 1.00 . A A . 6 ASP H 1 1 2 231 1 1 6 ASP HA H 38.909 26.775 14.931 1.00 . A A . 6 ASP HA 1 1 2 232 1 1 6 ASP HB2 H 41.271 26.392 15.835 1.00 . A A . 6 ASP HB2 1 1 2 233 1 1 6 ASP HB3 H 40.802 25.512 14.410 1.00 . A A . 6 ASP HB3 1 1 2 234 1 1 6 ASP N N 39.513 27.563 13.179 1.00 . A A . 6 ASP N 1 1 2 235 1 1 6 ASP O O 39.866 28.674 16.576 1.00 . A A . 6 ASP O 1 1 2 236 1 1 6 ASP OD1 O 42.638 26.558 13.040 1.00 . A A . 6 ASP OD1 1 1 2 237 1 1 6 ASP OD2 O 42.662 28.301 14.317 1.00 . A A . 6 ASP OD2 1 1 2 238 1 1 7 SER C C 39.252 32.096 14.969 1.00 . A A . 7 SER C 1 1 2 239 1 1 7 SER CA C 40.318 31.089 15.378 1.00 . A A . 7 SER CA 1 1 2 240 1 1 7 SER CB C 41.732 31.581 15.096 1.00 . A A . 7 SER CB 1 1 2 241 1 1 7 SER H H 40.144 29.793 13.726 1.00 . A A . 7 SER H 1 1 2 242 1 1 7 SER HA H 40.285 31.015 16.469 1.00 . A A . 7 SER HA 1 1 2 243 1 1 7 SER HB2 H 41.935 31.779 14.046 1.00 . A A . 7 SER HB2 1 1 2 244 1 1 7 SER HB3 H 41.840 32.527 15.630 1.00 . A A . 7 SER HB3 1 1 2 245 1 1 7 SER HG H 42.595 29.816 15.116 1.00 . A A . 7 SER HG 1 1 2 246 1 1 7 SER N N 40.145 29.804 14.735 1.00 . A A . 7 SER N 1 1 2 247 1 1 7 SER O O 39.275 32.549 13.822 1.00 . A A . 7 SER O 1 1 2 248 1 1 7 SER OG O 42.638 30.633 15.623 1.00 . A A . 7 SER OG 1 1 2 249 1 1 8 . C C 35.940 33.011 16.152 1.00 . A A . 8 DTY C 1 1 2 250 1 1 8 . CA C 37.321 33.432 15.647 1.00 . A A . 8 DTY CA 1 1 2 251 1 1 8 . CB C 37.648 34.748 16.344 1.00 . A A . 8 DTY CB 1 1 2 252 1 1 8 . CD1 C 39.104 36.507 15.300 1.00 . A A . 8 DTY CD1 1 1 2 253 1 1 8 . CD2 C 40.124 34.778 16.698 1.00 . A A . 8 DTY CD2 1 1 2 254 1 1 8 . CE1 C 40.358 37.113 15.151 1.00 . A A . 8 DTY CE1 1 1 2 255 1 1 8 . CE2 C 41.358 35.413 16.527 1.00 . A A . 8 DTY CE2 1 1 2 256 1 1 8 . CG C 39.011 35.339 16.057 1.00 . A A . 8 DTY CG 1 1 2 257 1 1 8 . CZ C 41.514 36.594 15.777 1.00 . A A . 8 DTY CZ 1 1 2 258 1 1 8 . H H 38.207 31.800 16.669 1.00 . A A . 8 DTY H 1 1 2 259 1 1 8 . HA H 37.306 33.709 14.589 1.00 . A A . 8 DTY HA 1 1 2 260 1 1 8 . HB2 H 37.588 34.599 17.422 1.00 . A A . 8 DTY HB2 1 1 2 261 1 1 8 . HB3 H 36.888 35.468 16.030 1.00 . A A . 8 DTY HB3 1 1 2 262 1 1 8 . HD1 H 38.232 36.916 14.803 1.00 . A A . 8 DTY HD1 1 1 2 263 1 1 8 . HD2 H 40.013 33.960 17.393 1.00 . A A . 8 DTY HD2 1 1 2 264 1 1 8 . HE1 H 40.487 37.958 14.493 1.00 . A A . 8 DTY HE1 1 1 2 265 1 1 8 . HE2 H 42.201 35.033 17.094 1.00 . A A . 8 DTY HE2 1 1 2 266 1 1 8 . HH H 43.471 36.779 15.961 1.00 . A A . 8 DTY HH 1 1 2 267 1 1 8 . N N 38.259 32.340 15.821 1.00 . A A . 8 DTY N 1 1 2 268 1 1 8 . O O 35.812 32.302 17.149 1.00 . A A . 8 DTY O 1 1 2 269 1 1 8 . OH O 42.728 37.149 15.490 1.00 . A A . 8 DTY OH 1 1 2 270 1 1 9 . C C 32.568 34.181 15.646 1.00 . A A . 9 DCY C 1 1 2 271 1 1 9 . CA C 33.543 33.004 15.595 1.00 . A A . 9 DCY CA 1 1 2 272 1 1 9 . CB C 33.281 32.073 14.413 1.00 . A A . 9 DCY CB 1 1 2 273 1 1 9 . H H 35.080 34.121 14.691 1.00 . A A . 9 DCY H 1 1 2 274 1 1 9 . HA H 33.404 32.406 16.497 1.00 . A A . 9 DCY HA 1 1 2 275 1 1 9 . HB2 H 33.357 32.617 13.469 1.00 . A A . 9 DCY HB2 1 1 2 276 1 1 9 . HB3 H 32.218 31.848 14.476 1.00 . A A . 9 DCY HB3 1 1 2 277 1 1 9 . N N 34.911 33.440 15.413 1.00 . A A . 9 DCY N 1 1 2 278 1 1 9 . O O 31.936 34.485 14.636 1.00 . A A . 9 DCY O 1 1 2 279 1 1 9 . SG S 34.256 30.551 14.399 1.00 . A A . 9 DCY SG 1 1 2 280 1 1 10 PRO C C 31.566 36.985 15.866 1.00 . A A . 10 PRO C 1 1 2 281 1 1 10 PRO CA C 31.475 35.936 16.955 1.00 . A A . 10 PRO CA 1 1 2 282 1 1 10 PRO CB C 31.771 36.529 18.323 1.00 . A A . 10 PRO CB 1 1 2 283 1 1 10 PRO CD C 33.024 34.567 18.094 1.00 . A A . 10 PRO CD 1 1 2 284 1 1 10 PRO CG C 32.205 35.321 19.131 1.00 . A A . 10 PRO CG 1 1 2 285 1 1 10 PRO HA H 30.498 35.456 16.954 1.00 . A A . 10 PRO HA 1 1 2 286 1 1 10 PRO HB2 H 32.510 37.336 18.243 1.00 . A A . 10 PRO HB2 1 1 2 287 1 1 10 PRO HB3 H 30.854 36.922 18.770 1.00 . A A . 10 PRO HB3 1 1 2 288 1 1 10 PRO HD2 H 34.022 35.001 18.040 1.00 . A A . 10 PRO HD2 1 1 2 289 1 1 10 PRO HD3 H 33.172 33.523 18.367 1.00 . A A . 10 PRO HD3 1 1 2 290 1 1 10 PRO HG2 H 32.900 35.618 19.928 1.00 . A A . 10 PRO HG2 1 1 2 291 1 1 10 PRO HG3 H 31.351 34.758 19.517 1.00 . A A . 10 PRO HG3 1 1 2 292 1 1 10 PRO N N 32.405 34.822 16.808 1.00 . A A . 10 PRO N 1 1 2 293 1 1 10 PRO O O 32.683 37.206 15.390 1.00 . A A . 10 PRO O 1 1 2 294 1 1 11 . C C 30.538 37.940 12.943 1.00 . A A . 11 DSN C 1 1 2 295 1 1 11 . CA C 30.209 38.416 14.357 1.00 . A A . 11 DSN CA 1 1 2 296 1 1 11 . CB C 28.825 39.035 14.470 1.00 . A A . 11 DSN CB 1 1 2 297 1 1 11 . H H 29.515 37.055 15.731 1.00 . A A . 11 DSN H 1 1 2 298 1 1 11 . HA H 30.937 39.150 14.718 1.00 . A A . 11 DSN HA 1 1 2 299 1 1 11 . HB2 H 28.584 39.765 13.689 1.00 . A A . 11 DSN HB2 1 1 2 300 1 1 11 . HB3 H 28.805 39.560 15.417 1.00 . A A . 11 DSN HB3 1 1 2 301 1 1 11 . HG H 27.020 38.271 14.216 1.00 . A A . 11 DSN HG 1 1 2 302 1 1 11 . N N 30.389 37.429 15.399 1.00 . A A . 11 DSN N 1 1 2 303 1 1 11 . O O 30.467 38.751 12.014 1.00 . A A . 11 DSN O 1 1 2 304 1 1 11 . OG O 27.900 37.972 14.450 1.00 . A A . 11 DSN OG 1 1 3 305 1 1 1 DAL C C 33.103 36.760 11.388 1.00 . A A . 1 DAL C 1 1 3 306 1 1 1 DAL CA C 31.586 36.753 11.423 1.00 . A A . 1 DAL CA 1 1 3 307 1 1 1 DAL CB C 31.059 35.480 10.746 1.00 . A A . 1 DAL CB 1 1 3 308 1 1 1 DAL H1 H 30.686 36.236 13.289 1.00 . A A . 1 DAL H1 1 1 3 309 1 1 1 DAL HA H 31.301 37.634 10.833 1.00 . A A . 1 DAL HA 1 1 3 310 1 1 1 DAL HB1 H 31.480 35.487 9.737 1.00 . A A . 1 DAL HB1 1 1 3 311 1 1 1 DAL HB2 H 29.974 35.541 10.696 1.00 . A A . 1 DAL HB2 1 1 3 312 1 1 1 DAL HB3 H 31.454 34.609 11.260 1.00 . A A . 1 DAL HB3 1 1 3 313 1 1 1 DAL N N 31.004 37.001 12.726 1.00 . A A . 1 DAL N 1 1 3 314 1 1 1 DAL O O 33.629 36.583 10.286 1.00 . A A . 1 DAL O 1 1 3 315 1 1 2 GLN C C 36.012 35.992 12.342 1.00 . A A . 2 GLN C 1 1 3 316 1 1 2 GLN CA C 35.231 37.270 12.579 1.00 . A A . 2 GLN CA 1 1 3 317 1 1 2 GLN CB C 35.626 37.859 13.929 1.00 . A A . 2 GLN CB 1 1 3 318 1 1 2 GLN CD C 35.769 39.999 15.292 1.00 . A A . 2 GLN CD 1 1 3 319 1 1 2 GLN CG C 35.212 39.319 14.052 1.00 . A A . 2 GLN CG 1 1 3 320 1 1 2 GLN H H 33.225 37.077 13.326 1.00 . A A . 2 GLN H 1 1 3 321 1 1 2 GLN HA H 35.432 37.972 11.783 1.00 . A A . 2 GLN HA 1 1 3 322 1 1 2 GLN HB2 H 35.313 37.256 14.780 1.00 . A A . 2 GLN HB2 1 1 3 323 1 1 2 GLN HB3 H 36.714 37.945 13.981 1.00 . A A . 2 GLN HB3 1 1 3 324 1 1 2 GLN HE21 H 34.691 41.720 14.878 1.00 . A A . 2 GLN HE21 1 1 3 325 1 1 2 GLN HE22 H 35.765 41.816 16.196 1.00 . A A . 2 GLN HE22 1 1 3 326 1 1 2 GLN HG2 H 35.415 40.001 13.216 1.00 . A A . 2 GLN HG2 1 1 3 327 1 1 2 GLN HG3 H 34.126 39.335 14.160 1.00 . A A . 2 GLN HG3 1 1 3 328 1 1 2 GLN N N 33.799 37.027 12.496 1.00 . A A . 2 GLN N 1 1 3 329 1 1 2 GLN NE2 N 35.307 41.233 15.519 1.00 . A A . 2 GLN NE2 1 1 3 330 1 1 2 GLN O O 35.639 34.937 12.853 1.00 . A A . 2 GLN O 1 1 3 331 1 1 2 GLN OE1 O 36.637 39.455 15.966 1.00 . A A . 2 GLN OE1 1 1 3 332 1 1 3 DPR C C 37.538 33.831 10.945 1.00 . A A . 3 DPR C 1 1 3 333 1 1 3 DPR CA C 38.195 35.089 11.480 1.00 . A A . 3 DPR CA 1 1 3 334 1 1 3 DPR CB C 39.287 35.724 10.630 1.00 . A A . 3 DPR CB 1 1 3 335 1 1 3 DPR CD C 37.595 37.330 11.083 1.00 . A A . 3 DPR CD 1 1 3 336 1 1 3 DPR CG C 39.067 37.229 10.715 1.00 . A A . 3 DPR CG 1 1 3 337 1 1 3 DPR HA H 38.609 34.866 12.464 1.00 . A A . 3 DPR HA 1 1 3 338 1 1 3 DPR HB2 H 39.177 35.458 9.579 1.00 . A A . 3 DPR HB2 1 1 3 339 1 1 3 DPR HB3 H 40.237 35.417 11.069 1.00 . A A . 3 DPR HB3 1 1 3 340 1 1 3 DPR HD2 H 36.977 37.613 10.232 1.00 . A A . 3 DPR HD2 1 1 3 341 1 1 3 DPR HD3 H 37.463 38.176 11.767 1.00 . A A . 3 DPR HD3 1 1 3 342 1 1 3 DPR HG2 H 39.228 37.723 9.753 1.00 . A A . 3 DPR HG2 1 1 3 343 1 1 3 DPR HG3 H 39.732 37.608 11.488 1.00 . A A . 3 DPR HG3 1 1 3 344 1 1 3 DPR N N 37.134 36.063 11.623 1.00 . A A . 3 DPR N 1 1 3 345 1 1 3 DPR O O 36.761 33.956 10.004 1.00 . A A . 3 DPR O 1 1 3 346 1 1 4 . C C 38.081 30.312 11.580 1.00 . A A . 4 DCY C 1 1 3 347 1 1 4 . CA C 37.057 31.386 11.226 1.00 . A A . 4 DCY CA 1 1 3 348 1 1 4 . CB C 35.843 31.460 12.149 1.00 . A A . 4 DCY CB 1 1 3 349 1 1 4 . H H 38.539 32.580 12.100 1.00 . A A . 4 DCY H 1 1 3 350 1 1 4 . HA H 36.721 31.137 10.223 1.00 . A A . 4 DCY HA 1 1 3 351 1 1 4 . HB2 H 35.354 32.440 12.084 1.00 . A A . 4 DCY HB2 1 1 3 352 1 1 4 . HB3 H 36.251 31.438 13.164 1.00 . A A . 4 DCY HB3 1 1 3 353 1 1 4 . N N 37.831 32.597 11.388 1.00 . A A . 4 DCY N 1 1 3 354 1 1 4 . O O 39.123 30.538 12.176 1.00 . A A . 4 DCY O 1 1 3 355 1 1 4 . SG S 34.613 30.170 11.862 1.00 . A A . 4 DCY SG 1 1 3 356 1 1 5 . C C 38.604 27.648 12.931 1.00 . A A . 5 DLY C 1 1 3 357 1 1 5 . CA C 38.416 27.877 11.432 1.00 . A A . 5 DLY CA 1 1 3 358 1 1 5 . CB C 37.625 26.732 10.809 1.00 . A A . 5 DLY CB 1 1 3 359 1 1 5 . CD C 39.351 25.255 9.934 1.00 . A A . 5 DLY CD 1 1 3 360 1 1 5 . CE C 40.278 24.117 10.349 1.00 . A A . 5 DLY CE 1 1 3 361 1 1 5 . CG C 38.299 25.380 11.033 1.00 . A A . 5 DLY CG 1 1 3 362 1 1 5 . H H 36.846 29.038 10.627 1.00 . A A . 5 DLY H 1 1 3 363 1 1 5 . HA H 39.332 27.862 10.846 1.00 . A A . 5 DLY HA 1 1 3 364 1 1 5 . HB2 H 37.433 26.875 9.742 1.00 . A A . 5 DLY HB2 1 1 3 365 1 1 5 . HB3 H 36.620 26.710 11.234 1.00 . A A . 5 DLY HB3 1 1 3 366 1 1 5 . HD2 H 39.865 26.191 9.706 1.00 . A A . 5 DLY HD2 1 1 3 367 1 1 5 . HD3 H 38.727 24.988 9.089 1.00 . A A . 5 DLY HD3 1 1 3 368 1 1 5 . HE2 H 39.732 23.193 10.508 1.00 . A A . 5 DLY HE2 1 1 3 369 1 1 5 . HE3 H 40.797 24.383 11.269 1.00 . A A . 5 DLY HE3 1 1 3 370 1 1 5 . HG2 H 37.492 24.687 10.790 1.00 . A A . 5 DLY HG2 1 1 3 371 1 1 5 . HG3 H 38.721 25.187 12.019 1.00 . A A . 5 DLY HG3 1 1 3 372 1 1 5 . HZ1 H 40.617 23.805 8.472 1.00 . A A . 5 DLY HZ1 1 1 3 373 1 1 5 . HZ2 H 41.911 23.200 9.447 1.00 . A A . 5 DLY HZ2 1 1 3 374 1 1 5 . HZ3 H 41.776 24.773 9.047 1.00 . A A . 5 DLY HZ3 1 1 3 375 1 1 5 . N N 37.721 29.108 11.126 1.00 . A A . 5 DLY N 1 1 3 376 1 1 5 . NZ N 41.248 23.940 9.248 1.00 . A A . 5 DLY NZ 1 1 3 377 1 1 5 . O O 37.646 27.518 13.689 1.00 . A A . 5 DLY O 1 1 3 378 1 1 6 ASP C C 40.291 28.706 15.504 1.00 . A A . 6 ASP C 1 1 3 379 1 1 6 ASP CA C 40.282 27.433 14.678 1.00 . A A . 6 ASP CA 1 1 3 380 1 1 6 ASP CB C 41.677 26.831 14.747 1.00 . A A . 6 ASP CB 1 1 3 381 1 1 6 ASP CG C 42.807 27.602 14.089 1.00 . A A . 6 ASP CG 1 1 3 382 1 1 6 ASP H H 40.531 27.897 12.578 1.00 . A A . 6 ASP H 1 1 3 383 1 1 6 ASP HA H 39.561 26.779 15.168 1.00 . A A . 6 ASP HA 1 1 3 384 1 1 6 ASP HB2 H 41.977 26.626 15.776 1.00 . A A . 6 ASP HB2 1 1 3 385 1 1 6 ASP HB3 H 41.524 25.876 14.233 1.00 . A A . 6 ASP HB3 1 1 3 386 1 1 6 ASP N N 39.883 27.584 13.290 1.00 . A A . 6 ASP N 1 1 3 387 1 1 6 ASP O O 40.530 28.569 16.707 1.00 . A A . 6 ASP O 1 1 3 388 1 1 6 ASP OD1 O 43.977 27.588 14.546 1.00 . A A . 6 ASP OD1 1 1 3 389 1 1 6 ASP OD2 O 42.628 28.329 13.083 1.00 . A A . 6 ASP OD2 1 1 3 390 1 1 7 SER C C 39.104 32.154 15.091 1.00 . A A . 7 SER C 1 1 3 391 1 1 7 SER CA C 40.056 31.131 15.673 1.00 . A A . 7 SER CA 1 1 3 392 1 1 7 SER CB C 41.466 31.647 15.403 1.00 . A A . 7 SER CB 1 1 3 393 1 1 7 SER H H 39.718 29.975 13.980 1.00 . A A . 7 SER H 1 1 3 394 1 1 7 SER HA H 39.772 31.009 16.719 1.00 . A A . 7 SER HA 1 1 3 395 1 1 7 SER HB2 H 41.700 31.609 14.344 1.00 . A A . 7 SER HB2 1 1 3 396 1 1 7 SER HB3 H 41.553 32.718 15.579 1.00 . A A . 7 SER HB3 1 1 3 397 1 1 7 SER HG H 43.176 31.532 16.329 1.00 . A A . 7 SER HG 1 1 3 398 1 1 7 SER N N 39.985 29.874 14.942 1.00 . A A . 7 SER N 1 1 3 399 1 1 7 SER O O 39.293 32.751 14.037 1.00 . A A . 7 SER O 1 1 3 400 1 1 7 SER OG O 42.441 30.954 16.152 1.00 . A A . 7 SER OG 1 1 3 401 1 1 8 . C C 35.572 32.519 15.530 1.00 . A A . 8 DTY C 1 1 3 402 1 1 8 . CA C 36.900 33.232 15.361 1.00 . A A . 8 DTY CA 1 1 3 403 1 1 8 . CB C 36.871 34.597 16.057 1.00 . A A . 8 DTY CB 1 1 3 404 1 1 8 . CD1 C 38.636 36.097 15.115 1.00 . A A . 8 DTY CD1 1 1 3 405 1 1 8 . CD2 C 39.136 34.921 17.165 1.00 . A A . 8 DTY CD2 1 1 3 406 1 1 8 . CE1 C 39.863 36.779 15.147 1.00 . A A . 8 DTY CE1 1 1 3 407 1 1 8 . CE2 C 40.282 35.704 17.326 1.00 . A A . 8 DTY CE2 1 1 3 408 1 1 8 . CG C 38.258 35.183 16.106 1.00 . A A . 8 DTY CG 1 1 3 409 1 1 8 . CZ C 40.639 36.612 16.311 1.00 . A A . 8 DTY CZ 1 1 3 410 1 1 8 . H H 37.781 31.808 16.596 1.00 . A A . 8 DTY H 1 1 3 411 1 1 8 . HA H 37.060 33.272 14.288 1.00 . A A . 8 DTY HA 1 1 3 412 1 1 8 . HB2 H 36.617 34.532 17.119 1.00 . A A . 8 DTY HB2 1 1 3 413 1 1 8 . HB3 H 36.142 35.240 15.571 1.00 . A A . 8 DTY HB3 1 1 3 414 1 1 8 . HD1 H 37.909 36.292 14.344 1.00 . A A . 8 DTY HD1 1 1 3 415 1 1 8 . HD2 H 38.780 34.168 17.855 1.00 . A A . 8 DTY HD2 1 1 3 416 1 1 8 . HE1 H 40.179 37.412 14.335 1.00 . A A . 8 DTY HE1 1 1 3 417 1 1 8 . HE2 H 40.839 35.528 18.223 1.00 . A A . 8 DTY HE2 1 1 3 418 1 1 8 . HH H 42.281 37.251 17.121 1.00 . A A . 8 DTY HH 1 1 3 419 1 1 8 . N N 38.000 32.402 15.806 1.00 . A A . 8 DTY N 1 1 3 420 1 1 8 . O O 35.583 31.513 16.239 1.00 . A A . 8 DTY O 1 1 3 421 1 1 8 . OH O 41.826 37.275 16.272 1.00 . A A . 8 DTY OH 1 1 3 422 1 1 9 . C C 32.152 33.707 15.271 1.00 . A A . 9 DCY C 1 1 3 423 1 1 9 . CA C 33.100 32.546 15.006 1.00 . A A . 9 DCY CA 1 1 3 424 1 1 9 . CB C 32.722 31.696 13.797 1.00 . A A . 9 DCY CB 1 1 3 425 1 1 9 . H H 34.611 33.718 14.230 1.00 . A A . 9 DCY H 1 1 3 426 1 1 9 . HA H 33.021 31.763 15.757 1.00 . A A . 9 DCY HA 1 1 3 427 1 1 9 . HB2 H 32.857 32.244 12.868 1.00 . A A . 9 DCY HB2 1 1 3 428 1 1 9 . HB3 H 31.673 31.482 14.018 1.00 . A A . 9 DCY HB3 1 1 3 429 1 1 9 . N N 34.484 32.965 14.905 1.00 . A A . 9 DCY N 1 1 3 430 1 1 9 . O O 31.464 34.120 14.341 1.00 . A A . 9 DCY O 1 1 3 431 1 1 9 . SG S 33.639 30.135 13.651 1.00 . A A . 9 DCY SG 1 1 3 432 1 1 10 PRO C C 31.272 36.532 16.002 1.00 . A A . 10 PRO C 1 1 3 433 1 1 10 PRO CA C 31.126 35.296 16.863 1.00 . A A . 10 PRO CA 1 1 3 434 1 1 10 PRO CB C 31.382 35.669 18.317 1.00 . A A . 10 PRO CB 1 1 3 435 1 1 10 PRO CD C 32.849 33.889 17.657 1.00 . A A . 10 PRO CD 1 1 3 436 1 1 10 PRO CG C 32.126 34.457 18.873 1.00 . A A . 10 PRO CG 1 1 3 437 1 1 10 PRO HA H 30.109 34.880 16.803 1.00 . A A . 10 PRO HA 1 1 3 438 1 1 10 PRO HB2 H 31.959 36.582 18.386 1.00 . A A . 10 PRO HB2 1 1 3 439 1 1 10 PRO HB3 H 30.459 35.831 18.884 1.00 . A A . 10 PRO HB3 1 1 3 440 1 1 10 PRO HD2 H 33.853 34.264 17.450 1.00 . A A . 10 PRO HD2 1 1 3 441 1 1 10 PRO HD3 H 33.086 32.825 17.767 1.00 . A A . 10 PRO HD3 1 1 3 442 1 1 10 PRO HG2 H 32.745 34.762 19.721 1.00 . A A . 10 PRO HG2 1 1 3 443 1 1 10 PRO HG3 H 31.344 33.775 19.202 1.00 . A A . 10 PRO HG3 1 1 3 444 1 1 10 PRO N N 32.057 34.246 16.498 1.00 . A A . 10 PRO N 1 1 3 445 1 1 10 PRO O O 32.398 36.966 15.767 1.00 . A A . 10 PRO O 1 1 3 446 1 1 11 . C C 30.831 38.201 13.280 1.00 . A A . 11 DSN C 1 1 3 447 1 1 11 . CA C 30.222 38.267 14.678 1.00 . A A . 11 DSN CA 1 1 3 448 1 1 11 . CB C 28.802 38.808 14.585 1.00 . A A . 11 DSN CB 1 1 3 449 1 1 11 . H H 29.280 36.582 15.557 1.00 . A A . 11 DSN H 1 1 3 450 1 1 11 . HA H 30.920 38.971 15.147 1.00 . A A . 11 DSN HA 1 1 3 451 1 1 11 . HB2 H 28.800 39.792 14.108 1.00 . A A . 11 DSN HB2 1 1 3 452 1 1 11 . HB3 H 28.433 38.869 15.605 1.00 . A A . 11 DSN HB3 1 1 3 453 1 1 11 . HG H 27.236 38.240 13.695 1.00 . A A . 11 DSN HG 1 1 3 454 1 1 11 . N N 30.161 37.069 15.484 1.00 . A A . 11 DSN N 1 1 3 455 1 1 11 . O O 31.151 39.229 12.680 1.00 . A A . 11 DSN O 1 1 3 456 1 1 11 . OG O 28.068 37.818 13.916 1.00 . A A . 11 DSN OG 1 1 4 457 1 1 1 DAL C C 32.936 36.645 11.264 1.00 . A A . 1 DAL C 1 1 4 458 1 1 1 DAL CA C 31.423 36.499 11.298 1.00 . A A . 1 DAL CA 1 1 4 459 1 1 1 DAL CB C 31.042 35.058 10.955 1.00 . A A . 1 DAL CB 1 1 4 460 1 1 1 DAL H1 H 30.641 36.021 13.175 1.00 . A A . 1 DAL H1 1 1 4 461 1 1 1 DAL HA H 31.042 37.023 10.425 1.00 . A A . 1 DAL HA 1 1 4 462 1 1 1 DAL HB1 H 31.305 34.313 11.704 1.00 . A A . 1 DAL HB1 1 1 4 463 1 1 1 DAL HB2 H 31.345 34.784 9.944 1.00 . A A . 1 DAL HB2 1 1 4 464 1 1 1 DAL HB3 H 29.951 34.998 10.850 1.00 . A A . 1 DAL HB3 1 1 4 465 1 1 1 DAL N N 30.774 36.812 12.561 1.00 . A A . 1 DAL N 1 1 4 466 1 1 1 DAL O O 33.511 36.599 10.184 1.00 . A A . 1 DAL O 1 1 4 467 1 1 2 GLN C C 35.979 36.207 12.577 1.00 . A A . 2 GLN C 1 1 4 468 1 1 2 GLN CA C 34.945 37.331 12.558 1.00 . A A . 2 GLN CA 1 1 4 469 1 1 2 GLN CB C 35.063 38.176 13.823 1.00 . A A . 2 GLN CB 1 1 4 470 1 1 2 GLN CD C 34.429 40.486 14.722 1.00 . A A . 2 GLN CD 1 1 4 471 1 1 2 GLN CG C 34.252 39.448 13.619 1.00 . A A . 2 GLN CG 1 1 4 472 1 1 2 GLN H H 33.011 36.704 13.224 1.00 . A A . 2 GLN H 1 1 4 473 1 1 2 GLN HA H 35.127 37.976 11.706 1.00 . A A . 2 GLN HA 1 1 4 474 1 1 2 GLN HB2 H 34.720 37.631 14.694 1.00 . A A . 2 GLN HB2 1 1 4 475 1 1 2 GLN HB3 H 36.145 38.335 13.912 1.00 . A A . 2 GLN HB3 1 1 4 476 1 1 2 GLN HE21 H 33.607 41.854 13.505 1.00 . A A . 2 GLN HE21 1 1 4 477 1 1 2 GLN HE22 H 34.260 42.454 15.013 1.00 . A A . 2 GLN HE22 1 1 4 478 1 1 2 GLN HG2 H 34.597 39.926 12.694 1.00 . A A . 2 GLN HG2 1 1 4 479 1 1 2 GLN HG3 H 33.180 39.240 13.582 1.00 . A A . 2 GLN HG3 1 1 4 480 1 1 2 GLN N N 33.585 36.866 12.403 1.00 . A A . 2 GLN N 1 1 4 481 1 1 2 GLN NE2 N 33.923 41.688 14.451 1.00 . A A . 2 GLN NE2 1 1 4 482 1 1 2 GLN O O 35.764 35.253 13.323 1.00 . A A . 2 GLN O 1 1 4 483 1 1 2 GLN OE1 O 35.005 40.262 15.787 1.00 . A A . 2 GLN OE1 1 1 4 484 1 1 3 DPR C C 37.522 34.053 11.057 1.00 . A A . 3 DPR C 1 1 4 485 1 1 3 DPR CA C 38.100 35.334 11.665 1.00 . A A . 3 DPR CA 1 1 4 486 1 1 3 DPR CB C 39.282 35.940 10.925 1.00 . A A . 3 DPR CB 1 1 4 487 1 1 3 DPR CD C 37.424 37.492 11.008 1.00 . A A . 3 DPR CD 1 1 4 488 1 1 3 DPR CG C 38.950 37.425 10.889 1.00 . A A . 3 DPR CG 1 1 4 489 1 1 3 DPR HA H 38.598 35.066 12.597 1.00 . A A . 3 DPR HA 1 1 4 490 1 1 3 DPR HB2 H 39.371 35.628 9.886 1.00 . A A . 3 DPR HB2 1 1 4 491 1 1 3 DPR HB3 H 40.247 35.802 11.420 1.00 . A A . 3 DPR HB3 1 1 4 492 1 1 3 DPR HD2 H 36.921 37.361 10.046 1.00 . A A . 3 DPR HD2 1 1 4 493 1 1 3 DPR HD3 H 37.155 38.393 11.554 1.00 . A A . 3 DPR HD3 1 1 4 494 1 1 3 DPR HG2 H 39.302 37.821 9.940 1.00 . A A . 3 DPR HG2 1 1 4 495 1 1 3 DPR HG3 H 39.428 37.876 11.749 1.00 . A A . 3 DPR HG3 1 1 4 496 1 1 3 DPR N N 37.079 36.351 11.832 1.00 . A A . 3 DPR N 1 1 4 497 1 1 3 DPR O O 36.826 33.999 10.045 1.00 . A A . 3 DPR O 1 1 4 498 1 1 4 . C C 38.373 30.439 11.455 1.00 . A A . 4 DCY C 1 1 4 499 1 1 4 . CA C 37.388 31.607 11.442 1.00 . A A . 4 DCY CA 1 1 4 500 1 1 4 . CB C 36.381 31.346 12.556 1.00 . A A . 4 DCY CB 1 1 4 501 1 1 4 . H H 38.578 33.112 12.420 1.00 . A A . 4 DCY H 1 1 4 502 1 1 4 . HA H 36.786 31.588 10.532 1.00 . A A . 4 DCY HA 1 1 4 503 1 1 4 . HB2 H 35.801 32.259 12.693 1.00 . A A . 4 DCY HB2 1 1 4 504 1 1 4 . HB3 H 36.956 31.140 13.464 1.00 . A A . 4 DCY HB3 1 1 4 505 1 1 4 . N N 37.900 32.938 11.678 1.00 . A A . 4 DCY N 1 1 4 506 1 1 4 . O O 39.499 30.522 11.935 1.00 . A A . 4 DCY O 1 1 4 507 1 1 4 . SG S 35.144 30.042 12.474 1.00 . A A . 4 DCY SG 1 1 4 508 1 1 5 . C C 38.366 27.543 12.644 1.00 . A A . 5 DLY C 1 1 4 509 1 1 5 . CA C 38.501 27.935 11.179 1.00 . A A . 5 DLY CA 1 1 4 510 1 1 5 . CB C 37.890 26.956 10.191 1.00 . A A . 5 DLY CB 1 1 4 511 1 1 5 . CD C 38.020 24.695 9.221 1.00 . A A . 5 DLY CD 1 1 4 512 1 1 5 . CE C 38.954 23.494 9.048 1.00 . A A . 5 DLY CE 1 1 4 513 1 1 5 . CG C 38.762 25.703 10.081 1.00 . A A . 5 DLY CG 1 1 4 514 1 1 5 . H H 37.188 29.268 10.313 1.00 . A A . 5 DLY H 1 1 4 515 1 1 5 . HA H 39.579 27.950 11.016 1.00 . A A . 5 DLY HA 1 1 4 516 1 1 5 . HB2 H 37.790 27.497 9.260 1.00 . A A . 5 DLY HB2 1 1 4 517 1 1 5 . HB3 H 36.900 26.598 10.498 1.00 . A A . 5 DLY HB3 1 1 4 518 1 1 5 . HD2 H 37.623 25.047 8.268 1.00 . A A . 5 DLY HD2 1 1 4 519 1 1 5 . HD3 H 37.134 24.317 9.713 1.00 . A A . 5 DLY HD3 1 1 4 520 1 1 5 . HE2 H 39.268 23.196 10.039 1.00 . A A . 5 DLY HE2 1 1 4 521 1 1 5 . HE3 H 39.821 23.815 8.456 1.00 . A A . 5 DLY HE3 1 1 4 522 1 1 5 . HG2 H 39.058 25.363 11.075 1.00 . A A . 5 DLY HG2 1 1 4 523 1 1 5 . HG3 H 39.641 25.900 9.465 1.00 . A A . 5 DLY HG3 1 1 4 524 1 1 5 . HZ1 H 37.434 22.138 8.839 1.00 . A A . 5 DLY HZ1 1 1 4 525 1 1 5 . HZ2 H 38.950 21.570 8.571 1.00 . A A . 5 DLY HZ2 1 1 4 526 1 1 5 . HZ3 H 38.196 22.556 7.414 1.00 . A A . 5 DLY HZ3 1 1 4 527 1 1 5 . N N 37.997 29.271 10.918 1.00 . A A . 5 DLY N 1 1 4 528 1 1 5 . NZ N 38.321 22.339 8.400 1.00 . A A . 5 DLY NZ 1 1 4 529 1 1 5 . O O 37.265 27.512 13.197 1.00 . A A . 5 DLY O 1 1 4 530 1 1 6 ASP C C 39.692 28.386 15.469 1.00 . A A . 6 ASP C 1 1 4 531 1 1 6 ASP CA C 39.627 27.097 14.676 1.00 . A A . 6 ASP CA 1 1 4 532 1 1 6 ASP CB C 40.791 26.183 15.025 1.00 . A A . 6 ASP CB 1 1 4 533 1 1 6 ASP CG C 42.111 26.566 14.384 1.00 . A A . 6 ASP CG 1 1 4 534 1 1 6 ASP H H 40.405 27.459 12.749 1.00 . A A . 6 ASP H 1 1 4 535 1 1 6 ASP HA H 38.727 26.576 14.999 1.00 . A A . 6 ASP HA 1 1 4 536 1 1 6 ASP HB2 H 40.834 26.244 16.119 1.00 . A A . 6 ASP HB2 1 1 4 537 1 1 6 ASP HB3 H 40.526 25.174 14.688 1.00 . A A . 6 ASP HB3 1 1 4 538 1 1 6 ASP N N 39.538 27.323 13.247 1.00 . A A . 6 ASP N 1 1 4 539 1 1 6 ASP O O 39.553 28.338 16.695 1.00 . A A . 6 ASP O 1 1 4 540 1 1 6 ASP OD1 O 42.989 25.812 13.890 1.00 . A A . 6 ASP OD1 1 1 4 541 1 1 6 ASP OD2 O 42.229 27.791 14.162 1.00 . A A . 6 ASP OD2 1 1 4 542 1 1 7 SER C C 39.422 31.977 15.073 1.00 . A A . 7 SER C 1 1 4 543 1 1 7 SER CA C 40.238 30.767 15.492 1.00 . A A . 7 SER CA 1 1 4 544 1 1 7 SER CB C 41.684 31.018 15.094 1.00 . A A . 7 SER CB 1 1 4 545 1 1 7 SER H H 39.835 29.556 13.806 1.00 . A A . 7 SER H 1 1 4 546 1 1 7 SER HA H 40.230 30.672 16.577 1.00 . A A . 7 SER HA 1 1 4 547 1 1 7 SER HB2 H 41.734 31.066 14.006 1.00 . A A . 7 SER HB2 1 1 4 548 1 1 7 SER HB3 H 41.968 32.035 15.374 1.00 . A A . 7 SER HB3 1 1 4 549 1 1 7 SER HG H 42.475 29.315 15.221 1.00 . A A . 7 SER HG 1 1 4 550 1 1 7 SER N N 39.850 29.542 14.814 1.00 . A A . 7 SER N 1 1 4 551 1 1 7 SER O O 39.571 32.499 13.966 1.00 . A A . 7 SER O 1 1 4 552 1 1 7 SER OG O 42.540 30.119 15.742 1.00 . A A . 7 SER OG 1 1 4 553 1 1 8 . C C 36.009 32.817 16.018 1.00 . A A . 8 DTY C 1 1 4 554 1 1 8 . CA C 37.369 33.338 15.572 1.00 . A A . 8 DTY CA 1 1 4 555 1 1 8 . CB C 37.703 34.678 16.218 1.00 . A A . 8 DTY CB 1 1 4 556 1 1 8 . CD1 C 40.105 35.104 15.749 1.00 . A A . 8 DTY CD1 1 1 4 557 1 1 8 . CD2 C 38.512 36.794 15.091 1.00 . A A . 8 DTY CD2 1 1 4 558 1 1 8 . CE1 C 41.149 35.811 15.144 1.00 . A A . 8 DTY CE1 1 1 4 559 1 1 8 . CE2 C 39.539 37.543 14.517 1.00 . A A . 8 DTY CE2 1 1 4 560 1 1 8 . CG C 38.781 35.493 15.537 1.00 . A A . 8 DTY CG 1 1 4 561 1 1 8 . CZ C 40.855 37.059 14.556 1.00 . A A . 8 DTY CZ 1 1 4 562 1 1 8 . H H 38.257 31.889 16.728 1.00 . A A . 8 DTY H 1 1 4 563 1 1 8 . HA H 37.316 33.458 14.500 1.00 . A A . 8 DTY HA 1 1 4 564 1 1 8 . HB2 H 37.940 34.567 17.279 1.00 . A A . 8 DTY HB2 1 1 4 565 1 1 8 . HB3 H 36.761 35.199 16.066 1.00 . A A . 8 DTY HB3 1 1 4 566 1 1 8 . HD1 H 40.223 34.166 16.277 1.00 . A A . 8 DTY HD1 1 1 4 567 1 1 8 . HD2 H 37.498 37.149 15.226 1.00 . A A . 8 DTY HD2 1 1 4 568 1 1 8 . HE1 H 42.181 35.478 15.173 1.00 . A A . 8 DTY HE1 1 1 4 569 1 1 8 . HE2 H 39.413 38.534 14.100 1.00 . A A . 8 DTY HE2 1 1 4 570 1 1 8 . HH H 41.465 38.682 13.718 1.00 . A A . 8 DTY HH 1 1 4 571 1 1 8 . N N 38.406 32.358 15.844 1.00 . A A . 8 DTY N 1 1 4 572 1 1 8 . O O 35.897 32.138 17.042 1.00 . A A . 8 DTY O 1 1 4 573 1 1 8 . OH O 41.843 37.882 14.091 1.00 . A A . 8 DTY OH 1 1 4 574 1 1 9 . C C 32.542 33.896 15.429 1.00 . A A . 9 DCY C 1 1 4 575 1 1 9 . CA C 33.581 32.778 15.430 1.00 . A A . 9 DCY CA 1 1 4 576 1 1 9 . CB C 33.243 31.766 14.334 1.00 . A A . 9 DCY CB 1 1 4 577 1 1 9 . H H 35.075 33.998 14.689 1.00 . A A . 9 DCY H 1 1 4 578 1 1 9 . HA H 33.513 32.225 16.365 1.00 . A A . 9 DCY HA 1 1 4 579 1 1 9 . HB2 H 33.492 32.228 13.377 1.00 . A A . 9 DCY HB2 1 1 4 580 1 1 9 . HB3 H 32.167 31.630 14.438 1.00 . A A . 9 DCY HB3 1 1 4 581 1 1 9 . N N 34.961 33.195 15.294 1.00 . A A . 9 DCY N 1 1 4 582 1 1 9 . O O 31.954 34.114 14.370 1.00 . A A . 9 DCY O 1 1 4 583 1 1 9 . SG S 34.210 30.246 14.275 1.00 . A A . 9 DCY SG 1 1 4 584 1 1 10 PRO C C 31.244 36.697 15.768 1.00 . A A . 10 PRO C 1 1 4 585 1 1 10 PRO CA C 31.220 35.494 16.705 1.00 . A A . 10 PRO CA 1 1 4 586 1 1 10 PRO CB C 31.366 35.961 18.151 1.00 . A A . 10 PRO CB 1 1 4 587 1 1 10 PRO CD C 33.071 34.510 17.809 1.00 . A A . 10 PRO CD 1 1 4 588 1 1 10 PRO CG C 32.023 34.788 18.875 1.00 . A A . 10 PRO CG 1 1 4 589 1 1 10 PRO HA H 30.288 34.939 16.597 1.00 . A A . 10 PRO HA 1 1 4 590 1 1 10 PRO HB2 H 32.042 36.815 18.239 1.00 . A A . 10 PRO HB2 1 1 4 591 1 1 10 PRO HB3 H 30.357 36.200 18.500 1.00 . A A . 10 PRO HB3 1 1 4 592 1 1 10 PRO HD2 H 33.788 35.324 17.917 1.00 . A A . 10 PRO HD2 1 1 4 593 1 1 10 PRO HD3 H 33.465 33.514 18.016 1.00 . A A . 10 PRO HD3 1 1 4 594 1 1 10 PRO HG2 H 32.471 35.121 19.809 1.00 . A A . 10 PRO HG2 1 1 4 595 1 1 10 PRO HG3 H 31.355 33.938 18.964 1.00 . A A . 10 PRO HG3 1 1 4 596 1 1 10 PRO N N 32.333 34.571 16.560 1.00 . A A . 10 PRO N 1 1 4 597 1 1 10 PRO O O 32.261 37.188 15.294 1.00 . A A . 10 PRO O 1 1 4 598 1 1 11 . C C 30.448 38.018 13.014 1.00 . A A . 11 DSN C 1 1 4 599 1 1 11 . CA C 29.778 38.100 14.383 1.00 . A A . 11 DSN CA 1 1 4 600 1 1 11 . CB C 28.282 38.248 14.145 1.00 . A A . 11 DSN CB 1 1 4 601 1 1 11 . H H 29.226 36.628 15.816 1.00 . A A . 11 DSN H 1 1 4 602 1 1 11 . HA H 30.181 39.025 14.797 1.00 . A A . 11 DSN HA 1 1 4 603 1 1 11 . HB2 H 28.105 39.206 13.661 1.00 . A A . 11 DSN HB2 1 1 4 604 1 1 11 . HB3 H 27.704 38.324 15.061 1.00 . A A . 11 DSN HB3 1 1 4 605 1 1 11 . HG H 27.753 36.407 13.960 1.00 . A A . 11 DSN HG 1 1 4 606 1 1 11 . N N 30.029 37.061 15.362 1.00 . A A . 11 DSN N 1 1 4 607 1 1 11 . O O 30.746 39.050 12.413 1.00 . A A . 11 DSN O 1 1 4 608 1 1 11 . OG O 27.718 37.187 13.405 1.00 . A A . 11 DSN OG 1 1 5 609 1 1 1 DAL C C 32.739 36.803 11.289 1.00 . A A . 1 DAL C 1 1 5 610 1 1 1 DAL CA C 31.260 36.558 11.485 1.00 . A A . 1 DAL CA 1 1 5 611 1 1 1 DAL CB C 30.748 35.121 11.323 1.00 . A A . 1 DAL CB 1 1 5 612 1 1 1 DAL H1 H 30.510 36.427 13.484 1.00 . A A . 1 DAL H1 1 1 5 613 1 1 1 DAL HA H 30.877 37.226 10.706 1.00 . A A . 1 DAL HA 1 1 5 614 1 1 1 DAL HB1 H 29.703 35.074 11.626 1.00 . A A . 1 DAL HB1 1 1 5 615 1 1 1 DAL HB2 H 31.314 34.443 11.958 1.00 . A A . 1 DAL HB2 1 1 5 616 1 1 1 DAL HB3 H 30.857 34.858 10.278 1.00 . A A . 1 DAL HB3 1 1 5 617 1 1 1 DAL N N 30.723 37.067 12.732 1.00 . A A . 1 DAL N 1 1 5 618 1 1 1 DAL O O 33.205 36.810 10.154 1.00 . A A . 1 DAL O 1 1 5 619 1 1 2 GLN C C 35.835 36.152 12.536 1.00 . A A . 2 GLN C 1 1 5 620 1 1 2 GLN CA C 34.948 37.363 12.280 1.00 . A A . 2 GLN CA 1 1 5 621 1 1 2 GLN CB C 35.272 38.563 13.162 1.00 . A A . 2 GLN CB 1 1 5 622 1 1 2 GLN CD C 34.249 40.480 11.854 1.00 . A A . 2 GLN CD 1 1 5 623 1 1 2 GLN CG C 34.336 39.763 13.197 1.00 . A A . 2 GLN CG 1 1 5 624 1 1 2 GLN H H 33.153 37.037 13.277 1.00 . A A . 2 GLN H 1 1 5 625 1 1 2 GLN HA H 35.124 37.658 11.249 1.00 . A A . 2 GLN HA 1 1 5 626 1 1 2 GLN HB2 H 35.482 38.158 14.160 1.00 . A A . 2 GLN HB2 1 1 5 627 1 1 2 GLN HB3 H 36.266 38.943 12.939 1.00 . A A . 2 GLN HB3 1 1 5 628 1 1 2 GLN HE21 H 32.321 40.116 11.811 1.00 . A A . 2 GLN HE21 1 1 5 629 1 1 2 GLN HE22 H 32.759 41.048 10.489 1.00 . A A . 2 GLN HE22 1 1 5 630 1 1 2 GLN HG2 H 33.354 39.599 13.637 1.00 . A A . 2 GLN HG2 1 1 5 631 1 1 2 GLN HG3 H 34.862 40.385 13.928 1.00 . A A . 2 GLN HG3 1 1 5 632 1 1 2 GLN N N 33.541 37.010 12.340 1.00 . A A . 2 GLN N 1 1 5 633 1 1 2 GLN NE2 N 33.079 40.423 11.217 1.00 . A A . 2 GLN NE2 1 1 5 634 1 1 2 GLN O O 35.570 35.326 13.410 1.00 . A A . 2 GLN O 1 1 5 635 1 1 2 GLN OE1 O 35.226 40.934 11.261 1.00 . A A . 2 GLN OE1 1 1 5 636 1 1 3 DPR C C 36.989 33.538 11.468 1.00 . A A . 3 DPR C 1 1 5 637 1 1 3 DPR CA C 37.774 34.802 11.779 1.00 . A A . 3 DPR CA 1 1 5 638 1 1 3 DPR CB C 38.744 34.952 10.609 1.00 . A A . 3 DPR CB 1 1 5 639 1 1 3 DPR CD C 37.707 37.024 11.117 1.00 . A A . 3 DPR CD 1 1 5 640 1 1 3 DPR CG C 38.977 36.451 10.480 1.00 . A A . 3 DPR CG 1 1 5 641 1 1 3 DPR HA H 38.279 34.562 12.707 1.00 . A A . 3 DPR HA 1 1 5 642 1 1 3 DPR HB2 H 38.280 34.651 9.670 1.00 . A A . 3 DPR HB2 1 1 5 643 1 1 3 DPR HB3 H 39.699 34.413 10.697 1.00 . A A . 3 DPR HB3 1 1 5 644 1 1 3 DPR HD2 H 37.156 37.371 10.240 1.00 . A A . 3 DPR HD2 1 1 5 645 1 1 3 DPR HD3 H 38.046 37.836 11.751 1.00 . A A . 3 DPR HD3 1 1 5 646 1 1 3 DPR HG2 H 39.139 36.787 9.459 1.00 . A A . 3 DPR HG2 1 1 5 647 1 1 3 DPR HG3 H 39.808 36.716 11.138 1.00 . A A . 3 DPR HG3 1 1 5 648 1 1 3 DPR N N 36.983 36.017 11.857 1.00 . A A . 3 DPR N 1 1 5 649 1 1 3 DPR O O 36.027 33.629 10.709 1.00 . A A . 3 DPR O 1 1 5 650 1 1 4 . C C 38.156 30.125 11.593 1.00 . A A . 4 DCY C 1 1 5 651 1 1 4 . CA C 36.958 31.051 11.645 1.00 . A A . 4 DCY CA 1 1 5 652 1 1 4 . CB C 35.919 30.663 12.695 1.00 . A A . 4 DCY CB 1 1 5 653 1 1 4 . H H 38.365 32.334 12.317 1.00 . A A . 4 DCY H 1 1 5 654 1 1 4 . HA H 36.556 31.002 10.632 1.00 . A A . 4 DCY HA 1 1 5 655 1 1 4 . HB2 H 35.957 31.387 13.515 1.00 . A A . 4 DCY HB2 1 1 5 656 1 1 4 . HB3 H 36.175 29.722 13.188 1.00 . A A . 4 DCY HB3 1 1 5 657 1 1 4 . N N 37.413 32.383 11.985 1.00 . A A . 4 DCY N 1 1 5 658 1 1 4 . O O 39.238 30.467 12.059 1.00 . A A . 4 DCY O 1 1 5 659 1 1 4 . SG S 34.226 30.374 12.114 1.00 . A A . 4 DCY SG 1 1 5 660 1 1 5 . C C 39.460 27.465 12.348 1.00 . A A . 5 DLY C 1 1 5 661 1 1 5 . CA C 38.982 27.909 10.974 1.00 . A A . 5 DLY CA 1 1 5 662 1 1 5 . CB C 38.517 26.733 10.131 1.00 . A A . 5 DLY CB 1 1 5 663 1 1 5 . CD C 39.191 24.548 9.175 1.00 . A A . 5 DLY CD 1 1 5 664 1 1 5 . CE C 40.453 23.775 8.806 1.00 . A A . 5 DLY CE 1 1 5 665 1 1 5 . CG C 39.687 25.788 9.912 1.00 . A A . 5 DLY CG 1 1 5 666 1 1 5 . H H 37.055 28.701 10.644 1.00 . A A . 5 DLY H 1 1 5 667 1 1 5 . HA H 39.883 28.308 10.505 1.00 . A A . 5 DLY HA 1 1 5 668 1 1 5 . HB2 H 38.180 27.066 9.155 1.00 . A A . 5 DLY HB2 1 1 5 669 1 1 5 . HB3 H 37.732 26.183 10.651 1.00 . A A . 5 DLY HB3 1 1 5 670 1 1 5 . HD2 H 38.681 24.825 8.246 1.00 . A A . 5 DLY HD2 1 1 5 671 1 1 5 . HD3 H 38.544 23.899 9.762 1.00 . A A . 5 DLY HD3 1 1 5 672 1 1 5 . HE2 H 40.966 23.384 9.689 1.00 . A A . 5 DLY HE2 1 1 5 673 1 1 5 . HE3 H 41.153 24.451 8.308 1.00 . A A . 5 DLY HE3 1 1 5 674 1 1 5 . HG2 H 40.169 25.406 10.814 1.00 . A A . 5 DLY HG2 1 1 5 675 1 1 5 . HG3 H 40.498 26.252 9.343 1.00 . A A . 5 DLY HG3 1 1 5 676 1 1 5 . HZ1 H 39.763 21.917 8.131 1.00 . A A . 5 DLY HZ1 1 1 5 677 1 1 5 . HZ2 H 41.330 22.331 7.755 1.00 . A A . 5 DLY HZ2 1 1 5 678 1 1 5 . HZ3 H 40.020 22.965 6.958 1.00 . A A . 5 DLY HZ3 1 1 5 679 1 1 5 . N N 37.976 28.956 10.959 1.00 . A A . 5 DLY N 1 1 5 680 1 1 5 . NZ N 40.385 22.656 7.849 1.00 . A A . 5 DLY NZ 1 1 5 681 1 1 5 . O O 38.768 26.755 13.086 1.00 . A A . 5 DLY O 1 1 5 682 1 1 6 ASP C C 40.506 28.281 15.169 1.00 . A A . 6 ASP C 1 1 5 683 1 1 6 ASP CA C 41.254 27.564 14.045 1.00 . A A . 6 ASP CA 1 1 5 684 1 1 6 ASP CB C 42.727 27.951 13.977 1.00 . A A . 6 ASP CB 1 1 5 685 1 1 6 ASP CG C 43.009 29.381 13.535 1.00 . A A . 6 ASP CG 1 1 5 686 1 1 6 ASP H H 41.206 28.297 12.020 1.00 . A A . 6 ASP H 1 1 5 687 1 1 6 ASP HA H 41.260 26.489 14.200 1.00 . A A . 6 ASP HA 1 1 5 688 1 1 6 ASP HB2 H 43.301 27.664 14.857 1.00 . A A . 6 ASP HB2 1 1 5 689 1 1 6 ASP HB3 H 43.190 27.366 13.181 1.00 . A A . 6 ASP HB3 1 1 5 690 1 1 6 ASP N N 40.658 27.873 12.766 1.00 . A A . 6 ASP N 1 1 5 691 1 1 6 ASP O O 40.363 27.736 16.264 1.00 . A A . 6 ASP O 1 1 5 692 1 1 6 ASP OD1 O 43.290 29.533 12.332 1.00 . A A . 6 ASP OD1 1 1 5 693 1 1 6 ASP OD2 O 42.887 30.404 14.244 1.00 . A A . 6 ASP OD2 1 1 5 694 1 1 7 SER C C 38.674 31.577 15.376 1.00 . A A . 7 SER C 1 1 5 695 1 1 7 SER CA C 39.492 30.417 15.937 1.00 . A A . 7 SER CA 1 1 5 696 1 1 7 SER CB C 40.580 30.958 16.869 1.00 . A A . 7 SER CB 1 1 5 697 1 1 7 SER H H 40.307 29.985 14.099 1.00 . A A . 7 SER H 1 1 5 698 1 1 7 SER HA H 38.817 29.801 16.526 1.00 . A A . 7 SER HA 1 1 5 699 1 1 7 SER HB2 H 40.155 31.526 17.694 1.00 . A A . 7 SER HB2 1 1 5 700 1 1 7 SER HB3 H 41.104 30.078 17.248 1.00 . A A . 7 SER HB3 1 1 5 701 1 1 7 SER HG H 41.939 31.161 15.485 1.00 . A A . 7 SER HG 1 1 5 702 1 1 7 SER N N 40.188 29.566 14.999 1.00 . A A . 7 SER N 1 1 5 703 1 1 7 SER O O 39.013 32.091 14.309 1.00 . A A . 7 SER O 1 1 5 704 1 1 7 SER OG O 41.534 31.712 16.162 1.00 . A A . 7 SER OG 1 1 5 705 1 1 8 . C C 35.369 32.790 16.011 1.00 . A A . 8 DTY C 1 1 5 706 1 1 8 . CA C 36.836 33.141 15.820 1.00 . A A . 8 DTY CA 1 1 5 707 1 1 8 . CB C 37.367 34.236 16.731 1.00 . A A . 8 DTY CB 1 1 5 708 1 1 8 . CD1 C 39.814 34.674 16.053 1.00 . A A . 8 DTY CD1 1 1 5 709 1 1 8 . CD2 C 38.032 36.157 15.362 1.00 . A A . 8 DTY CD2 1 1 5 710 1 1 8 . CE1 C 40.757 35.510 15.437 1.00 . A A . 8 DTY CE1 1 1 5 711 1 1 8 . CE2 C 38.926 36.950 14.629 1.00 . A A . 8 DTY CE2 1 1 5 712 1 1 8 . CG C 38.472 35.079 16.138 1.00 . A A . 8 DTY CG 1 1 5 713 1 1 8 . CZ C 40.290 36.626 14.710 1.00 . A A . 8 DTY CZ 1 1 5 714 1 1 8 . H H 37.455 31.463 16.960 1.00 . A A . 8 DTY H 1 1 5 715 1 1 8 . HA H 37.036 33.382 14.763 1.00 . A A . 8 DTY HA 1 1 5 716 1 1 8 . HB2 H 37.645 33.849 17.710 1.00 . A A . 8 DTY HB2 1 1 5 717 1 1 8 . HB3 H 36.497 34.866 16.922 1.00 . A A . 8 DTY HB3 1 1 5 718 1 1 8 . HD1 H 40.075 33.843 16.686 1.00 . A A . 8 DTY HD1 1 1 5 719 1 1 8 . HD2 H 36.969 36.312 15.289 1.00 . A A . 8 DTY HD2 1 1 5 720 1 1 8 . HE1 H 41.802 35.242 15.514 1.00 . A A . 8 DTY HE1 1 1 5 721 1 1 8 . HE2 H 38.620 37.783 14.007 1.00 . A A . 8 DTY HE2 1 1 5 722 1 1 8 . HH H 40.860 38.137 13.760 1.00 . A A . 8 DTY HH 1 1 5 723 1 1 8 . N N 37.701 32.029 16.160 1.00 . A A . 8 DTY N 1 1 5 724 1 1 8 . O O 34.992 32.220 17.033 1.00 . A A . 8 DTY O 1 1 5 725 1 1 8 . OH O 41.286 37.382 14.160 1.00 . A A . 8 DTY OH 1 1 5 726 1 1 9 . C C 32.167 34.014 15.349 1.00 . A A . 9 DCY C 1 1 5 727 1 1 9 . CA C 33.033 32.768 15.287 1.00 . A A . 9 DCY CA 1 1 5 728 1 1 9 . CB C 32.601 31.866 14.127 1.00 . A A . 9 DCY CB 1 1 5 729 1 1 9 . H H 34.704 33.547 14.261 1.00 . A A . 9 DCY H 1 1 5 730 1 1 9 . HA H 32.834 32.254 16.228 1.00 . A A . 9 DCY HA 1 1 5 731 1 1 9 . HB2 H 32.753 32.464 13.237 1.00 . A A . 9 DCY HB2 1 1 5 732 1 1 9 . HB3 H 31.520 31.788 14.279 1.00 . A A . 9 DCY HB3 1 1 5 733 1 1 9 . N N 34.435 33.036 15.087 1.00 . A A . 9 DCY N 1 1 5 734 1 1 9 . O O 31.467 34.432 14.428 1.00 . A A . 9 DCY O 1 1 5 735 1 1 9 . SG S 33.329 30.225 13.936 1.00 . A A . 9 DCY SG 1 1 5 736 1 1 10 PRO C C 31.401 37.034 15.683 1.00 . A A . 10 PRO C 1 1 5 737 1 1 10 PRO CA C 31.405 35.957 16.765 1.00 . A A . 10 PRO CA 1 1 5 738 1 1 10 PRO CB C 31.878 36.510 18.113 1.00 . A A . 10 PRO CB 1 1 5 739 1 1 10 PRO CD C 33.033 34.523 17.598 1.00 . A A . 10 PRO CD 1 1 5 740 1 1 10 PRO CG C 32.371 35.233 18.774 1.00 . A A . 10 PRO CG 1 1 5 741 1 1 10 PRO HA H 30.364 35.701 16.946 1.00 . A A . 10 PRO HA 1 1 5 742 1 1 10 PRO HB2 H 32.701 37.205 17.964 1.00 . A A . 10 PRO HB2 1 1 5 743 1 1 10 PRO HB3 H 31.075 36.903 18.734 1.00 . A A . 10 PRO HB3 1 1 5 744 1 1 10 PRO HD2 H 33.996 34.929 17.300 1.00 . A A . 10 PRO HD2 1 1 5 745 1 1 10 PRO HD3 H 33.112 33.495 17.955 1.00 . A A . 10 PRO HD3 1 1 5 746 1 1 10 PRO HG2 H 33.130 35.451 19.527 1.00 . A A . 10 PRO HG2 1 1 5 747 1 1 10 PRO HG3 H 31.616 34.608 19.264 1.00 . A A . 10 PRO HG3 1 1 5 748 1 1 10 PRO N N 32.165 34.764 16.461 1.00 . A A . 10 PRO N 1 1 5 749 1 1 10 PRO O O 32.425 37.360 15.086 1.00 . A A . 10 PRO O 1 1 5 750 1 1 11 . C C 30.543 38.368 12.954 1.00 . A A . 11 DSN C 1 1 5 751 1 1 11 . CA C 30.227 38.751 14.384 1.00 . A A . 11 DSN CA 1 1 5 752 1 1 11 . CB C 28.874 39.466 14.425 1.00 . A A . 11 DSN CB 1 1 5 753 1 1 11 . H H 29.455 37.364 15.835 1.00 . A A . 11 DSN H 1 1 5 754 1 1 11 . HA H 31.052 39.446 14.532 1.00 . A A . 11 DSN HA 1 1 5 755 1 1 11 . HB2 H 29.031 40.426 13.943 1.00 . A A . 11 DSN HB2 1 1 5 756 1 1 11 . HB3 H 28.660 39.610 15.473 1.00 . A A . 11 DSN HB3 1 1 5 757 1 1 11 . HG H 27.000 39.278 13.685 1.00 . A A . 11 DSN HG 1 1 5 758 1 1 11 . N N 30.273 37.636 15.314 1.00 . A A . 11 DSN N 1 1 5 759 1 1 11 . O O 30.765 39.212 12.085 1.00 . A A . 11 DSN O 1 1 5 760 1 1 11 . OG O 27.834 38.809 13.733 1.00 . A A . 11 DSN OG 1 1 6 761 1 1 1 DAL C C 32.972 36.882 11.317 1.00 . A A . 1 DAL C 1 1 6 762 1 1 1 DAL CA C 31.453 36.850 11.383 1.00 . A A . 1 DAL CA 1 1 6 763 1 1 1 DAL CB C 30.738 35.674 10.734 1.00 . A A . 1 DAL CB 1 1 6 764 1 1 1 DAL H1 H 30.986 36.293 13.337 1.00 . A A . 1 DAL H1 1 1 6 765 1 1 1 DAL HA H 31.185 37.734 10.800 1.00 . A A . 1 DAL HA 1 1 6 766 1 1 1 DAL HB1 H 30.842 35.692 9.646 1.00 . A A . 1 DAL HB1 1 1 6 767 1 1 1 DAL HB2 H 29.681 35.603 10.979 1.00 . A A . 1 DAL HB2 1 1 6 768 1 1 1 DAL HB3 H 31.239 34.741 11.011 1.00 . A A . 1 DAL HB3 1 1 6 769 1 1 1 DAL N N 30.899 37.070 12.704 1.00 . A A . 1 DAL N 1 1 6 770 1 1 1 DAL O O 33.568 36.812 10.248 1.00 . A A . 1 DAL O 1 1 6 771 1 1 2 GLN C C 35.902 36.184 12.551 1.00 . A A . 2 GLN C 1 1 6 772 1 1 2 GLN CA C 34.991 37.398 12.567 1.00 . A A . 2 GLN CA 1 1 6 773 1 1 2 GLN CB C 35.222 38.307 13.778 1.00 . A A . 2 GLN CB 1 1 6 774 1 1 2 GLN CD C 34.617 40.496 14.866 1.00 . A A . 2 GLN CD 1 1 6 775 1 1 2 GLN CG C 34.274 39.495 13.771 1.00 . A A . 2 GLN CG 1 1 6 776 1 1 2 GLN H H 33.110 36.957 13.377 1.00 . A A . 2 GLN H 1 1 6 777 1 1 2 GLN HA H 35.228 37.967 11.663 1.00 . A A . 2 GLN HA 1 1 6 778 1 1 2 GLN HB2 H 35.162 37.717 14.692 1.00 . A A . 2 GLN HB2 1 1 6 779 1 1 2 GLN HB3 H 36.244 38.677 13.724 1.00 . A A . 2 GLN HB3 1 1 6 780 1 1 2 GLN HE21 H 32.665 41.158 14.975 1.00 . A A . 2 GLN HE21 1 1 6 781 1 1 2 GLN HE22 H 33.921 42.078 15.828 1.00 . A A . 2 GLN HE22 1 1 6 782 1 1 2 GLN HG2 H 34.371 39.928 12.767 1.00 . A A . 2 GLN HG2 1 1 6 783 1 1 2 GLN HG3 H 33.256 39.129 13.897 1.00 . A A . 2 GLN HG3 1 1 6 784 1 1 2 GLN N N 33.591 37.039 12.491 1.00 . A A . 2 GLN N 1 1 6 785 1 1 2 GLN NE2 N 33.625 41.305 15.247 1.00 . A A . 2 GLN NE2 1 1 6 786 1 1 2 GLN O O 35.527 35.192 13.180 1.00 . A A . 2 GLN O 1 1 6 787 1 1 2 GLN OE1 O 35.710 40.614 15.424 1.00 . A A . 2 GLN OE1 1 1 6 788 1 1 3 DPR C C 37.170 33.710 11.294 1.00 . A A . 3 DPR C 1 1 6 789 1 1 3 DPR CA C 37.901 34.959 11.770 1.00 . A A . 3 DPR CA 1 1 6 790 1 1 3 DPR CB C 39.000 35.376 10.799 1.00 . A A . 3 DPR CB 1 1 6 791 1 1 3 DPR CD C 37.729 37.285 11.308 1.00 . A A . 3 DPR CD 1 1 6 792 1 1 3 DPR CG C 39.176 36.873 11.051 1.00 . A A . 3 DPR CG 1 1 6 793 1 1 3 DPR HA H 38.296 34.800 12.775 1.00 . A A . 3 DPR HA 1 1 6 794 1 1 3 DPR HB2 H 38.739 35.330 9.748 1.00 . A A . 3 DPR HB2 1 1 6 795 1 1 3 DPR HB3 H 39.848 34.771 11.133 1.00 . A A . 3 DPR HB3 1 1 6 796 1 1 3 DPR HD2 H 37.204 37.691 10.447 1.00 . A A . 3 DPR HD2 1 1 6 797 1 1 3 DPR HD3 H 37.814 37.978 12.156 1.00 . A A . 3 DPR HD3 1 1 6 798 1 1 3 DPR HG2 H 39.567 37.458 10.227 1.00 . A A . 3 DPR HG2 1 1 6 799 1 1 3 DPR HG3 H 39.743 36.941 11.981 1.00 . A A . 3 DPR HG3 1 1 6 800 1 1 3 DPR N N 37.048 36.133 11.877 1.00 . A A . 3 DPR N 1 1 6 801 1 1 3 DPR O O 36.143 33.819 10.623 1.00 . A A . 3 DPR O 1 1 6 802 1 1 4 . C C 38.147 30.090 11.431 1.00 . A A . 4 DCY C 1 1 6 803 1 1 4 . CA C 37.130 31.218 11.334 1.00 . A A . 4 DCY CA 1 1 6 804 1 1 4 . CB C 36.215 30.975 12.537 1.00 . A A . 4 DCY CB 1 1 6 805 1 1 4 . H H 38.440 32.601 12.273 1.00 . A A . 4 DCY H 1 1 6 806 1 1 4 . HA H 36.580 31.271 10.396 1.00 . A A . 4 DCY HA 1 1 6 807 1 1 4 . HB2 H 35.738 31.925 12.798 1.00 . A A . 4 DCY HB2 1 1 6 808 1 1 4 . HB3 H 36.745 30.725 13.455 1.00 . A A . 4 DCY HB3 1 1 6 809 1 1 4 . N N 37.674 32.522 11.620 1.00 . A A . 4 DCY N 1 1 6 810 1 1 4 . O O 39.224 30.319 11.995 1.00 . A A . 4 DCY O 1 1 6 811 1 1 4 . SG S 34.912 29.724 12.363 1.00 . A A . 4 DCY SG 1 1 6 812 1 1 5 . C C 38.714 27.447 12.612 1.00 . A A . 5 DLY C 1 1 6 813 1 1 5 . CA C 38.896 27.830 11.156 1.00 . A A . 5 DLY CA 1 1 6 814 1 1 5 . CB C 38.645 26.571 10.336 1.00 . A A . 5 DLY CB 1 1 6 815 1 1 5 . CD C 39.250 24.136 9.701 1.00 . A A . 5 DLY CD 1 1 6 816 1 1 5 . CE C 40.307 23.071 9.999 1.00 . A A . 5 DLY CE 1 1 6 817 1 1 5 . CG C 39.481 25.328 10.623 1.00 . A A . 5 DLY CG 1 1 6 818 1 1 5 . H H 37.131 28.714 10.328 1.00 . A A . 5 DLY H 1 1 6 819 1 1 5 . HA H 39.920 28.132 10.949 1.00 . A A . 5 DLY HA 1 1 6 820 1 1 5 . HB2 H 38.718 26.849 9.287 1.00 . A A . 5 DLY HB2 1 1 6 821 1 1 5 . HB3 H 37.599 26.361 10.557 1.00 . A A . 5 DLY HB3 1 1 6 822 1 1 5 . HD2 H 39.275 24.456 8.661 1.00 . A A . 5 DLY HD2 1 1 6 823 1 1 5 . HD3 H 38.298 23.685 9.979 1.00 . A A . 5 DLY HD3 1 1 6 824 1 1 5 . HE2 H 41.311 23.418 9.735 1.00 . A A . 5 DLY HE2 1 1 6 825 1 1 5 . HE3 H 40.014 22.163 9.471 1.00 . A A . 5 DLY HE3 1 1 6 826 1 1 5 . HG2 H 39.251 24.992 11.634 1.00 . A A . 5 DLY HG2 1 1 6 827 1 1 5 . HG3 H 40.549 25.587 10.672 1.00 . A A . 5 DLY HG3 1 1 6 828 1 1 5 . HZ1 H 40.627 23.487 12.065 1.00 . A A . 5 DLY HZ1 1 1 6 829 1 1 5 . HZ2 H 40.939 21.903 11.540 1.00 . A A . 5 DLY HZ2 1 1 6 830 1 1 5 . HZ3 H 39.498 22.569 11.869 1.00 . A A . 5 DLY HZ3 1 1 6 831 1 1 5 . N N 37.986 28.920 10.830 1.00 . A A . 5 DLY N 1 1 6 832 1 1 5 . NZ N 40.391 22.735 11.427 1.00 . A A . 5 DLY NZ 1 1 6 833 1 1 5 . O O 37.603 27.087 12.997 1.00 . A A . 5 DLY O 1 1 6 834 1 1 6 ASP C C 40.200 28.635 15.680 1.00 . A A . 6 ASP C 1 1 6 835 1 1 6 ASP CA C 39.687 27.449 14.883 1.00 . A A . 6 ASP CA 1 1 6 836 1 1 6 ASP CB C 40.424 26.150 15.190 1.00 . A A . 6 ASP CB 1 1 6 837 1 1 6 ASP CG C 39.933 24.895 14.484 1.00 . A A . 6 ASP CG 1 1 6 838 1 1 6 ASP H H 40.660 27.874 13.117 1.00 . A A . 6 ASP H 1 1 6 839 1 1 6 ASP HA H 38.660 27.347 15.249 1.00 . A A . 6 ASP HA 1 1 6 840 1 1 6 ASP HB2 H 41.482 26.292 14.938 1.00 . A A . 6 ASP HB2 1 1 6 841 1 1 6 ASP HB3 H 40.384 25.989 16.264 1.00 . A A . 6 ASP HB3 1 1 6 842 1 1 6 ASP N N 39.744 27.647 13.450 1.00 . A A . 6 ASP N 1 1 6 843 1 1 6 ASP O O 40.626 28.544 16.823 1.00 . A A . 6 ASP O 1 1 6 844 1 1 6 ASP OD1 O 38.835 24.407 14.825 1.00 . A A . 6 ASP OD1 1 1 6 845 1 1 6 ASP OD2 O 40.578 24.369 13.551 1.00 . A A . 6 ASP OD2 1 1 6 846 1 1 7 SER C C 39.297 32.050 14.905 1.00 . A A . 7 SER C 1 1 6 847 1 1 7 SER CA C 40.409 31.137 15.393 1.00 . A A . 7 SER CA 1 1 6 848 1 1 7 SER CB C 41.818 31.488 14.915 1.00 . A A . 7 SER CB 1 1 6 849 1 1 7 SER H H 39.587 29.724 14.112 1.00 . A A . 7 SER H 1 1 6 850 1 1 7 SER HA H 40.379 31.085 16.488 1.00 . A A . 7 SER HA 1 1 6 851 1 1 7 SER HB2 H 41.869 31.599 13.834 1.00 . A A . 7 SER HB2 1 1 6 852 1 1 7 SER HB3 H 42.072 32.456 15.341 1.00 . A A . 7 SER HB3 1 1 6 853 1 1 7 SER HG H 43.587 30.860 15.025 1.00 . A A . 7 SER HG 1 1 6 854 1 1 7 SER N N 40.025 29.791 15.024 1.00 . A A . 7 SER N 1 1 6 855 1 1 7 SER O O 39.373 32.641 13.825 1.00 . A A . 7 SER O 1 1 6 856 1 1 7 SER OG O 42.746 30.502 15.326 1.00 . A A . 7 SER OG 1 1 6 857 1 1 8 . C C 35.745 32.459 15.638 1.00 . A A . 8 DTY C 1 1 6 858 1 1 8 . CA C 37.118 33.080 15.465 1.00 . A A . 8 DTY CA 1 1 6 859 1 1 8 . CB C 37.404 34.248 16.407 1.00 . A A . 8 DTY CB 1 1 6 860 1 1 8 . CD1 C 39.787 34.994 16.499 1.00 . A A . 8 DTY CD1 1 1 6 861 1 1 8 . CD2 C 38.181 36.451 15.418 1.00 . A A . 8 DTY CD2 1 1 6 862 1 1 8 . CE1 C 40.868 35.814 16.163 1.00 . A A . 8 DTY CE1 1 1 6 863 1 1 8 . CE2 C 39.238 37.336 15.175 1.00 . A A . 8 DTY CE2 1 1 6 864 1 1 8 . CG C 38.495 35.213 16.002 1.00 . A A . 8 DTY CG 1 1 6 865 1 1 8 . CZ C 40.571 37.026 15.507 1.00 . A A . 8 DTY CZ 1 1 6 866 1 1 8 . H H 38.342 31.742 16.582 1.00 . A A . 8 DTY H 1 1 6 867 1 1 8 . HA H 37.114 33.461 14.446 1.00 . A A . 8 DTY HA 1 1 6 868 1 1 8 . HB2 H 37.581 33.772 17.374 1.00 . A A . 8 DTY HB2 1 1 6 869 1 1 8 . HB3 H 36.508 34.845 16.590 1.00 . A A . 8 DTY HB3 1 1 6 870 1 1 8 . HD1 H 39.996 34.113 17.083 1.00 . A A . 8 DTY HD1 1 1 6 871 1 1 8 . HD2 H 37.153 36.777 15.303 1.00 . A A . 8 DTY HD2 1 1 6 872 1 1 8 . HE1 H 41.898 35.587 16.412 1.00 . A A . 8 DTY HE1 1 1 6 873 1 1 8 . HE2 H 39.052 38.347 14.832 1.00 . A A . 8 DTY HE2 1 1 6 874 1 1 8 . HH H 41.152 38.778 15.033 1.00 . A A . 8 DTY HH 1 1 6 875 1 1 8 . N N 38.216 32.160 15.678 1.00 . A A . 8 DTY N 1 1 6 876 1 1 8 . O O 35.701 31.355 16.179 1.00 . A A . 8 DTY O 1 1 6 877 1 1 8 . OH O 41.552 37.952 15.302 1.00 . A A . 8 DTY OH 1 1 6 878 1 1 9 . C C 32.304 33.790 15.166 1.00 . A A . 9 DCY C 1 1 6 879 1 1 9 . CA C 33.313 32.645 15.094 1.00 . A A . 9 DCY CA 1 1 6 880 1 1 9 . CB C 33.105 31.735 13.885 1.00 . A A . 9 DCY CB 1 1 6 881 1 1 9 . H H 34.850 33.891 14.511 1.00 . A A . 9 DCY H 1 1 6 882 1 1 9 . HA H 33.040 32.003 15.927 1.00 . A A . 9 DCY HA 1 1 6 883 1 1 9 . HB2 H 33.297 32.269 12.953 1.00 . A A . 9 DCY HB2 1 1 6 884 1 1 9 . HB3 H 32.059 31.620 13.646 1.00 . A A . 9 DCY HB3 1 1 6 885 1 1 9 . N N 34.701 33.064 15.061 1.00 . A A . 9 DCY N 1 1 6 886 1 1 9 . O O 31.668 34.044 14.151 1.00 . A A . 9 DCY O 1 1 6 887 1 1 9 . SG S 33.839 30.094 14.059 1.00 . A A . 9 DCY SG 1 1 6 888 1 1 10 PRO C C 31.287 36.539 15.803 1.00 . A A . 10 PRO C 1 1 6 889 1 1 10 PRO CA C 31.136 35.341 16.730 1.00 . A A . 10 PRO CA 1 1 6 890 1 1 10 PRO CB C 31.383 35.686 18.193 1.00 . A A . 10 PRO CB 1 1 6 891 1 1 10 PRO CD C 32.722 33.841 17.599 1.00 . A A . 10 PRO CD 1 1 6 892 1 1 10 PRO CG C 31.873 34.360 18.760 1.00 . A A . 10 PRO CG 1 1 6 893 1 1 10 PRO HA H 30.157 34.874 16.573 1.00 . A A . 10 PRO HA 1 1 6 894 1 1 10 PRO HB2 H 32.236 36.362 18.204 1.00 . A A . 10 PRO HB2 1 1 6 895 1 1 10 PRO HB3 H 30.553 36.057 18.800 1.00 . A A . 10 PRO HB3 1 1 6 896 1 1 10 PRO HD2 H 33.670 34.376 17.660 1.00 . A A . 10 PRO HD2 1 1 6 897 1 1 10 PRO HD3 H 32.850 32.782 17.814 1.00 . A A . 10 PRO HD3 1 1 6 898 1 1 10 PRO HG2 H 32.431 34.358 19.693 1.00 . A A . 10 PRO HG2 1 1 6 899 1 1 10 PRO HG3 H 30.967 33.772 18.954 1.00 . A A . 10 PRO HG3 1 1 6 900 1 1 10 PRO N N 32.084 34.301 16.383 1.00 . A A . 10 PRO N 1 1 6 901 1 1 10 PRO O O 32.396 36.972 15.513 1.00 . A A . 10 PRO O 1 1 6 902 1 1 11 . C C 30.581 38.277 13.175 1.00 . A A . 11 DSN C 1 1 6 903 1 1 11 . CA C 30.136 38.370 14.625 1.00 . A A . 11 DSN CA 1 1 6 904 1 1 11 . CB C 28.775 39.060 14.724 1.00 . A A . 11 DSN CB 1 1 6 905 1 1 11 . H H 29.310 36.828 15.811 1.00 . A A . 11 DSN H 1 1 6 906 1 1 11 . HA H 30.865 39.038 15.085 1.00 . A A . 11 DSN HA 1 1 6 907 1 1 11 . HB2 H 27.993 38.319 14.601 1.00 . A A . 11 DSN HB2 1 1 6 908 1 1 11 . HB3 H 28.701 39.846 13.971 1.00 . A A . 11 DSN HB3 1 1 6 909 1 1 11 . HG H 27.913 40.155 16.123 1.00 . A A . 11 DSN HG 1 1 6 910 1 1 11 . N N 30.170 37.126 15.368 1.00 . A A . 11 DSN N 1 1 6 911 1 1 11 . O O 30.728 39.287 12.482 1.00 . A A . 11 DSN O 1 1 6 912 1 1 11 . OG O 28.669 39.567 16.043 1.00 . A A . 11 DSN OG 1 1 7 913 1 1 1 DAL C C 32.800 36.457 11.273 1.00 . A A . 1 DAL C 1 1 7 914 1 1 1 DAL CA C 31.315 36.166 11.425 1.00 . A A . 1 DAL CA 1 1 7 915 1 1 1 DAL CB C 31.164 34.647 11.288 1.00 . A A . 1 DAL CB 1 1 7 916 1 1 1 DAL H1 H 31.029 35.729 13.368 1.00 . A A . 1 DAL H1 1 1 7 917 1 1 1 DAL HA H 30.715 36.648 10.659 1.00 . A A . 1 DAL HA 1 1 7 918 1 1 1 DAL HB1 H 31.564 34.353 10.321 1.00 . A A . 1 DAL HB1 1 1 7 919 1 1 1 DAL HB2 H 30.128 34.331 11.211 1.00 . A A . 1 DAL HB2 1 1 7 920 1 1 1 DAL HB3 H 31.757 34.124 12.036 1.00 . A A . 1 DAL HB3 1 1 7 921 1 1 1 DAL N N 30.799 36.494 12.737 1.00 . A A . 1 DAL N 1 1 7 922 1 1 1 DAL O O 33.403 36.229 10.226 1.00 . A A . 1 DAL O 1 1 7 923 1 1 2 GLN C C 35.804 36.260 12.216 1.00 . A A . 2 GLN C 1 1 7 924 1 1 2 GLN CA C 34.815 37.418 12.168 1.00 . A A . 2 GLN CA 1 1 7 925 1 1 2 GLN CB C 35.179 38.416 13.255 1.00 . A A . 2 GLN CB 1 1 7 926 1 1 2 GLN CD C 35.094 40.782 14.192 1.00 . A A . 2 GLN CD 1 1 7 927 1 1 2 GLN CG C 34.509 39.786 13.198 1.00 . A A . 2 GLN CG 1 1 7 928 1 1 2 GLN H H 33.029 37.157 13.227 1.00 . A A . 2 GLN H 1 1 7 929 1 1 2 GLN HA H 34.891 37.927 11.206 1.00 . A A . 2 GLN HA 1 1 7 930 1 1 2 GLN HB2 H 34.900 37.915 14.177 1.00 . A A . 2 GLN HB2 1 1 7 931 1 1 2 GLN HB3 H 36.267 38.493 13.265 1.00 . A A . 2 GLN HB3 1 1 7 932 1 1 2 GLN HE21 H 34.203 42.355 13.292 1.00 . A A . 2 GLN HE21 1 1 7 933 1 1 2 GLN HE22 H 34.919 42.762 14.795 1.00 . A A . 2 GLN HE22 1 1 7 934 1 1 2 GLN HG2 H 34.548 40.219 12.197 1.00 . A A . 2 GLN HG2 1 1 7 935 1 1 2 GLN HG3 H 33.467 39.583 13.432 1.00 . A A . 2 GLN HG3 1 1 7 936 1 1 2 GLN N N 33.429 36.997 12.323 1.00 . A A . 2 GLN N 1 1 7 937 1 1 2 GLN NE2 N 34.799 42.084 14.060 1.00 . A A . 2 GLN NE2 1 1 7 938 1 1 2 GLN O O 35.557 35.270 12.895 1.00 . A A . 2 GLN O 1 1 7 939 1 1 2 GLN OE1 O 35.764 40.426 15.153 1.00 . A A . 2 GLN OE1 1 1 7 940 1 1 3 DPR C C 37.635 34.099 10.866 1.00 . A A . 3 DPR C 1 1 7 941 1 1 3 DPR CA C 38.043 35.368 11.604 1.00 . A A . 3 DPR CA 1 1 7 942 1 1 3 DPR CB C 39.317 36.033 11.065 1.00 . A A . 3 DPR CB 1 1 7 943 1 1 3 DPR CD C 37.406 37.526 10.863 1.00 . A A . 3 DPR CD 1 1 7 944 1 1 3 DPR CG C 38.817 37.280 10.348 1.00 . A A . 3 DPR CG 1 1 7 945 1 1 3 DPR HA H 38.340 35.089 12.617 1.00 . A A . 3 DPR HA 1 1 7 946 1 1 3 DPR HB2 H 39.807 35.348 10.379 1.00 . A A . 3 DPR HB2 1 1 7 947 1 1 3 DPR HB3 H 39.952 36.343 11.898 1.00 . A A . 3 DPR HB3 1 1 7 948 1 1 3 DPR HD2 H 36.637 37.659 10.108 1.00 . A A . 3 DPR HD2 1 1 7 949 1 1 3 DPR HD3 H 37.614 38.427 11.446 1.00 . A A . 3 DPR HD3 1 1 7 950 1 1 3 DPR HG2 H 38.815 37.043 9.281 1.00 . A A . 3 DPR HG2 1 1 7 951 1 1 3 DPR HG3 H 39.520 38.091 10.502 1.00 . A A . 3 DPR HG3 1 1 7 952 1 1 3 DPR N N 37.025 36.387 11.678 1.00 . A A . 3 DPR N 1 1 7 953 1 1 3 DPR O O 37.036 34.155 9.802 1.00 . A A . 3 DPR O 1 1 7 954 1 1 4 . C C 38.357 30.466 11.257 1.00 . A A . 4 DCY C 1 1 7 955 1 1 4 . CA C 37.418 31.629 10.989 1.00 . A A . 4 DCY CA 1 1 7 956 1 1 4 . CB C 36.258 31.466 11.965 1.00 . A A . 4 DCY CB 1 1 7 957 1 1 4 . H H 38.721 32.859 12.062 1.00 . A A . 4 DCY H 1 1 7 958 1 1 4 . HA H 37.001 31.564 9.984 1.00 . A A . 4 DCY HA 1 1 7 959 1 1 4 . HB2 H 35.761 32.434 11.979 1.00 . A A . 4 DCY HB2 1 1 7 960 1 1 4 . HB3 H 36.763 31.487 12.920 1.00 . A A . 4 DCY HB3 1 1 7 961 1 1 4 . N N 38.047 32.901 11.309 1.00 . A A . 4 DCY N 1 1 7 962 1 1 4 . O O 39.292 30.512 12.055 1.00 . A A . 4 DCY O 1 1 7 963 1 1 4 . SG S 34.971 30.188 12.082 1.00 . A A . 4 DCY SG 1 1 7 964 1 1 5 . C C 38.374 27.647 12.554 1.00 . A A . 5 DLY C 1 1 7 965 1 1 5 . CA C 38.632 28.042 11.109 1.00 . A A . 5 DLY CA 1 1 7 966 1 1 5 . CB C 38.146 26.900 10.213 1.00 . A A . 5 DLY CB 1 1 7 967 1 1 5 . CD C 37.865 24.535 9.656 1.00 . A A . 5 DLY CD 1 1 7 968 1 1 5 . CE C 38.306 23.125 10.005 1.00 . A A . 5 DLY CE 1 1 7 969 1 1 5 . CG C 38.556 25.489 10.626 1.00 . A A . 5 DLY CG 1 1 7 970 1 1 5 . H H 37.219 29.237 10.101 1.00 . A A . 5 DLY H 1 1 7 971 1 1 5 . HA H 39.706 28.069 10.916 1.00 . A A . 5 DLY HA 1 1 7 972 1 1 5 . HB2 H 38.512 27.032 9.197 1.00 . A A . 5 DLY HB2 1 1 7 973 1 1 5 . HB3 H 37.069 26.797 10.065 1.00 . A A . 5 DLY HB3 1 1 7 974 1 1 5 . HD2 H 38.221 24.686 8.634 1.00 . A A . 5 DLY HD2 1 1 7 975 1 1 5 . HD3 H 36.774 24.600 9.696 1.00 . A A . 5 DLY HD3 1 1 7 976 1 1 5 . HE2 H 39.308 22.837 9.672 1.00 . A A . 5 DLY HE2 1 1 7 977 1 1 5 . HE3 H 37.576 22.546 9.453 1.00 . A A . 5 DLY HE3 1 1 7 978 1 1 5 . HG2 H 38.235 25.382 11.661 1.00 . A A . 5 DLY HG2 1 1 7 979 1 1 5 . HG3 H 39.643 25.435 10.608 1.00 . A A . 5 DLY HG3 1 1 7 980 1 1 5 . HZ1 H 39.101 23.124 11.902 1.00 . A A . 5 DLY HZ1 1 1 7 981 1 1 5 . HZ2 H 38.336 21.819 11.610 1.00 . A A . 5 DLY HZ2 1 1 7 982 1 1 5 . HZ3 H 37.424 23.199 11.873 1.00 . A A . 5 DLY HZ3 1 1 7 983 1 1 5 . N N 38.023 29.293 10.715 1.00 . A A . 5 DLY N 1 1 7 984 1 1 5 . NZ N 38.249 22.819 11.442 1.00 . A A . 5 DLY NZ 1 1 7 985 1 1 5 . O O 37.227 27.512 12.984 1.00 . A A . 5 DLY O 1 1 7 986 1 1 6 ASP C C 40.092 28.228 15.578 1.00 . A A . 6 ASP C 1 1 7 987 1 1 6 ASP CA C 39.629 27.126 14.639 1.00 . A A . 6 ASP CA 1 1 7 988 1 1 6 ASP CB C 40.480 25.865 14.713 1.00 . A A . 6 ASP CB 1 1 7 989 1 1 6 ASP CG C 40.180 24.757 13.714 1.00 . A A . 6 ASP CG 1 1 7 990 1 1 6 ASP H H 40.301 27.864 12.733 1.00 . A A . 6 ASP H 1 1 7 991 1 1 6 ASP HA H 38.646 26.802 14.971 1.00 . A A . 6 ASP HA 1 1 7 992 1 1 6 ASP HB2 H 41.518 26.173 14.574 1.00 . A A . 6 ASP HB2 1 1 7 993 1 1 6 ASP HB3 H 40.309 25.398 15.683 1.00 . A A . 6 ASP HB3 1 1 7 994 1 1 6 ASP N N 39.497 27.628 13.284 1.00 . A A . 6 ASP N 1 1 7 995 1 1 6 ASP O O 40.477 27.994 16.724 1.00 . A A . 6 ASP O 1 1 7 996 1 1 6 ASP OD1 O 39.165 24.027 13.810 1.00 . A A . 6 ASP OD1 1 1 7 997 1 1 6 ASP OD2 O 41.057 24.534 12.852 1.00 . A A . 6 ASP OD2 1 1 7 998 1 1 7 SER C C 38.998 31.785 15.430 1.00 . A A . 7 SER C 1 1 7 999 1 1 7 SER CA C 39.815 30.655 16.050 1.00 . A A . 7 SER CA 1 1 7 1000 1 1 7 SER CB C 41.203 31.216 16.333 1.00 . A A . 7 SER CB 1 1 7 1001 1 1 7 SER H H 39.709 29.691 14.233 1.00 . A A . 7 SER H 1 1 7 1002 1 1 7 SER HA H 39.365 30.299 16.981 1.00 . A A . 7 SER HA 1 1 7 1003 1 1 7 SER HB2 H 41.646 31.552 15.398 1.00 . A A . 7 SER HB2 1 1 7 1004 1 1 7 SER HB3 H 41.077 32.049 17.027 1.00 . A A . 7 SER HB3 1 1 7 1005 1 1 7 SER HG H 41.628 29.375 16.734 1.00 . A A . 7 SER HG 1 1 7 1006 1 1 7 SER N N 39.960 29.496 15.193 1.00 . A A . 7 SER N 1 1 7 1007 1 1 7 SER O O 39.070 31.931 14.217 1.00 . A A . 7 SER O 1 1 7 1008 1 1 7 SER OG O 41.966 30.234 17.005 1.00 . A A . 7 SER OG 1 1 7 1009 1 1 8 . C C 35.884 32.956 16.099 1.00 . A A . 8 DTY C 1 1 7 1010 1 1 8 . CA C 37.237 33.577 15.758 1.00 . A A . 8 DTY CA 1 1 7 1011 1 1 8 . CB C 37.419 34.876 16.537 1.00 . A A . 8 DTY CB 1 1 7 1012 1 1 8 . CD1 C 39.639 35.545 15.550 1.00 . A A . 8 DTY CD1 1 1 7 1013 1 1 8 . CD2 C 37.933 37.210 15.622 1.00 . A A . 8 DTY CD2 1 1 7 1014 1 1 8 . CE1 C 40.503 36.404 14.861 1.00 . A A . 8 DTY CE1 1 1 7 1015 1 1 8 . CE2 C 38.733 38.081 14.866 1.00 . A A . 8 DTY CE2 1 1 7 1016 1 1 8 . CG C 38.319 35.891 15.875 1.00 . A A . 8 DTY CG 1 1 7 1017 1 1 8 . CZ C 40.036 37.681 14.504 1.00 . A A . 8 DTY CZ 1 1 7 1018 1 1 8 . H H 38.227 32.367 17.143 1.00 . A A . 8 DTY H 1 1 7 1019 1 1 8 . HA H 37.264 33.846 14.697 1.00 . A A . 8 DTY HA 1 1 7 1020 1 1 8 . HB2 H 37.679 34.634 17.562 1.00 . A A . 8 DTY HB2 1 1 7 1021 1 1 8 . HB3 H 36.440 35.342 16.515 1.00 . A A . 8 DTY HB3 1 1 7 1022 1 1 8 . HD1 H 40.045 34.556 15.728 1.00 . A A . 8 DTY HD1 1 1 7 1023 1 1 8 . HD2 H 36.904 37.498 15.780 1.00 . A A . 8 DTY HD2 1 1 7 1024 1 1 8 . HE1 H 41.457 36.070 14.483 1.00 . A A . 8 DTY HE1 1 1 7 1025 1 1 8 . HE2 H 38.474 39.102 14.643 1.00 . A A . 8 DTY HE2 1 1 7 1026 1 1 8 . HH H 40.192 39.154 13.329 1.00 . A A . 8 DTY HH 1 1 7 1027 1 1 8 . N N 38.201 32.583 16.154 1.00 . A A . 8 DTY N 1 1 7 1028 1 1 8 . O O 35.717 32.134 17.005 1.00 . A A . 8 DTY O 1 1 7 1029 1 1 8 . OH O 40.767 38.460 13.652 1.00 . A A . 8 DTY OH 1 1 7 1030 1 1 9 . C C 32.481 33.827 15.386 1.00 . A A . 9 DCY C 1 1 7 1031 1 1 9 . CA C 33.589 32.801 15.179 1.00 . A A . 9 DCY CA 1 1 7 1032 1 1 9 . CB C 33.428 32.045 13.872 1.00 . A A . 9 DCY CB 1 1 7 1033 1 1 9 . H H 35.099 34.123 14.634 1.00 . A A . 9 DCY H 1 1 7 1034 1 1 9 . HA H 33.477 32.049 15.954 1.00 . A A . 9 DCY HA 1 1 7 1035 1 1 9 . HB2 H 33.928 32.561 13.051 1.00 . A A . 9 DCY HB2 1 1 7 1036 1 1 9 . HB3 H 32.358 31.902 13.704 1.00 . A A . 9 DCY HB3 1 1 7 1037 1 1 9 . N N 34.914 33.379 15.300 1.00 . A A . 9 DCY N 1 1 7 1038 1 1 9 . O O 31.905 34.302 14.406 1.00 . A A . 9 DCY O 1 1 7 1039 1 1 9 . SG S 34.310 30.467 13.995 1.00 . A A . 9 DCY SG 1 1 7 1040 1 1 10 PRO C C 31.485 36.563 16.020 1.00 . A A . 10 PRO C 1 1 7 1041 1 1 10 PRO CA C 31.356 35.363 16.942 1.00 . A A . 10 PRO CA 1 1 7 1042 1 1 10 PRO CB C 31.439 35.747 18.417 1.00 . A A . 10 PRO CB 1 1 7 1043 1 1 10 PRO CD C 32.892 33.966 17.895 1.00 . A A . 10 PRO CD 1 1 7 1044 1 1 10 PRO CG C 31.925 34.411 18.991 1.00 . A A . 10 PRO CG 1 1 7 1045 1 1 10 PRO HA H 30.390 34.870 16.811 1.00 . A A . 10 PRO HA 1 1 7 1046 1 1 10 PRO HB2 H 32.211 36.503 18.568 1.00 . A A . 10 PRO HB2 1 1 7 1047 1 1 10 PRO HB3 H 30.485 36.054 18.855 1.00 . A A . 10 PRO HB3 1 1 7 1048 1 1 10 PRO HD2 H 33.834 34.442 18.153 1.00 . A A . 10 PRO HD2 1 1 7 1049 1 1 10 PRO HD3 H 33.006 32.888 18.055 1.00 . A A . 10 PRO HD3 1 1 7 1050 1 1 10 PRO HG2 H 32.433 34.573 19.951 1.00 . A A . 10 PRO HG2 1 1 7 1051 1 1 10 PRO HG3 H 31.085 33.719 19.072 1.00 . A A . 10 PRO HG3 1 1 7 1052 1 1 10 PRO N N 32.324 34.338 16.618 1.00 . A A . 10 PRO N 1 1 7 1053 1 1 10 PRO O O 32.592 37.044 15.799 1.00 . A A . 10 PRO O 1 1 7 1054 1 1 11 . C C 30.551 37.762 13.081 1.00 . A A . 11 DSN C 1 1 7 1055 1 1 11 . CA C 30.320 38.134 14.537 1.00 . A A . 11 DSN CA 1 1 7 1056 1 1 11 . CB C 28.990 38.873 14.660 1.00 . A A . 11 DSN CB 1 1 7 1057 1 1 11 . H H 29.445 36.682 15.748 1.00 . A A . 11 DSN H 1 1 7 1058 1 1 11 . HA H 31.078 38.865 14.823 1.00 . A A . 11 DSN HA 1 1 7 1059 1 1 11 . HB2 H 28.257 38.275 14.117 1.00 . A A . 11 DSN HB2 1 1 7 1060 1 1 11 . HB3 H 29.087 39.772 14.059 1.00 . A A . 11 DSN HB3 1 1 7 1061 1 1 11 . HG H 28.071 39.969 15.815 1.00 . A A . 11 DSN HG 1 1 7 1062 1 1 11 . N N 30.354 37.053 15.500 1.00 . A A . 11 DSN N 1 1 7 1063 1 1 11 . O O 30.581 38.665 12.254 1.00 . A A . 11 DSN O 1 1 7 1064 1 1 11 . OG O 28.564 39.170 15.972 1.00 . A A . 11 DSN OG 1 1 8 1065 1 1 1 DAL C C 33.022 36.657 11.487 1.00 . A A . 1 DAL C 1 1 8 1066 1 1 1 DAL CA C 31.503 36.640 11.550 1.00 . A A . 1 DAL CA 1 1 8 1067 1 1 1 DAL CB C 30.855 35.328 11.114 1.00 . A A . 1 DAL CB 1 1 8 1068 1 1 1 DAL H1 H 31.072 36.290 13.548 1.00 . A A . 1 DAL H1 1 1 8 1069 1 1 1 DAL HA H 31.247 37.388 10.809 1.00 . A A . 1 DAL HA 1 1 8 1070 1 1 1 DAL HB1 H 31.154 35.063 10.097 1.00 . A A . 1 DAL HB1 1 1 8 1071 1 1 1 DAL HB2 H 29.775 35.480 11.143 1.00 . A A . 1 DAL HB2 1 1 8 1072 1 1 1 DAL HB3 H 31.109 34.492 11.768 1.00 . A A . 1 DAL HB3 1 1 8 1073 1 1 1 DAL N N 30.946 37.002 12.843 1.00 . A A . 1 DAL N 1 1 8 1074 1 1 1 DAL O O 33.648 36.514 10.446 1.00 . A A . 1 DAL O 1 1 8 1075 1 1 2 GLN C C 35.938 35.888 12.404 1.00 . A A . 2 GLN C 1 1 8 1076 1 1 2 GLN CA C 35.111 37.106 12.783 1.00 . A A . 2 GLN CA 1 1 8 1077 1 1 2 GLN CB C 35.454 37.477 14.218 1.00 . A A . 2 GLN CB 1 1 8 1078 1 1 2 GLN CD C 35.103 39.207 16.006 1.00 . A A . 2 GLN CD 1 1 8 1079 1 1 2 GLN CG C 35.066 38.917 14.512 1.00 . A A . 2 GLN CG 1 1 8 1080 1 1 2 GLN H H 33.081 37.065 13.428 1.00 . A A . 2 GLN H 1 1 8 1081 1 1 2 GLN HA H 35.336 37.959 12.151 1.00 . A A . 2 GLN HA 1 1 8 1082 1 1 2 GLN HB2 H 34.935 36.775 14.883 1.00 . A A . 2 GLN HB2 1 1 8 1083 1 1 2 GLN HB3 H 36.532 37.450 14.357 1.00 . A A . 2 GLN HB3 1 1 8 1084 1 1 2 GLN HE21 H 33.523 38.083 16.367 1.00 . A A . 2 GLN HE21 1 1 8 1085 1 1 2 GLN HE22 H 34.010 39.190 17.668 1.00 . A A . 2 GLN HE22 1 1 8 1086 1 1 2 GLN HG2 H 35.637 39.702 14.018 1.00 . A A . 2 GLN HG2 1 1 8 1087 1 1 2 GLN HG3 H 34.023 39.152 14.284 1.00 . A A . 2 GLN HG3 1 1 8 1088 1 1 2 GLN N N 33.680 36.908 12.626 1.00 . A A . 2 GLN N 1 1 8 1089 1 1 2 GLN NE2 N 34.218 38.652 16.836 1.00 . A A . 2 GLN NE2 1 1 8 1090 1 1 2 GLN O O 35.784 34.833 13.034 1.00 . A A . 2 GLN O 1 1 8 1091 1 1 2 GLN OE1 O 36.062 39.810 16.495 1.00 . A A . 2 GLN OE1 1 1 8 1092 1 1 3 DPR C C 37.526 33.754 10.803 1.00 . A A . 3 DPR C 1 1 8 1093 1 1 3 DPR CA C 38.052 35.078 11.335 1.00 . A A . 3 DPR CA 1 1 8 1094 1 1 3 DPR CB C 39.071 35.671 10.365 1.00 . A A . 3 DPR CB 1 1 8 1095 1 1 3 DPR CD C 37.101 37.004 10.523 1.00 . A A . 3 DPR CD 1 1 8 1096 1 1 3 DPR CG C 38.167 36.564 9.529 1.00 . A A . 3 DPR CG 1 1 8 1097 1 1 3 DPR HA H 38.505 34.738 12.274 1.00 . A A . 3 DPR HA 1 1 8 1098 1 1 3 DPR HB2 H 39.546 34.870 9.782 1.00 . A A . 3 DPR HB2 1 1 8 1099 1 1 3 DPR HB3 H 39.862 36.183 10.903 1.00 . A A . 3 DPR HB3 1 1 8 1100 1 1 3 DPR HD2 H 36.208 37.085 9.911 1.00 . A A . 3 DPR HD2 1 1 8 1101 1 1 3 DPR HD3 H 37.371 38.004 10.848 1.00 . A A . 3 DPR HD3 1 1 8 1102 1 1 3 DPR HG2 H 37.651 35.946 8.781 1.00 . A A . 3 DPR HG2 1 1 8 1103 1 1 3 DPR HG3 H 38.629 37.449 9.090 1.00 . A A . 3 DPR HG3 1 1 8 1104 1 1 3 DPR N N 36.983 36.017 11.585 1.00 . A A . 3 DPR N 1 1 8 1105 1 1 3 DPR O O 36.579 33.797 10.027 1.00 . A A . 3 DPR O 1 1 8 1106 1 1 4 . C C 38.424 30.208 11.285 1.00 . A A . 4 DCY C 1 1 8 1107 1 1 4 . CA C 37.394 31.338 11.306 1.00 . A A . 4 DCY CA 1 1 8 1108 1 1 4 . CB C 36.418 31.218 12.478 1.00 . A A . 4 DCY CB 1 1 8 1109 1 1 4 . H H 38.804 32.687 11.971 1.00 . A A . 4 DCY H 1 1 8 1110 1 1 4 . HA H 36.865 31.235 10.363 1.00 . A A . 4 DCY HA 1 1 8 1111 1 1 4 . HB2 H 35.861 32.142 12.653 1.00 . A A . 4 DCY HB2 1 1 8 1112 1 1 4 . HB3 H 36.986 30.928 13.355 1.00 . A A . 4 DCY HB3 1 1 8 1113 1 1 4 . N N 38.042 32.631 11.309 1.00 . A A . 4 DCY N 1 1 8 1114 1 1 4 . O O 39.548 30.395 11.742 1.00 . A A . 4 DCY O 1 1 8 1115 1 1 4 . SG S 34.987 30.167 12.136 1.00 . A A . 4 DCY SG 1 1 8 1116 1 1 5 . C C 38.648 27.601 12.724 1.00 . A A . 5 DLY C 1 1 8 1117 1 1 5 . CA C 38.651 27.799 11.215 1.00 . A A . 5 DLY CA 1 1 8 1118 1 1 5 . CB C 38.136 26.608 10.421 1.00 . A A . 5 DLY CB 1 1 8 1119 1 1 5 . CD C 37.911 24.200 9.955 1.00 . A A . 5 DLY CD 1 1 8 1120 1 1 5 . CE C 38.007 22.778 10.499 1.00 . A A . 5 DLY CE 1 1 8 1121 1 1 5 . CG C 38.580 25.224 10.874 1.00 . A A . 5 DLY CG 1 1 8 1122 1 1 5 . H H 37.056 28.945 10.428 1.00 . A A . 5 DLY H 1 1 8 1123 1 1 5 . HA H 39.700 27.926 10.941 1.00 . A A . 5 DLY HA 1 1 8 1124 1 1 5 . HB2 H 38.374 26.746 9.369 1.00 . A A . 5 DLY HB2 1 1 8 1125 1 1 5 . HB3 H 37.050 26.588 10.517 1.00 . A A . 5 DLY HB3 1 1 8 1126 1 1 5 . HD2 H 38.344 24.332 8.967 1.00 . A A . 5 DLY HD2 1 1 8 1127 1 1 5 . HD3 H 36.862 24.483 9.827 1.00 . A A . 5 DLY HD3 1 1 8 1128 1 1 5 . HE2 H 37.589 22.809 11.498 1.00 . A A . 5 DLY HE2 1 1 8 1129 1 1 5 . HE3 H 39.062 22.539 10.605 1.00 . A A . 5 DLY HE3 1 1 8 1130 1 1 5 . HG2 H 38.313 25.115 11.930 1.00 . A A . 5 DLY HG2 1 1 8 1131 1 1 5 . HG3 H 39.672 25.185 10.886 1.00 . A A . 5 DLY HG3 1 1 8 1132 1 1 5 . HZ1 H 36.299 22.107 9.448 1.00 . A A . 5 DLY HZ1 1 1 8 1133 1 1 5 . HZ2 H 37.234 20.885 9.973 1.00 . A A . 5 DLY HZ2 1 1 8 1134 1 1 5 . HZ3 H 37.739 21.795 8.764 1.00 . A A . 5 DLY HZ3 1 1 8 1135 1 1 5 . N N 37.958 29.030 10.866 1.00 . A A . 5 DLY N 1 1 8 1136 1 1 5 . NZ N 37.256 21.835 9.649 1.00 . A A . 5 DLY NZ 1 1 8 1137 1 1 5 . O O 37.578 27.525 13.321 1.00 . A A . 5 DLY O 1 1 8 1138 1 1 6 ASP C C 40.090 28.588 15.620 1.00 . A A . 6 ASP C 1 1 8 1139 1 1 6 ASP CA C 40.137 27.352 14.738 1.00 . A A . 6 ASP CA 1 1 8 1140 1 1 6 ASP CB C 41.443 26.583 14.933 1.00 . A A . 6 ASP CB 1 1 8 1141 1 1 6 ASP CG C 42.631 27.256 14.273 1.00 . A A . 6 ASP CG 1 1 8 1142 1 1 6 ASP H H 40.580 27.831 12.728 1.00 . A A . 6 ASP H 1 1 8 1143 1 1 6 ASP HA H 39.355 26.723 15.153 1.00 . A A . 6 ASP HA 1 1 8 1144 1 1 6 ASP HB2 H 41.568 26.427 16.001 1.00 . A A . 6 ASP HB2 1 1 8 1145 1 1 6 ASP HB3 H 41.292 25.580 14.532 1.00 . A A . 6 ASP HB3 1 1 8 1146 1 1 6 ASP N N 39.831 27.527 13.331 1.00 . A A . 6 ASP N 1 1 8 1147 1 1 6 ASP O O 40.226 28.508 16.842 1.00 . A A . 6 ASP O 1 1 8 1148 1 1 6 ASP OD1 O 42.917 28.457 14.497 1.00 . A A . 6 ASP OD1 1 1 8 1149 1 1 6 ASP OD2 O 43.310 26.532 13.521 1.00 . A A . 6 ASP OD2 1 1 8 1150 1 1 7 SER C C 38.974 32.031 15.040 1.00 . A A . 7 SER C 1 1 8 1151 1 1 7 SER CA C 40.028 31.025 15.507 1.00 . A A . 7 SER CA 1 1 8 1152 1 1 7 SER CB C 41.425 31.571 15.266 1.00 . A A . 7 SER CB 1 1 8 1153 1 1 7 SER H H 39.908 29.593 13.924 1.00 . A A . 7 SER H 1 1 8 1154 1 1 7 SER HA H 39.934 30.831 16.576 1.00 . A A . 7 SER HA 1 1 8 1155 1 1 7 SER HB2 H 41.609 31.674 14.193 1.00 . A A . 7 SER HB2 1 1 8 1156 1 1 7 SER HB3 H 41.515 32.572 15.683 1.00 . A A . 7 SER HB3 1 1 8 1157 1 1 7 SER HG H 42.586 30.093 15.182 1.00 . A A . 7 SER HG 1 1 8 1158 1 1 7 SER N N 39.852 29.707 14.925 1.00 . A A . 7 SER N 1 1 8 1159 1 1 7 SER O O 39.098 32.648 13.988 1.00 . A A . 7 SER O 1 1 8 1160 1 1 7 SER OG O 42.445 30.777 15.833 1.00 . A A . 7 SER OG 1 1 8 1161 1 1 8 . C C 35.511 32.731 15.864 1.00 . A A . 8 DTY C 1 1 8 1162 1 1 8 . CA C 36.923 33.257 15.603 1.00 . A A . 8 DTY CA 1 1 8 1163 1 1 8 . CB C 37.350 34.392 16.524 1.00 . A A . 8 DTY CB 1 1 8 1164 1 1 8 . CD1 C 39.002 35.820 15.230 1.00 . A A . 8 DTY CD1 1 1 8 1165 1 1 8 . CD2 C 39.736 34.543 17.172 1.00 . A A . 8 DTY CD2 1 1 8 1166 1 1 8 . CE1 C 40.339 36.183 14.988 1.00 . A A . 8 DTY CE1 1 1 8 1167 1 1 8 . CE2 C 41.051 34.941 16.912 1.00 . A A . 8 DTY CE2 1 1 8 1168 1 1 8 . CG C 38.719 35.010 16.330 1.00 . A A . 8 DTY CG 1 1 8 1169 1 1 8 . CZ C 41.375 35.839 15.876 1.00 . A A . 8 DTY CZ 1 1 8 1170 1 1 8 . H H 37.906 31.722 16.700 1.00 . A A . 8 DTY H 1 1 8 1171 1 1 8 . HA H 36.978 33.744 14.630 1.00 . A A . 8 DTY HA 1 1 8 1172 1 1 8 . HB2 H 37.245 34.124 17.567 1.00 . A A . 8 DTY HB2 1 1 8 1173 1 1 8 . HB3 H 36.682 35.233 16.329 1.00 . A A . 8 DTY HB3 1 1 8 1174 1 1 8 . HD1 H 38.299 36.097 14.460 1.00 . A A . 8 DTY HD1 1 1 8 1175 1 1 8 . HD2 H 39.463 33.860 17.967 1.00 . A A . 8 DTY HD2 1 1 8 1176 1 1 8 . HE1 H 40.591 36.774 14.121 1.00 . A A . 8 DTY HE1 1 1 8 1177 1 1 8 . HE2 H 41.879 34.491 17.429 1.00 . A A . 8 DTY HE2 1 1 8 1178 1 1 8 . HH H 43.181 35.956 16.344 1.00 . A A . 8 DTY HH 1 1 8 1179 1 1 8 . N N 37.895 32.206 15.809 1.00 . A A . 8 DTY N 1 1 8 1180 1 1 8 . O O 35.256 31.952 16.787 1.00 . A A . 8 DTY O 1 1 8 1181 1 1 8 . OH O 42.626 36.318 15.642 1.00 . A A . 8 DTY OH 1 1 8 1182 1 1 9 . C C 32.286 33.954 15.152 1.00 . A A . 9 DCY C 1 1 8 1183 1 1 9 . CA C 33.181 32.736 14.955 1.00 . A A . 9 DCY CA 1 1 8 1184 1 1 9 . CB C 33.026 32.013 13.629 1.00 . A A . 9 DCY CB 1 1 8 1185 1 1 9 . H H 34.857 33.768 14.282 1.00 . A A . 9 DCY H 1 1 8 1186 1 1 9 . HA H 32.998 32.082 15.808 1.00 . A A . 9 DCY HA 1 1 8 1187 1 1 9 . HB2 H 33.561 32.604 12.879 1.00 . A A . 9 DCY HB2 1 1 8 1188 1 1 9 . HB3 H 31.946 31.955 13.530 1.00 . A A . 9 DCY HB3 1 1 8 1189 1 1 9 . N N 34.584 33.095 14.983 1.00 . A A . 9 DCY N 1 1 8 1190 1 1 9 . O O 31.635 34.436 14.236 1.00 . A A . 9 DCY O 1 1 8 1191 1 1 9 . SG S 33.766 30.357 13.759 1.00 . A A . 9 DCY SG 1 1 8 1192 1 1 10 PRO C C 31.284 36.752 15.875 1.00 . A A . 10 PRO C 1 1 8 1193 1 1 10 PRO CA C 31.215 35.528 16.777 1.00 . A A . 10 PRO CA 1 1 8 1194 1 1 10 PRO CB C 31.670 35.964 18.161 1.00 . A A . 10 PRO CB 1 1 8 1195 1 1 10 PRO CD C 32.920 34.065 17.505 1.00 . A A . 10 PRO CD 1 1 8 1196 1 1 10 PRO CG C 32.235 34.662 18.727 1.00 . A A . 10 PRO CG 1 1 8 1197 1 1 10 PRO HA H 30.178 35.186 16.803 1.00 . A A . 10 PRO HA 1 1 8 1198 1 1 10 PRO HB2 H 32.438 36.744 18.126 1.00 . A A . 10 PRO HB2 1 1 8 1199 1 1 10 PRO HB3 H 30.834 36.271 18.787 1.00 . A A . 10 PRO HB3 1 1 8 1200 1 1 10 PRO HD2 H 33.942 34.440 17.418 1.00 . A A . 10 PRO HD2 1 1 8 1201 1 1 10 PRO HD3 H 32.985 32.986 17.658 1.00 . A A . 10 PRO HD3 1 1 8 1202 1 1 10 PRO HG2 H 32.978 34.941 19.479 1.00 . A A . 10 PRO HG2 1 1 8 1203 1 1 10 PRO HG3 H 31.508 34.004 19.194 1.00 . A A . 10 PRO HG3 1 1 8 1204 1 1 10 PRO N N 32.180 34.534 16.352 1.00 . A A . 10 PRO N 1 1 8 1205 1 1 10 PRO O O 32.330 37.137 15.356 1.00 . A A . 10 PRO O 1 1 8 1206 1 1 11 . C C 30.338 38.140 13.175 1.00 . A A . 11 DSN C 1 1 8 1207 1 1 11 . CA C 29.977 38.420 14.629 1.00 . A A . 11 DSN CA 1 1 8 1208 1 1 11 . CB C 28.543 38.935 14.620 1.00 . A A . 11 DSN CB 1 1 8 1209 1 1 11 . H H 29.246 37.093 16.036 1.00 . A A . 11 DSN H 1 1 8 1210 1 1 11 . HA H 30.582 39.212 15.070 1.00 . A A . 11 DSN HA 1 1 8 1211 1 1 11 . HB2 H 28.397 39.798 13.979 1.00 . A A . 11 DSN HB2 1 1 8 1212 1 1 11 . HB3 H 28.298 39.167 15.661 1.00 . A A . 11 DSN HB3 1 1 8 1213 1 1 11 . HG H 26.801 38.110 14.243 1.00 . A A . 11 DSN HG 1 1 8 1214 1 1 11 . N N 30.125 37.364 15.612 1.00 . A A . 11 DSN N 1 1 8 1215 1 1 11 . O O 30.229 39.044 12.363 1.00 . A A . 11 DSN O 1 1 8 1216 1 1 11 . OG O 27.732 37.881 14.153 1.00 . A A . 11 DSN OG 1 1 9 1217 1 1 1 DAL C C 33.236 36.605 11.512 1.00 . A A . 1 DAL C 1 1 9 1218 1 1 1 DAL CA C 31.707 36.563 11.538 1.00 . A A . 1 DAL CA 1 1 9 1219 1 1 1 DAL CB C 31.225 35.161 11.180 1.00 . A A . 1 DAL CB 1 1 9 1220 1 1 1 DAL H1 H 31.342 36.354 13.586 1.00 . A A . 1 DAL H1 1 1 9 1221 1 1 1 DAL HA H 31.403 37.292 10.777 1.00 . A A . 1 DAL HA 1 1 9 1222 1 1 1 DAL HB1 H 31.488 34.940 10.139 1.00 . A A . 1 DAL HB1 1 1 9 1223 1 1 1 DAL HB2 H 30.162 35.101 11.385 1.00 . A A . 1 DAL HB2 1 1 9 1224 1 1 1 DAL HB3 H 31.563 34.372 11.855 1.00 . A A . 1 DAL HB3 1 1 9 1225 1 1 1 DAL N N 31.142 36.966 12.806 1.00 . A A . 1 DAL N 1 1 9 1226 1 1 1 DAL O O 33.863 36.260 10.512 1.00 . A A . 1 DAL O 1 1 9 1227 1 1 2 GLN C C 36.165 36.251 12.496 1.00 . A A . 2 GLN C 1 1 9 1228 1 1 2 GLN CA C 35.260 37.479 12.506 1.00 . A A . 2 GLN CA 1 1 9 1229 1 1 2 GLN CB C 35.584 38.519 13.571 1.00 . A A . 2 GLN CB 1 1 9 1230 1 1 2 GLN CD C 34.946 40.659 14.630 1.00 . A A . 2 GLN CD 1 1 9 1231 1 1 2 GLN CG C 34.608 39.682 13.507 1.00 . A A . 2 GLN CG 1 1 9 1232 1 1 2 GLN H H 33.329 37.476 13.326 1.00 . A A . 2 GLN H 1 1 9 1233 1 1 2 GLN HA H 35.354 37.953 11.530 1.00 . A A . 2 GLN HA 1 1 9 1234 1 1 2 GLN HB2 H 35.405 38.038 14.538 1.00 . A A . 2 GLN HB2 1 1 9 1235 1 1 2 GLN HB3 H 36.606 38.889 13.440 1.00 . A A . 2 GLN HB3 1 1 9 1236 1 1 2 GLN HE21 H 34.072 39.642 16.076 1.00 . A A . 2 GLN HE21 1 1 9 1237 1 1 2 GLN HE22 H 34.863 41.155 16.596 1.00 . A A . 2 GLN HE22 1 1 9 1238 1 1 2 GLN HG2 H 34.671 40.284 12.601 1.00 . A A . 2 GLN HG2 1 1 9 1239 1 1 2 GLN HG3 H 33.541 39.514 13.662 1.00 . A A . 2 GLN HG3 1 1 9 1240 1 1 2 GLN N N 33.870 37.049 12.591 1.00 . A A . 2 GLN N 1 1 9 1241 1 1 2 GLN NE2 N 34.702 40.420 15.924 1.00 . A A . 2 GLN NE2 1 1 9 1242 1 1 2 GLN O O 35.942 35.318 13.269 1.00 . A A . 2 GLN O 1 1 9 1243 1 1 2 GLN OE1 O 35.492 41.737 14.421 1.00 . A A . 2 GLN OE1 1 1 9 1244 1 1 3 DPR C C 37.344 33.745 11.009 1.00 . A A . 3 DPR C 1 1 9 1245 1 1 3 DPR CA C 38.004 35.023 11.496 1.00 . A A . 3 DPR CA 1 1 9 1246 1 1 3 DPR CB C 39.169 35.487 10.624 1.00 . A A . 3 DPR CB 1 1 9 1247 1 1 3 DPR CD C 37.639 37.222 10.719 1.00 . A A . 3 DPR CD 1 1 9 1248 1 1 3 DPR CG C 38.533 36.528 9.702 1.00 . A A . 3 DPR CG 1 1 9 1249 1 1 3 DPR HA H 38.390 34.731 12.473 1.00 . A A . 3 DPR HA 1 1 9 1250 1 1 3 DPR HB2 H 39.582 34.685 10.018 1.00 . A A . 3 DPR HB2 1 1 9 1251 1 1 3 DPR HB3 H 39.945 35.960 11.236 1.00 . A A . 3 DPR HB3 1 1 9 1252 1 1 3 DPR HD2 H 36.796 37.700 10.219 1.00 . A A . 3 DPR HD2 1 1 9 1253 1 1 3 DPR HD3 H 38.215 37.942 11.307 1.00 . A A . 3 DPR HD3 1 1 9 1254 1 1 3 DPR HG2 H 37.945 36.064 8.909 1.00 . A A . 3 DPR HG2 1 1 9 1255 1 1 3 DPR HG3 H 39.251 37.261 9.324 1.00 . A A . 3 DPR HG3 1 1 9 1256 1 1 3 DPR N N 37.145 36.186 11.605 1.00 . A A . 3 DPR N 1 1 9 1257 1 1 3 DPR O O 36.464 33.750 10.160 1.00 . A A . 3 DPR O 1 1 9 1258 1 1 4 . C C 38.044 30.168 11.598 1.00 . A A . 4 DCY C 1 1 9 1259 1 1 4 . CA C 37.056 31.324 11.564 1.00 . A A . 4 DCY CA 1 1 9 1260 1 1 4 . CB C 36.201 31.325 12.829 1.00 . A A . 4 DCY CB 1 1 9 1261 1 1 4 . H H 38.580 32.596 12.129 1.00 . A A . 4 DCY H 1 1 9 1262 1 1 4 . HA H 36.387 31.230 10.710 1.00 . A A . 4 DCY HA 1 1 9 1263 1 1 4 . HB2 H 35.953 32.326 13.178 1.00 . A A . 4 DCY HB2 1 1 9 1264 1 1 4 . HB3 H 36.711 30.742 13.603 1.00 . A A . 4 DCY HB3 1 1 9 1265 1 1 4 . N N 37.771 32.586 11.522 1.00 . A A . 4 DCY N 1 1 9 1266 1 1 4 . O O 39.236 30.256 11.925 1.00 . A A . 4 DCY O 1 1 9 1267 1 1 4 . SG S 34.649 30.489 12.435 1.00 . A A . 4 DCY SG 1 1 9 1268 1 1 5 . C C 38.654 27.387 12.598 1.00 . A A . 5 DLY C 1 1 9 1269 1 1 5 . CA C 38.287 27.763 11.173 1.00 . A A . 5 DLY CA 1 1 9 1270 1 1 5 . CB C 37.474 26.697 10.451 1.00 . A A . 5 DLY CB 1 1 9 1271 1 1 5 . CD C 37.423 24.509 9.205 1.00 . A A . 5 DLY CD 1 1 9 1272 1 1 5 . CE C 38.100 23.165 8.959 1.00 . A A . 5 DLY CE 1 1 9 1273 1 1 5 . CG C 38.209 25.401 10.159 1.00 . A A . 5 DLY CG 1 1 9 1274 1 1 5 . H H 36.528 28.933 11.077 1.00 . A A . 5 DLY H 1 1 9 1275 1 1 5 . HA H 39.211 27.886 10.595 1.00 . A A . 5 DLY HA 1 1 9 1276 1 1 5 . HB2 H 37.267 27.057 9.442 1.00 . A A . 5 DLY HB2 1 1 9 1277 1 1 5 . HB3 H 36.598 26.512 11.078 1.00 . A A . 5 DLY HB3 1 1 9 1278 1 1 5 . HD2 H 37.330 25.124 8.320 1.00 . A A . 5 DLY HD2 1 1 9 1279 1 1 5 . HD3 H 36.505 24.172 9.697 1.00 . A A . 5 DLY HD3 1 1 9 1280 1 1 5 . HE2 H 37.830 22.417 9.702 1.00 . A A . 5 DLY HE2 1 1 9 1281 1 1 5 . HE3 H 39.179 23.347 8.908 1.00 . A A . 5 DLY HE3 1 1 9 1282 1 1 5 . HG2 H 38.379 24.846 11.083 1.00 . A A . 5 DLY HG2 1 1 9 1283 1 1 5 . HG3 H 39.196 25.567 9.715 1.00 . A A . 5 DLY HG3 1 1 9 1284 1 1 5 . HZ1 H 38.240 21.654 7.619 1.00 . A A . 5 DLY HZ1 1 1 9 1285 1 1 5 . HZ2 H 38.061 23.237 6.908 1.00 . A A . 5 DLY HZ2 1 1 9 1286 1 1 5 . HZ3 H 36.817 22.541 7.672 1.00 . A A . 5 DLY HZ3 1 1 9 1287 1 1 5 . N N 37.527 28.996 11.232 1.00 . A A . 5 DLY N 1 1 9 1288 1 1 5 . NZ N 37.828 22.580 7.637 1.00 . A A . 5 DLY NZ 1 1 9 1289 1 1 5 . O O 37.768 27.063 13.402 1.00 . A A . 5 DLY O 1 1 9 1290 1 1 6 ASP C C 40.170 28.427 15.253 1.00 . A A . 6 ASP C 1 1 9 1291 1 1 6 ASP CA C 40.471 27.315 14.259 1.00 . A A . 6 ASP CA 1 1 9 1292 1 1 6 ASP CB C 41.966 27.026 14.186 1.00 . A A . 6 ASP CB 1 1 9 1293 1 1 6 ASP CG C 42.762 28.003 13.321 1.00 . A A . 6 ASP CG 1 1 9 1294 1 1 6 ASP H H 40.508 27.947 12.207 1.00 . A A . 6 ASP H 1 1 9 1295 1 1 6 ASP HA H 40.028 26.401 14.669 1.00 . A A . 6 ASP HA 1 1 9 1296 1 1 6 ASP HB2 H 42.385 27.042 15.184 1.00 . A A . 6 ASP HB2 1 1 9 1297 1 1 6 ASP HB3 H 42.194 26.045 13.763 1.00 . A A . 6 ASP HB3 1 1 9 1298 1 1 6 ASP N N 39.927 27.574 12.951 1.00 . A A . 6 ASP N 1 1 9 1299 1 1 6 ASP O O 39.981 28.073 16.418 1.00 . A A . 6 ASP O 1 1 9 1300 1 1 6 ASP OD1 O 42.940 29.148 13.800 1.00 . A A . 6 ASP OD1 1 1 9 1301 1 1 6 ASP OD2 O 43.410 27.572 12.345 1.00 . A A . 6 ASP OD2 1 1 9 1302 1 1 7 SER C C 39.298 31.896 15.152 1.00 . A A . 7 SER C 1 1 9 1303 1 1 7 SER CA C 40.182 30.833 15.786 1.00 . A A . 7 SER CA 1 1 9 1304 1 1 7 SER CB C 41.647 31.234 15.986 1.00 . A A . 7 SER CB 1 1 9 1305 1 1 7 SER H H 40.403 29.853 13.913 1.00 . A A . 7 SER H 1 1 9 1306 1 1 7 SER HA H 39.801 30.532 16.760 1.00 . A A . 7 SER HA 1 1 9 1307 1 1 7 SER HB2 H 42.062 31.559 15.028 1.00 . A A . 7 SER HB2 1 1 9 1308 1 1 7 SER HB3 H 41.667 31.904 16.845 1.00 . A A . 7 SER HB3 1 1 9 1309 1 1 7 SER HG H 42.644 29.714 15.475 1.00 . A A . 7 SER HG 1 1 9 1310 1 1 7 SER N N 40.134 29.710 14.882 1.00 . A A . 7 SER N 1 1 9 1311 1 1 7 SER O O 39.512 32.392 14.053 1.00 . A A . 7 SER O 1 1 9 1312 1 1 7 SER OG O 42.465 30.137 16.320 1.00 . A A . 7 SER OG 1 1 9 1313 1 1 8 . C C 35.852 32.800 15.913 1.00 . A A . 8 DTY C 1 1 9 1314 1 1 8 . CA C 37.262 33.284 15.612 1.00 . A A . 8 DTY CA 1 1 9 1315 1 1 8 . CB C 37.553 34.439 16.570 1.00 . A A . 8 DTY CB 1 1 9 1316 1 1 8 . CD1 C 38.858 36.259 15.494 1.00 . A A . 8 DTY CD1 1 1 9 1317 1 1 8 . CD2 C 40.062 34.714 16.927 1.00 . A A . 8 DTY CD2 1 1 9 1318 1 1 8 . CE1 C 40.031 36.979 15.259 1.00 . A A . 8 DTY CE1 1 1 9 1319 1 1 8 . CE2 C 41.253 35.356 16.551 1.00 . A A . 8 DTY CE2 1 1 9 1320 1 1 8 . CG C 38.869 35.137 16.330 1.00 . A A . 8 DTY CG 1 1 9 1321 1 1 8 . CZ C 41.264 36.528 15.771 1.00 . A A . 8 DTY CZ 1 1 9 1322 1 1 8 . H H 38.239 31.908 16.826 1.00 . A A . 8 DTY H 1 1 9 1323 1 1 8 . HA H 37.305 33.583 14.562 1.00 . A A . 8 DTY HA 1 1 9 1324 1 1 8 . HB2 H 37.575 34.091 17.602 1.00 . A A . 8 DTY HB2 1 1 9 1325 1 1 8 . HB3 H 36.716 35.125 16.506 1.00 . A A . 8 DTY HB3 1 1 9 1326 1 1 8 . HD1 H 37.920 36.656 15.117 1.00 . A A . 8 DTY HD1 1 1 9 1327 1 1 8 . HD2 H 40.120 33.866 17.595 1.00 . A A . 8 DTY HD2 1 1 9 1328 1 1 8 . HE1 H 39.932 37.837 14.605 1.00 . A A . 8 DTY HE1 1 1 9 1329 1 1 8 . HE2 H 42.216 35.008 16.906 1.00 . A A . 8 DTY HE2 1 1 9 1330 1 1 8 . HH H 43.162 36.847 15.910 1.00 . A A . 8 DTY HH 1 1 9 1331 1 1 8 . N N 38.229 32.237 15.875 1.00 . A A . 8 DTY N 1 1 9 1332 1 1 8 . O O 35.630 31.983 16.799 1.00 . A A . 8 DTY O 1 1 9 1333 1 1 8 . OH O 42.407 37.181 15.432 1.00 . A A . 8 DTY OH 1 1 9 1334 1 1 9 . C C 32.672 34.439 15.604 1.00 . A A . 9 DCY C 1 1 9 1335 1 1 9 . CA C 33.427 33.118 15.494 1.00 . A A . 9 DCY CA 1 1 9 1336 1 1 9 . CB C 32.914 32.230 14.368 1.00 . A A . 9 DCY CB 1 1 9 1337 1 1 9 . H H 35.082 34.168 14.696 1.00 . A A . 9 DCY H 1 1 9 1338 1 1 9 . HA H 33.233 32.613 16.436 1.00 . A A . 9 DCY HA 1 1 9 1339 1 1 9 . HB2 H 33.035 32.727 13.402 1.00 . A A . 9 DCY HB2 1 1 9 1340 1 1 9 . HB3 H 31.823 32.181 14.359 1.00 . A A . 9 DCY HB3 1 1 9 1341 1 1 9 . N N 34.833 33.391 15.285 1.00 . A A . 9 DCY N 1 1 9 1342 1 1 9 . O O 31.952 34.819 14.683 1.00 . A A . 9 DCY O 1 1 9 1343 1 1 9 . SG S 33.719 30.618 14.244 1.00 . A A . 9 DCY SG 1 1 9 1344 1 1 10 PRO C C 31.747 37.357 15.873 1.00 . A A . 10 PRO C 1 1 9 1345 1 1 10 PRO CA C 31.995 36.346 16.982 1.00 . A A . 10 PRO CA 1 1 9 1346 1 1 10 PRO CB C 32.572 37.067 18.192 1.00 . A A . 10 PRO CB 1 1 9 1347 1 1 10 PRO CD C 33.589 34.887 17.883 1.00 . A A . 10 PRO CD 1 1 9 1348 1 1 10 PRO CG C 33.074 35.844 18.952 1.00 . A A . 10 PRO CG 1 1 9 1349 1 1 10 PRO HA H 30.958 36.089 17.213 1.00 . A A . 10 PRO HA 1 1 9 1350 1 1 10 PRO HB2 H 33.407 37.699 17.914 1.00 . A A . 10 PRO HB2 1 1 9 1351 1 1 10 PRO HB3 H 31.817 37.600 18.766 1.00 . A A . 10 PRO HB3 1 1 9 1352 1 1 10 PRO HD2 H 34.659 35.028 17.746 1.00 . A A . 10 PRO HD2 1 1 9 1353 1 1 10 PRO HD3 H 33.243 33.895 18.185 1.00 . A A . 10 PRO HD3 1 1 9 1354 1 1 10 PRO HG2 H 33.885 36.200 19.578 1.00 . A A . 10 PRO HG2 1 1 9 1355 1 1 10 PRO HG3 H 32.337 35.356 19.591 1.00 . A A . 10 PRO HG3 1 1 9 1356 1 1 10 PRO N N 32.822 35.198 16.695 1.00 . A A . 10 PRO N 1 1 9 1357 1 1 10 PRO O O 32.661 38.078 15.458 1.00 . A A . 10 PRO O 1 1 9 1358 1 1 11 . C C 30.406 38.060 13.018 1.00 . A A . 11 DSN C 1 1 9 1359 1 1 11 . CA C 29.953 38.389 14.433 1.00 . A A . 11 DSN CA 1 1 9 1360 1 1 11 . CB C 28.440 38.530 14.541 1.00 . A A . 11 DSN CB 1 1 9 1361 1 1 11 . H H 29.843 36.792 15.789 1.00 . A A . 11 DSN H 1 1 9 1362 1 1 11 . HA H 30.366 39.375 14.664 1.00 . A A . 11 DSN HA 1 1 9 1363 1 1 11 . HB2 H 27.929 37.566 14.596 1.00 . A A . 11 DSN HB2 1 1 9 1364 1 1 11 . HB3 H 28.019 39.252 13.850 1.00 . A A . 11 DSN HB3 1 1 9 1365 1 1 11 . HG H 28.513 39.998 15.604 1.00 . A A . 11 DSN HG 1 1 9 1366 1 1 11 . N N 30.508 37.449 15.395 1.00 . A A . 11 DSN N 1 1 9 1367 1 1 11 . O O 30.091 38.763 12.060 1.00 . A A . 11 DSN O 1 1 9 1368 1 1 11 . OG O 28.145 39.140 15.781 1.00 . A A . 11 DSN OG 1 1 10 1369 1 1 1 DAL C C 33.153 36.492 11.476 1.00 . A A . 1 DAL C 1 1 10 1370 1 1 1 DAL CA C 31.662 36.183 11.523 1.00 . A A . 1 DAL CA 1 1 10 1371 1 1 1 DAL CB C 31.353 34.691 11.568 1.00 . A A . 1 DAL CB 1 1 10 1372 1 1 1 DAL H1 H 30.823 35.983 13.433 1.00 . A A . 1 DAL H1 1 1 10 1373 1 1 1 DAL HA H 31.152 36.586 10.647 1.00 . A A . 1 DAL HA 1 1 10 1374 1 1 1 DAL HB1 H 30.295 34.605 11.782 1.00 . A A . 1 DAL HB1 1 1 10 1375 1 1 1 DAL HB2 H 31.971 34.265 12.357 1.00 . A A . 1 DAL HB2 1 1 10 1376 1 1 1 DAL HB3 H 31.675 34.215 10.642 1.00 . A A . 1 DAL HB3 1 1 10 1377 1 1 1 DAL N N 30.959 36.652 12.688 1.00 . A A . 1 DAL N 1 1 10 1378 1 1 1 DAL O O 33.754 36.427 10.412 1.00 . A A . 1 DAL O 1 1 10 1379 1 1 2 GLN C C 36.131 36.250 12.573 1.00 . A A . 2 GLN C 1 1 10 1380 1 1 2 GLN CA C 35.135 37.398 12.588 1.00 . A A . 2 GLN CA 1 1 10 1381 1 1 2 GLN CB C 35.364 38.359 13.756 1.00 . A A . 2 GLN CB 1 1 10 1382 1 1 2 GLN CD C 34.677 40.450 12.355 1.00 . A A . 2 GLN CD 1 1 10 1383 1 1 2 GLN CG C 34.572 39.650 13.644 1.00 . A A . 2 GLN CG 1 1 10 1384 1 1 2 GLN H H 33.255 36.810 13.442 1.00 . A A . 2 GLN H 1 1 10 1385 1 1 2 GLN HA H 35.262 38.029 11.713 1.00 . A A . 2 GLN HA 1 1 10 1386 1 1 2 GLN HB2 H 35.062 37.904 14.704 1.00 . A A . 2 GLN HB2 1 1 10 1387 1 1 2 GLN HB3 H 36.411 38.640 13.846 1.00 . A A . 2 GLN HB3 1 1 10 1388 1 1 2 GLN HE21 H 35.984 41.835 12.997 1.00 . A A . 2 GLN HE21 1 1 10 1389 1 1 2 GLN HE22 H 35.236 42.175 11.422 1.00 . A A . 2 GLN HE22 1 1 10 1390 1 1 2 GLN HG2 H 33.522 39.564 13.933 1.00 . A A . 2 GLN HG2 1 1 10 1391 1 1 2 GLN HG3 H 34.960 40.352 14.385 1.00 . A A . 2 GLN HG3 1 1 10 1392 1 1 2 GLN N N 33.778 36.868 12.586 1.00 . A A . 2 GLN N 1 1 10 1393 1 1 2 GLN NE2 N 35.399 41.566 12.215 1.00 . A A . 2 GLN NE2 1 1 10 1394 1 1 2 GLN O O 35.921 35.248 13.253 1.00 . A A . 2 GLN O 1 1 10 1395 1 1 2 GLN OE1 O 34.092 40.140 11.326 1.00 . A A . 2 GLN OE1 1 1 10 1396 1 1 3 DPR C C 37.488 33.963 10.862 1.00 . A A . 3 DPR C 1 1 10 1397 1 1 3 DPR CA C 38.136 35.197 11.486 1.00 . A A . 3 DPR CA 1 1 10 1398 1 1 3 DPR CB C 39.216 35.708 10.550 1.00 . A A . 3 DPR CB 1 1 10 1399 1 1 3 DPR CD C 37.825 37.518 11.348 1.00 . A A . 3 DPR CD 1 1 10 1400 1 1 3 DPR CG C 39.229 37.208 10.830 1.00 . A A . 3 DPR CG 1 1 10 1401 1 1 3 DPR HA H 38.625 34.881 12.409 1.00 . A A . 3 DPR HA 1 1 10 1402 1 1 3 DPR HB2 H 38.870 35.651 9.521 1.00 . A A . 3 DPR HB2 1 1 10 1403 1 1 3 DPR HB3 H 40.222 35.280 10.607 1.00 . A A . 3 DPR HB3 1 1 10 1404 1 1 3 DPR HD2 H 37.212 37.971 10.574 1.00 . A A . 3 DPR HD2 1 1 10 1405 1 1 3 DPR HD3 H 37.950 38.185 12.193 1.00 . A A . 3 DPR HD3 1 1 10 1406 1 1 3 DPR HG2 H 39.373 37.878 9.982 1.00 . A A . 3 DPR HG2 1 1 10 1407 1 1 3 DPR HG3 H 39.874 37.398 11.694 1.00 . A A . 3 DPR HG3 1 1 10 1408 1 1 3 DPR N N 37.224 36.278 11.802 1.00 . A A . 3 DPR N 1 1 10 1409 1 1 3 DPR O O 36.609 33.919 10.008 1.00 . A A . 3 DPR O 1 1 10 1410 1 1 4 . C C 38.245 30.425 11.487 1.00 . A A . 4 DCY C 1 1 10 1411 1 1 4 . CA C 37.246 31.565 11.370 1.00 . A A . 4 DCY CA 1 1 10 1412 1 1 4 . CB C 36.184 31.521 12.475 1.00 . A A . 4 DCY CB 1 1 10 1413 1 1 4 . H H 38.659 32.939 12.114 1.00 . A A . 4 DCY H 1 1 10 1414 1 1 4 . HA H 36.731 31.514 10.405 1.00 . A A . 4 DCY HA 1 1 10 1415 1 1 4 . HB2 H 35.866 32.544 12.671 1.00 . A A . 4 DCY HB2 1 1 10 1416 1 1 4 . HB3 H 36.669 31.061 13.335 1.00 . A A . 4 DCY HB3 1 1 10 1417 1 1 4 . N N 37.948 32.826 11.408 1.00 . A A . 4 DCY N 1 1 10 1418 1 1 4 . O O 39.329 30.592 12.043 1.00 . A A . 4 DCY O 1 1 10 1419 1 1 4 . SG S 34.679 30.576 12.129 1.00 . A A . 4 DCY SG 1 1 10 1420 1 1 5 . C C 38.226 27.665 12.632 1.00 . A A . 5 DLY C 1 1 10 1421 1 1 5 . CA C 38.252 27.991 11.149 1.00 . A A . 5 DLY CA 1 1 10 1422 1 1 5 . CB C 37.506 26.915 10.358 1.00 . A A . 5 DLY CB 1 1 10 1423 1 1 5 . CD C 37.488 24.557 9.500 1.00 . A A . 5 DLY CD 1 1 10 1424 1 1 5 . CE C 38.197 23.227 9.697 1.00 . A A . 5 DLY CE 1 1 10 1425 1 1 5 . CG C 38.314 25.642 10.177 1.00 . A A . 5 DLY CG 1 1 10 1426 1 1 5 . H H 36.824 29.522 10.538 1.00 . A A . 5 DLY H 1 1 10 1427 1 1 5 . HA H 39.277 27.959 10.781 1.00 . A A . 5 DLY HA 1 1 10 1428 1 1 5 . HB2 H 37.407 27.362 9.367 1.00 . A A . 5 DLY HB2 1 1 10 1429 1 1 5 . HB3 H 36.555 26.727 10.864 1.00 . A A . 5 DLY HB3 1 1 10 1430 1 1 5 . HD2 H 37.210 24.650 8.448 1.00 . A A . 5 DLY HD2 1 1 10 1431 1 1 5 . HD3 H 36.518 24.544 9.997 1.00 . A A . 5 DLY HD3 1 1 10 1432 1 1 5 . HE2 H 38.365 23.182 10.776 1.00 . A A . 5 DLY HE2 1 1 10 1433 1 1 5 . HE3 H 39.216 23.241 9.307 1.00 . A A . 5 DLY HE3 1 1 10 1434 1 1 5 . HG2 H 38.481 25.249 11.173 1.00 . A A . 5 DLY HG2 1 1 10 1435 1 1 5 . HG3 H 39.234 25.824 9.619 1.00 . A A . 5 DLY HG3 1 1 10 1436 1 1 5 . HZ1 H 37.967 21.207 9.112 1.00 . A A . 5 DLY HZ1 1 1 10 1437 1 1 5 . HZ2 H 37.300 22.195 8.139 1.00 . A A . 5 DLY HZ2 1 1 10 1438 1 1 5 . HZ3 H 36.539 21.895 9.494 1.00 . A A . 5 DLY HZ3 1 1 10 1439 1 1 5 . N N 37.722 29.317 10.933 1.00 . A A . 5 DLY N 1 1 10 1440 1 1 5 . NZ N 37.463 22.083 9.134 1.00 . A A . 5 DLY NZ 1 1 10 1441 1 1 5 . O O 37.220 27.586 13.331 1.00 . A A . 5 DLY O 1 1 10 1442 1 1 6 ASP C C 39.878 28.618 15.408 1.00 . A A . 6 ASP C 1 1 10 1443 1 1 6 ASP CA C 39.685 27.316 14.639 1.00 . A A . 6 ASP CA 1 1 10 1444 1 1 6 ASP CB C 41.030 26.598 14.761 1.00 . A A . 6 ASP CB 1 1 10 1445 1 1 6 ASP CG C 42.208 27.297 14.105 1.00 . A A . 6 ASP CG 1 1 10 1446 1 1 6 ASP H H 40.211 27.691 12.663 1.00 . A A . 6 ASP H 1 1 10 1447 1 1 6 ASP HA H 38.902 26.724 15.109 1.00 . A A . 6 ASP HA 1 1 10 1448 1 1 6 ASP HB2 H 41.314 26.406 15.798 1.00 . A A . 6 ASP HB2 1 1 10 1449 1 1 6 ASP HB3 H 40.911 25.658 14.226 1.00 . A A . 6 ASP HB3 1 1 10 1450 1 1 6 ASP N N 39.404 27.646 13.259 1.00 . A A . 6 ASP N 1 1 10 1451 1 1 6 ASP O O 39.813 28.571 16.637 1.00 . A A . 6 ASP O 1 1 10 1452 1 1 6 ASP OD1 O 42.454 26.918 12.944 1.00 . A A . 6 ASP OD1 1 1 10 1453 1 1 6 ASP OD2 O 42.867 28.217 14.652 1.00 . A A . 6 ASP OD2 1 1 10 1454 1 1 7 SER C C 39.370 31.978 14.948 1.00 . A A . 7 SER C 1 1 10 1455 1 1 7 SER CA C 40.453 31.018 15.426 1.00 . A A . 7 SER CA 1 1 10 1456 1 1 7 SER CB C 41.799 31.505 14.892 1.00 . A A . 7 SER CB 1 1 10 1457 1 1 7 SER H H 40.325 29.749 13.773 1.00 . A A . 7 SER H 1 1 10 1458 1 1 7 SER HA H 40.455 31.014 16.515 1.00 . A A . 7 SER HA 1 1 10 1459 1 1 7 SER HB2 H 41.840 31.246 13.833 1.00 . A A . 7 SER HB2 1 1 10 1460 1 1 7 SER HB3 H 41.866 32.574 15.052 1.00 . A A . 7 SER HB3 1 1 10 1461 1 1 7 SER HG H 42.897 29.930 15.300 1.00 . A A . 7 SER HG 1 1 10 1462 1 1 7 SER N N 40.165 29.748 14.772 1.00 . A A . 7 SER N 1 1 10 1463 1 1 7 SER O O 39.389 32.620 13.904 1.00 . A A . 7 SER O 1 1 10 1464 1 1 7 SER OG O 42.831 30.840 15.598 1.00 . A A . 7 SER OG 1 1 10 1465 1 1 8 . C C 35.912 32.775 16.047 1.00 . A A . 8 DTY C 1 1 10 1466 1 1 8 . CA C 37.350 33.171 15.733 1.00 . A A . 8 DTY CA 1 1 10 1467 1 1 8 . CB C 37.837 34.314 16.621 1.00 . A A . 8 DTY CB 1 1 10 1468 1 1 8 . CD1 C 40.222 34.780 16.072 1.00 . A A . 8 DTY CD1 1 1 10 1469 1 1 8 . CD2 C 38.566 36.390 15.350 1.00 . A A . 8 DTY CD2 1 1 10 1470 1 1 8 . CE1 C 41.255 35.495 15.442 1.00 . A A . 8 DTY CE1 1 1 10 1471 1 1 8 . CE2 C 39.535 37.111 14.638 1.00 . A A . 8 DTY CE2 1 1 10 1472 1 1 8 . CG C 38.893 35.223 16.047 1.00 . A A . 8 DTY CG 1 1 10 1473 1 1 8 . CZ C 40.856 36.612 14.686 1.00 . A A . 8 DTY CZ 1 1 10 1474 1 1 8 . H H 38.283 31.505 16.545 1.00 . A A . 8 DTY H 1 1 10 1475 1 1 8 . HA H 37.345 33.512 14.694 1.00 . A A . 8 DTY HA 1 1 10 1476 1 1 8 . HB2 H 38.304 33.809 17.471 1.00 . A A . 8 DTY HB2 1 1 10 1477 1 1 8 . HB3 H 36.987 34.861 17.032 1.00 . A A . 8 DTY HB3 1 1 10 1478 1 1 8 . HD1 H 40.455 33.942 16.724 1.00 . A A . 8 DTY HD1 1 1 10 1479 1 1 8 . HD2 H 37.541 36.717 15.232 1.00 . A A . 8 DTY HD2 1 1 10 1480 1 1 8 . HE1 H 42.281 35.193 15.360 1.00 . A A . 8 DTY HE1 1 1 10 1481 1 1 8 . HE2 H 39.367 37.986 14.041 1.00 . A A . 8 DTY HE2 1 1 10 1482 1 1 8 . HH H 41.432 38.218 13.775 1.00 . A A . 8 DTY HH 1 1 10 1483 1 1 8 . N N 38.281 32.071 15.706 1.00 . A A . 8 DTY N 1 1 10 1484 1 1 8 . O O 35.705 31.904 16.889 1.00 . A A . 8 DTY O 1 1 10 1485 1 1 8 . OH O 41.788 37.379 14.061 1.00 . A A . 8 DTY OH 1 1 10 1486 1 1 9 . C C 32.583 34.139 15.662 1.00 . A A . 9 DCY C 1 1 10 1487 1 1 9 . CA C 33.551 32.968 15.570 1.00 . A A . 9 DCY CA 1 1 10 1488 1 1 9 . CB C 33.157 32.137 14.355 1.00 . A A . 9 DCY CB 1 1 10 1489 1 1 9 . H H 35.129 34.087 14.695 1.00 . A A . 9 DCY H 1 1 10 1490 1 1 9 . HA H 33.420 32.302 16.432 1.00 . A A . 9 DCY HA 1 1 10 1491 1 1 9 . HB2 H 33.271 32.763 13.466 1.00 . A A . 9 DCY HB2 1 1 10 1492 1 1 9 . HB3 H 32.082 31.998 14.465 1.00 . A A . 9 DCY HB3 1 1 10 1493 1 1 9 . N N 34.916 33.413 15.427 1.00 . A A . 9 DCY N 1 1 10 1494 1 1 9 . O O 31.705 34.253 14.813 1.00 . A A . 9 DCY O 1 1 10 1495 1 1 9 . SG S 34.015 30.580 14.055 1.00 . A A . 9 DCY SG 1 1 10 1496 1 1 10 PRO C C 31.574 36.964 15.924 1.00 . A A . 10 PRO C 1 1 10 1497 1 1 10 PRO CA C 31.604 35.885 17.004 1.00 . A A . 10 PRO CA 1 1 10 1498 1 1 10 PRO CB C 31.872 36.463 18.392 1.00 . A A . 10 PRO CB 1 1 10 1499 1 1 10 PRO CD C 33.735 35.122 17.679 1.00 . A A . 10 PRO CD 1 1 10 1500 1 1 10 PRO CG C 33.259 35.997 18.835 1.00 . A A . 10 PRO CG 1 1 10 1501 1 1 10 PRO HA H 30.638 35.369 17.065 1.00 . A A . 10 PRO HA 1 1 10 1502 1 1 10 PRO HB2 H 31.739 37.542 18.382 1.00 . A A . 10 PRO HB2 1 1 10 1503 1 1 10 PRO HB3 H 31.256 36.027 19.171 1.00 . A A . 10 PRO HB3 1 1 10 1504 1 1 10 PRO HD2 H 34.496 35.637 17.089 1.00 . A A . 10 PRO HD2 1 1 10 1505 1 1 10 PRO HD3 H 34.080 34.135 17.993 1.00 . A A . 10 PRO HD3 1 1 10 1506 1 1 10 PRO HG2 H 33.907 36.851 19.016 1.00 . A A . 10 PRO HG2 1 1 10 1507 1 1 10 PRO HG3 H 33.212 35.345 19.702 1.00 . A A . 10 PRO HG3 1 1 10 1508 1 1 10 PRO N N 32.649 34.925 16.740 1.00 . A A . 10 PRO N 1 1 10 1509 1 1 10 PRO O O 32.591 37.379 15.373 1.00 . A A . 10 PRO O 1 1 10 1510 1 1 11 . C C 30.727 37.924 13.019 1.00 . A A . 11 DSN C 1 1 10 1511 1 1 11 . CA C 30.140 38.283 14.376 1.00 . A A . 11 DSN CA 1 1 10 1512 1 1 11 . CB C 28.645 38.579 14.282 1.00 . A A . 11 DSN CB 1 1 10 1513 1 1 11 . H H 29.554 37.063 15.928 1.00 . A A . 11 DSN H 1 1 10 1514 1 1 11 . HA H 30.758 39.077 14.778 1.00 . A A . 11 DSN HA 1 1 10 1515 1 1 11 . HB2 H 28.058 37.718 13.968 1.00 . A A . 11 DSN HB2 1 1 10 1516 1 1 11 . HB3 H 28.531 39.341 13.509 1.00 . A A . 11 DSN HB3 1 1 10 1517 1 1 11 . HG H 27.212 39.392 15.271 1.00 . A A . 11 DSN HG 1 1 10 1518 1 1 11 . N N 30.391 37.285 15.401 1.00 . A A . 11 DSN N 1 1 10 1519 1 1 11 . O O 31.091 38.818 12.252 1.00 . A A . 11 DSN O 1 1 10 1520 1 1 11 . OG O 28.080 39.051 15.489 1.00 . A A . 11 DSN OG 1 1 11 1521 1 1 1 DAL C C 33.012 36.899 11.245 1.00 . A A . 1 DAL C 1 1 11 1522 1 1 1 DAL CA C 31.547 36.548 11.472 1.00 . A A . 1 DAL CA 1 1 11 1523 1 1 1 DAL CB C 31.328 35.095 11.038 1.00 . A A . 1 DAL CB 1 1 11 1524 1 1 1 DAL H1 H 31.113 35.947 13.468 1.00 . A A . 1 DAL H1 1 1 11 1525 1 1 1 DAL HA H 30.944 37.185 10.822 1.00 . A A . 1 DAL HA 1 1 11 1526 1 1 1 DAL HB1 H 30.288 34.820 11.168 1.00 . A A . 1 DAL HB1 1 1 11 1527 1 1 1 DAL HB2 H 32.045 34.536 11.640 1.00 . A A . 1 DAL HB2 1 1 11 1528 1 1 1 DAL HB3 H 31.549 35.008 9.974 1.00 . A A . 1 DAL HB3 1 1 11 1529 1 1 1 DAL N N 31.120 36.741 12.838 1.00 . A A . 1 DAL N 1 1 11 1530 1 1 1 DAL O O 33.480 37.062 10.119 1.00 . A A . 1 DAL O 1 1 11 1531 1 1 2 GLN C C 36.111 36.265 12.180 1.00 . A A . 2 GLN C 1 1 11 1532 1 1 2 GLN CA C 35.200 37.466 12.333 1.00 . A A . 2 GLN CA 1 1 11 1533 1 1 2 GLN CB C 35.531 38.268 13.593 1.00 . A A . 2 GLN CB 1 1 11 1534 1 1 2 GLN CD C 35.225 40.224 15.169 1.00 . A A . 2 GLN CD 1 1 11 1535 1 1 2 GLN CG C 34.770 39.559 13.885 1.00 . A A . 2 GLN CG 1 1 11 1536 1 1 2 GLN H H 33.364 37.082 13.227 1.00 . A A . 2 GLN H 1 1 11 1537 1 1 2 GLN HA H 35.391 38.170 11.519 1.00 . A A . 2 GLN HA 1 1 11 1538 1 1 2 GLN HB2 H 35.399 37.664 14.497 1.00 . A A . 2 GLN HB2 1 1 11 1539 1 1 2 GLN HB3 H 36.580 38.556 13.541 1.00 . A A . 2 GLN HB3 1 1 11 1540 1 1 2 GLN HE21 H 37.064 40.368 14.480 1.00 . A A . 2 GLN HE21 1 1 11 1541 1 1 2 GLN HE22 H 36.889 41.100 16.044 1.00 . A A . 2 GLN HE22 1 1 11 1542 1 1 2 GLN HG2 H 35.012 40.141 13.000 1.00 . A A . 2 GLN HG2 1 1 11 1543 1 1 2 GLN HG3 H 33.687 39.417 13.970 1.00 . A A . 2 GLN HG3 1 1 11 1544 1 1 2 GLN N N 33.791 37.118 12.308 1.00 . A A . 2 GLN N 1 1 11 1545 1 1 2 GLN NE2 N 36.464 40.728 15.209 1.00 . A A . 2 GLN NE2 1 1 11 1546 1 1 2 GLN O O 35.838 35.185 12.715 1.00 . A A . 2 GLN O 1 1 11 1547 1 1 2 GLN OE1 O 34.497 40.313 16.160 1.00 . A A . 2 GLN OE1 1 1 11 1548 1 1 3 DPR C C 37.743 34.026 10.930 1.00 . A A . 3 DPR C 1 1 11 1549 1 1 3 DPR CA C 38.236 35.351 11.502 1.00 . A A . 3 DPR CA 1 1 11 1550 1 1 3 DPR CB C 39.476 35.924 10.819 1.00 . A A . 3 DPR CB 1 1 11 1551 1 1 3 DPR CD C 37.794 37.539 10.781 1.00 . A A . 3 DPR CD 1 1 11 1552 1 1 3 DPR CG C 38.915 37.005 9.896 1.00 . A A . 3 DPR CG 1 1 11 1553 1 1 3 DPR HA H 38.465 35.120 12.546 1.00 . A A . 3 DPR HA 1 1 11 1554 1 1 3 DPR HB2 H 39.965 35.164 10.222 1.00 . A A . 3 DPR HB2 1 1 11 1555 1 1 3 DPR HB3 H 40.156 36.345 11.560 1.00 . A A . 3 DPR HB3 1 1 11 1556 1 1 3 DPR HD2 H 37.102 38.141 10.186 1.00 . A A . 3 DPR HD2 1 1 11 1557 1 1 3 DPR HD3 H 38.244 38.247 11.475 1.00 . A A . 3 DPR HD3 1 1 11 1558 1 1 3 DPR HG2 H 38.671 36.503 8.964 1.00 . A A . 3 DPR HG2 1 1 11 1559 1 1 3 DPR HG3 H 39.773 37.648 9.668 1.00 . A A . 3 DPR HG3 1 1 11 1560 1 1 3 DPR N N 37.229 36.399 11.470 1.00 . A A . 3 DPR N 1 1 11 1561 1 1 3 DPR O O 37.040 34.113 9.931 1.00 . A A . 3 DPR O 1 1 11 1562 1 1 4 . C C 38.204 30.353 11.523 1.00 . A A . 4 DCY C 1 1 11 1563 1 1 4 . CA C 37.414 31.629 11.236 1.00 . A A . 4 DCY CA 1 1 11 1564 1 1 4 . CB C 36.158 31.615 12.116 1.00 . A A . 4 DCY CB 1 1 11 1565 1 1 4 . H H 38.823 32.854 12.165 1.00 . A A . 4 DCY H 1 1 11 1566 1 1 4 . HA H 37.006 31.537 10.224 1.00 . A A . 4 DCY HA 1 1 11 1567 1 1 4 . HB2 H 35.679 32.587 12.215 1.00 . A A . 4 DCY HB2 1 1 11 1568 1 1 4 . HB3 H 36.455 31.244 13.089 1.00 . A A . 4 DCY HB3 1 1 11 1569 1 1 4 . N N 38.158 32.853 11.410 1.00 . A A . 4 DCY N 1 1 11 1570 1 1 4 . O O 39.337 30.436 11.978 1.00 . A A . 4 DCY O 1 1 11 1571 1 1 4 . SG S 34.804 30.548 11.565 1.00 . A A . 4 DCY SG 1 1 11 1572 1 1 5 . C C 38.372 27.675 12.961 1.00 . A A . 5 DLY C 1 1 11 1573 1 1 5 . CA C 38.028 27.836 11.483 1.00 . A A . 5 DLY CA 1 1 11 1574 1 1 5 . CB C 37.063 26.827 10.872 1.00 . A A . 5 DLY CB 1 1 11 1575 1 1 5 . CD C 36.269 24.583 10.687 1.00 . A A . 5 DLY CD 1 1 11 1576 1 1 5 . CE C 36.550 23.078 10.669 1.00 . A A . 5 DLY CE 1 1 11 1577 1 1 5 . CG C 37.499 25.377 11.099 1.00 . A A . 5 DLY CG 1 1 11 1578 1 1 5 . H H 36.807 29.240 10.603 1.00 . A A . 5 DLY H 1 1 11 1579 1 1 5 . HA H 38.951 27.599 10.956 1.00 . A A . 5 DLY HA 1 1 11 1580 1 1 5 . HB2 H 37.028 26.944 9.785 1.00 . A A . 5 DLY HB2 1 1 11 1581 1 1 5 . HB3 H 36.080 26.907 11.322 1.00 . A A . 5 DLY HB3 1 1 11 1582 1 1 5 . HD2 H 36.040 24.956 9.686 1.00 . A A . 5 DLY HD2 1 1 11 1583 1 1 5 . HD3 H 35.484 24.791 11.417 1.00 . A A . 5 DLY HD3 1 1 11 1584 1 1 5 . HE2 H 36.860 22.887 11.694 1.00 . A A . 5 DLY HE2 1 1 11 1585 1 1 5 . HE3 H 37.424 22.902 10.044 1.00 . A A . 5 DLY HE3 1 1 11 1586 1 1 5 . HG2 H 37.723 25.076 12.123 1.00 . A A . 5 DLY HG2 1 1 11 1587 1 1 5 . HG3 H 38.378 25.195 10.493 1.00 . A A . 5 DLY HG3 1 1 11 1588 1 1 5 . HZ1 H 35.627 21.327 10.216 1.00 . A A . 5 DLY HZ1 1 1 11 1589 1 1 5 . HZ2 H 35.275 22.497 9.191 1.00 . A A . 5 DLY HZ2 1 1 11 1590 1 1 5 . HZ3 H 34.571 22.445 10.747 1.00 . A A . 5 DLY HZ3 1 1 11 1591 1 1 5 . N N 37.629 29.203 11.177 1.00 . A A . 5 DLY N 1 1 11 1592 1 1 5 . NZ N 35.388 22.308 10.181 1.00 . A A . 5 DLY NZ 1 1 11 1593 1 1 5 . O O 37.393 27.768 13.695 1.00 . A A . 5 DLY O 1 1 11 1594 1 1 6 ASP C C 39.805 28.701 15.677 1.00 . A A . 6 ASP C 1 1 11 1595 1 1 6 ASP CA C 39.884 27.434 14.846 1.00 . A A . 6 ASP CA 1 1 11 1596 1 1 6 ASP CB C 41.297 26.881 15.077 1.00 . A A . 6 ASP CB 1 1 11 1597 1 1 6 ASP CG C 42.457 27.516 14.337 1.00 . A A . 6 ASP CG 1 1 11 1598 1 1 6 ASP H H 40.341 27.477 12.737 1.00 . A A . 6 ASP H 1 1 11 1599 1 1 6 ASP HA H 39.176 26.727 15.274 1.00 . A A . 6 ASP HA 1 1 11 1600 1 1 6 ASP HB2 H 41.518 26.864 16.146 1.00 . A A . 6 ASP HB2 1 1 11 1601 1 1 6 ASP HB3 H 41.325 25.821 14.819 1.00 . A A . 6 ASP HB3 1 1 11 1602 1 1 6 ASP N N 39.621 27.574 13.427 1.00 . A A . 6 ASP N 1 1 11 1603 1 1 6 ASP O O 39.677 28.613 16.901 1.00 . A A . 6 ASP O 1 1 11 1604 1 1 6 ASP OD1 O 42.476 28.753 14.142 1.00 . A A . 6 ASP OD1 1 1 11 1605 1 1 6 ASP OD2 O 43.541 26.941 14.107 1.00 . A A . 6 ASP OD2 1 1 11 1606 1 1 7 SER C C 39.170 32.151 15.049 1.00 . A A . 7 SER C 1 1 11 1607 1 1 7 SER CA C 40.199 31.145 15.552 1.00 . A A . 7 SER CA 1 1 11 1608 1 1 7 SER CB C 41.637 31.634 15.483 1.00 . A A . 7 SER CB 1 1 11 1609 1 1 7 SER H H 39.908 29.822 13.980 1.00 . A A . 7 SER H 1 1 11 1610 1 1 7 SER HA H 40.030 31.211 16.629 1.00 . A A . 7 SER HA 1 1 11 1611 1 1 7 SER HB2 H 41.862 31.906 14.452 1.00 . A A . 7 SER HB2 1 1 11 1612 1 1 7 SER HB3 H 41.800 32.529 16.083 1.00 . A A . 7 SER HB3 1 1 11 1613 1 1 7 SER HG H 42.246 29.882 15.314 1.00 . A A . 7 SER HG 1 1 11 1614 1 1 7 SER N N 39.893 29.847 14.994 1.00 . A A . 7 SER N 1 1 11 1615 1 1 7 SER O O 39.326 32.824 14.031 1.00 . A A . 7 SER O 1 1 11 1616 1 1 7 SER OG O 42.429 30.567 15.952 1.00 . A A . 7 SER OG 1 1 11 1617 1 1 8 . C C 35.561 32.627 15.685 1.00 . A A . 8 DTY C 1 1 11 1618 1 1 8 . CA C 36.933 33.244 15.478 1.00 . A A . 8 DTY CA 1 1 11 1619 1 1 8 . CB C 37.240 34.483 16.308 1.00 . A A . 8 DTY CB 1 1 11 1620 1 1 8 . CD1 C 38.441 36.346 15.031 1.00 . A A . 8 DTY CD1 1 1 11 1621 1 1 8 . CD2 C 39.715 34.865 16.380 1.00 . A A . 8 DTY CD2 1 1 11 1622 1 1 8 . CE1 C 39.574 37.048 14.632 1.00 . A A . 8 DTY CE1 1 1 11 1623 1 1 8 . CE2 C 40.916 35.467 15.976 1.00 . A A . 8 DTY CE2 1 1 11 1624 1 1 8 . CG C 38.478 35.180 15.805 1.00 . A A . 8 DTY CG 1 1 11 1625 1 1 8 . CZ C 40.808 36.629 15.187 1.00 . A A . 8 DTY CZ 1 1 11 1626 1 1 8 . H H 37.951 31.858 16.610 1.00 . A A . 8 DTY H 1 1 11 1627 1 1 8 . HA H 37.008 33.603 14.448 1.00 . A A . 8 DTY HA 1 1 11 1628 1 1 8 . HB2 H 37.272 34.170 17.357 1.00 . A A . 8 DTY HB2 1 1 11 1629 1 1 8 . HB3 H 36.417 35.199 16.256 1.00 . A A . 8 DTY HB3 1 1 11 1630 1 1 8 . HD1 H 37.435 36.505 14.650 1.00 . A A . 8 DTY HD1 1 1 11 1631 1 1 8 . HD2 H 39.791 34.011 17.046 1.00 . A A . 8 DTY HD2 1 1 11 1632 1 1 8 . HE1 H 39.558 37.892 13.958 1.00 . A A . 8 DTY HE1 1 1 11 1633 1 1 8 . HE2 H 41.799 35.121 16.471 1.00 . A A . 8 DTY HE2 1 1 11 1634 1 1 8 . HH H 42.760 37.083 15.082 1.00 . A A . 8 DTY HH 1 1 11 1635 1 1 8 . N N 38.031 32.335 15.723 1.00 . A A . 8 DTY N 1 1 11 1636 1 1 8 . O O 35.384 31.822 16.593 1.00 . A A . 8 DTY O 1 1 11 1637 1 1 8 . OH O 41.891 37.343 14.761 1.00 . A A . 8 DTY OH 1 1 11 1638 1 1 9 . C C 32.273 33.543 15.209 1.00 . A A . 9 DCY C 1 1 11 1639 1 1 9 . CA C 33.253 32.402 15.015 1.00 . A A . 9 DCY CA 1 1 11 1640 1 1 9 . CB C 32.997 31.674 13.693 1.00 . A A . 9 DCY CB 1 1 11 1641 1 1 9 . H H 34.665 33.671 14.136 1.00 . A A . 9 DCY H 1 1 11 1642 1 1 9 . HA H 33.167 31.647 15.796 1.00 . A A . 9 DCY HA 1 1 11 1643 1 1 9 . HB2 H 33.093 32.336 12.826 1.00 . A A . 9 DCY HB2 1 1 11 1644 1 1 9 . HB3 H 31.995 31.261 13.695 1.00 . A A . 9 DCY HB3 1 1 11 1645 1 1 9 . N N 34.550 33.044 14.921 1.00 . A A . 9 DCY N 1 1 11 1646 1 1 9 . O O 31.706 33.993 14.212 1.00 . A A . 9 DCY O 1 1 11 1647 1 1 9 . SG S 33.977 30.185 13.402 1.00 . A A . 9 DCY SG 1 1 11 1648 1 1 10 PRO C C 31.400 36.301 15.917 1.00 . A A . 10 PRO C 1 1 11 1649 1 1 10 PRO CA C 31.166 35.070 16.784 1.00 . A A . 10 PRO CA 1 1 11 1650 1 1 10 PRO CB C 31.364 35.407 18.259 1.00 . A A . 10 PRO CB 1 1 11 1651 1 1 10 PRO CD C 32.619 33.411 17.655 1.00 . A A . 10 PRO CD 1 1 11 1652 1 1 10 PRO CG C 31.891 34.083 18.804 1.00 . A A . 10 PRO CG 1 1 11 1653 1 1 10 PRO HA H 30.113 34.809 16.673 1.00 . A A . 10 PRO HA 1 1 11 1654 1 1 10 PRO HB2 H 32.093 36.211 18.351 1.00 . A A . 10 PRO HB2 1 1 11 1655 1 1 10 PRO HB3 H 30.452 35.626 18.799 1.00 . A A . 10 PRO HB3 1 1 11 1656 1 1 10 PRO HD2 H 33.676 33.685 17.704 1.00 . A A . 10 PRO HD2 1 1 11 1657 1 1 10 PRO HD3 H 32.435 32.336 17.619 1.00 . A A . 10 PRO HD3 1 1 11 1658 1 1 10 PRO HG2 H 32.573 34.176 19.659 1.00 . A A . 10 PRO HG2 1 1 11 1659 1 1 10 PRO HG3 H 31.046 33.456 19.088 1.00 . A A . 10 PRO HG3 1 1 11 1660 1 1 10 PRO N N 32.113 34.027 16.445 1.00 . A A . 10 PRO N 1 1 11 1661 1 1 10 PRO O O 32.511 36.639 15.530 1.00 . A A . 10 PRO O 1 1 11 1662 1 1 11 . C C 30.674 37.928 13.243 1.00 . A A . 11 DSN C 1 1 11 1663 1 1 11 . CA C 30.310 38.155 14.700 1.00 . A A . 11 DSN CA 1 1 11 1664 1 1 11 . CB C 28.957 38.851 14.811 1.00 . A A . 11 DSN CB 1 1 11 1665 1 1 11 . H H 29.404 36.653 15.872 1.00 . A A . 11 DSN H 1 1 11 1666 1 1 11 . HA H 31.137 38.751 15.090 1.00 . A A . 11 DSN HA 1 1 11 1667 1 1 11 . HB2 H 28.249 38.359 14.142 1.00 . A A . 11 DSN HB2 1 1 11 1668 1 1 11 . HB3 H 29.038 39.816 14.322 1.00 . A A . 11 DSN HB3 1 1 11 1669 1 1 11 . HG H 27.486 39.030 15.956 1.00 . A A . 11 DSN HG 1 1 11 1670 1 1 11 . N N 30.303 36.960 15.530 1.00 . A A . 11 DSN N 1 1 11 1671 1 1 11 . O O 30.566 38.864 12.449 1.00 . A A . 11 DSN O 1 1 11 1672 1 1 11 . OG O 28.434 38.984 16.107 1.00 . A A . 11 DSN OG 1 1 12 1673 1 1 1 DAL C C 32.747 37.047 11.204 1.00 . A A . 1 DAL C 1 1 12 1674 1 1 1 DAL CA C 31.257 36.859 11.421 1.00 . A A . 1 DAL CA 1 1 12 1675 1 1 1 DAL CB C 30.739 35.427 11.265 1.00 . A A . 1 DAL CB 1 1 12 1676 1 1 1 DAL H1 H 30.437 36.548 13.353 1.00 . A A . 1 DAL H1 1 1 12 1677 1 1 1 DAL HA H 30.870 37.545 10.673 1.00 . A A . 1 DAL HA 1 1 12 1678 1 1 1 DAL HB1 H 31.119 35.129 10.290 1.00 . A A . 1 DAL HB1 1 1 12 1679 1 1 1 DAL HB2 H 29.649 35.387 11.280 1.00 . A A . 1 DAL HB2 1 1 12 1680 1 1 1 DAL HB3 H 31.046 34.804 12.102 1.00 . A A . 1 DAL HB3 1 1 12 1681 1 1 1 DAL N N 30.780 37.266 12.725 1.00 . A A . 1 DAL N 1 1 12 1682 1 1 1 DAL O O 33.271 37.299 10.122 1.00 . A A . 1 DAL O 1 1 12 1683 1 1 2 GLN C C 35.709 35.969 12.360 1.00 . A A . 2 GLN C 1 1 12 1684 1 1 2 GLN CA C 34.898 37.251 12.297 1.00 . A A . 2 GLN CA 1 1 12 1685 1 1 2 GLN CB C 35.320 38.158 13.463 1.00 . A A . 2 GLN CB 1 1 12 1686 1 1 2 GLN CD C 35.433 40.430 14.489 1.00 . A A . 2 GLN CD 1 1 12 1687 1 1 2 GLN CG C 35.206 39.651 13.210 1.00 . A A . 2 GLN CG 1 1 12 1688 1 1 2 GLN H H 33.101 36.874 13.253 1.00 . A A . 2 GLN H 1 1 12 1689 1 1 2 GLN HA H 35.140 37.786 11.379 1.00 . A A . 2 GLN HA 1 1 12 1690 1 1 2 GLN HB2 H 34.651 37.871 14.282 1.00 . A A . 2 GLN HB2 1 1 12 1691 1 1 2 GLN HB3 H 36.362 37.985 13.716 1.00 . A A . 2 GLN HB3 1 1 12 1692 1 1 2 GLN HE21 H 35.812 42.094 13.394 1.00 . A A . 2 GLN HE21 1 1 12 1693 1 1 2 GLN HE22 H 36.272 42.290 15.018 1.00 . A A . 2 GLN HE22 1 1 12 1694 1 1 2 GLN HG2 H 36.017 40.027 12.578 1.00 . A A . 2 GLN HG2 1 1 12 1695 1 1 2 GLN HG3 H 34.281 39.997 12.737 1.00 . A A . 2 GLN HG3 1 1 12 1696 1 1 2 GLN N N 33.476 36.982 12.322 1.00 . A A . 2 GLN N 1 1 12 1697 1 1 2 GLN NE2 N 35.855 41.690 14.313 1.00 . A A . 2 GLN NE2 1 1 12 1698 1 1 2 GLN O O 35.451 35.097 13.199 1.00 . A A . 2 GLN O 1 1 12 1699 1 1 2 GLN OE1 O 35.428 39.917 15.608 1.00 . A A . 2 GLN OE1 1 1 12 1700 1 1 3 DPR C C 37.020 33.350 11.207 1.00 . A A . 3 DPR C 1 1 12 1701 1 1 3 DPR CA C 37.659 34.678 11.553 1.00 . A A . 3 DPR CA 1 1 12 1702 1 1 3 DPR CB C 38.839 35.045 10.658 1.00 . A A . 3 DPR CB 1 1 12 1703 1 1 3 DPR CD C 37.355 36.840 10.711 1.00 . A A . 3 DPR CD 1 1 12 1704 1 1 3 DPR CG C 38.842 36.567 10.559 1.00 . A A . 3 DPR CG 1 1 12 1705 1 1 3 DPR HA H 38.036 34.641 12.581 1.00 . A A . 3 DPR HA 1 1 12 1706 1 1 3 DPR HB2 H 38.675 34.612 9.665 1.00 . A A . 3 DPR HB2 1 1 12 1707 1 1 3 DPR HB3 H 39.810 34.651 10.946 1.00 . A A . 3 DPR HB3 1 1 12 1708 1 1 3 DPR HD2 H 36.796 36.828 9.775 1.00 . A A . 3 DPR HD2 1 1 12 1709 1 1 3 DPR HD3 H 37.240 37.872 11.047 1.00 . A A . 3 DPR HD3 1 1 12 1710 1 1 3 DPR HG2 H 39.164 36.930 9.588 1.00 . A A . 3 DPR HG2 1 1 12 1711 1 1 3 DPR HG3 H 39.448 37.138 11.270 1.00 . A A . 3 DPR HG3 1 1 12 1712 1 1 3 DPR N N 36.781 35.837 11.574 1.00 . A A . 3 DPR N 1 1 12 1713 1 1 3 DPR O O 36.225 33.309 10.266 1.00 . A A . 3 DPR O 1 1 12 1714 1 1 4 . C C 38.216 29.998 11.690 1.00 . A A . 4 DCY C 1 1 12 1715 1 1 4 . CA C 37.006 30.915 11.614 1.00 . A A . 4 DCY CA 1 1 12 1716 1 1 4 . CB C 35.855 30.508 12.539 1.00 . A A . 4 DCY CB 1 1 12 1717 1 1 4 . H H 38.165 32.332 12.575 1.00 . A A . 4 DCY H 1 1 12 1718 1 1 4 . HA H 36.777 30.767 10.567 1.00 . A A . 4 DCY HA 1 1 12 1719 1 1 4 . HB2 H 35.956 30.976 13.520 1.00 . A A . 4 DCY HB2 1 1 12 1720 1 1 4 . HB3 H 35.837 29.427 12.654 1.00 . A A . 4 DCY HB3 1 1 12 1721 1 1 4 . N N 37.417 32.275 11.900 1.00 . A A . 4 DCY N 1 1 12 1722 1 1 4 . O O 39.138 30.289 12.448 1.00 . A A . 4 DCY O 1 1 12 1723 1 1 4 . SG S 34.304 31.114 11.824 1.00 . A A . 4 DCY SG 1 1 12 1724 1 1 5 . C C 39.632 27.508 12.279 1.00 . A A . 5 DLY C 1 1 12 1725 1 1 5 . CA C 39.513 28.095 10.871 1.00 . A A . 5 DLY CA 1 1 12 1726 1 1 5 . CB C 39.324 27.025 9.790 1.00 . A A . 5 DLY CB 1 1 12 1727 1 1 5 . CD C 40.520 25.105 8.741 1.00 . A A . 5 DLY CD 1 1 12 1728 1 1 5 . CE C 41.770 24.230 8.618 1.00 . A A . 5 DLY CE 1 1 12 1729 1 1 5 . CG C 40.675 26.330 9.640 1.00 . A A . 5 DLY CG 1 1 12 1730 1 1 5 . H H 37.534 28.609 10.378 1.00 . A A . 5 DLY H 1 1 12 1731 1 1 5 . HA H 40.210 28.862 10.554 1.00 . A A . 5 DLY HA 1 1 12 1732 1 1 5 . HB2 H 39.039 27.490 8.853 1.00 . A A . 5 DLY HB2 1 1 12 1733 1 1 5 . HB3 H 38.573 26.285 10.063 1.00 . A A . 5 DLY HB3 1 1 12 1734 1 1 5 . HD2 H 40.239 25.380 7.723 1.00 . A A . 5 DLY HD2 1 1 12 1735 1 1 5 . HD3 H 39.723 24.424 9.033 1.00 . A A . 5 DLY HD3 1 1 12 1736 1 1 5 . HE2 H 41.636 23.445 7.880 1.00 . A A . 5 DLY HE2 1 1 12 1737 1 1 5 . HE3 H 41.980 23.801 9.601 1.00 . A A . 5 DLY HE3 1 1 12 1738 1 1 5 . HG2 H 41.109 25.997 10.592 1.00 . A A . 5 DLY HG2 1 1 12 1739 1 1 5 . HG3 H 41.378 27.021 9.192 1.00 . A A . 5 DLY HG3 1 1 12 1740 1 1 5 . HZ1 H 42.719 25.695 7.489 1.00 . A A . 5 DLY HZ1 1 1 12 1741 1 1 5 . HZ2 H 43.759 24.528 8.060 1.00 . A A . 5 DLY HZ2 1 1 12 1742 1 1 5 . HZ3 H 43.234 25.626 9.032 1.00 . A A . 5 DLY HZ3 1 1 12 1743 1 1 5 . N N 38.321 28.906 10.930 1.00 . A A . 5 DLY N 1 1 12 1744 1 1 5 . NZ N 42.922 25.061 8.252 1.00 . A A . 5 DLY NZ 1 1 12 1745 1 1 5 . O O 38.741 26.765 12.684 1.00 . A A . 5 DLY O 1 1 12 1746 1 1 6 ASP C C 40.571 28.431 15.535 1.00 . A A . 6 ASP C 1 1 12 1747 1 1 6 ASP CA C 40.768 27.403 14.435 1.00 . A A . 6 ASP CA 1 1 12 1748 1 1 6 ASP CB C 41.973 26.487 14.636 1.00 . A A . 6 ASP CB 1 1 12 1749 1 1 6 ASP CG C 43.295 27.137 14.246 1.00 . A A . 6 ASP CG 1 1 12 1750 1 1 6 ASP H H 41.457 28.371 12.735 1.00 . A A . 6 ASP H 1 1 12 1751 1 1 6 ASP HA H 39.882 26.798 14.605 1.00 . A A . 6 ASP HA 1 1 12 1752 1 1 6 ASP HB2 H 42.019 26.030 15.629 1.00 . A A . 6 ASP HB2 1 1 12 1753 1 1 6 ASP HB3 H 41.871 25.606 14.014 1.00 . A A . 6 ASP HB3 1 1 12 1754 1 1 6 ASP N N 40.661 27.849 13.056 1.00 . A A . 6 ASP N 1 1 12 1755 1 1 6 ASP O O 40.851 28.171 16.705 1.00 . A A . 6 ASP O 1 1 12 1756 1 1 6 ASP OD1 O 44.310 26.410 14.264 1.00 . A A . 6 ASP OD1 1 1 12 1757 1 1 6 ASP OD2 O 43.362 28.319 13.855 1.00 . A A . 6 ASP OD2 1 1 12 1758 1 1 7 SER C C 38.788 31.722 15.331 1.00 . A A . 7 SER C 1 1 12 1759 1 1 7 SER CA C 39.694 30.726 16.029 1.00 . A A . 7 SER CA 1 1 12 1760 1 1 7 SER CB C 40.921 31.429 16.625 1.00 . A A . 7 SER CB 1 1 12 1761 1 1 7 SER H H 39.647 29.586 14.252 1.00 . A A . 7 SER H 1 1 12 1762 1 1 7 SER HA H 39.219 30.361 16.938 1.00 . A A . 7 SER HA 1 1 12 1763 1 1 7 SER HB2 H 41.672 31.645 15.868 1.00 . A A . 7 SER HB2 1 1 12 1764 1 1 7 SER HB3 H 40.657 32.354 17.114 1.00 . A A . 7 SER HB3 1 1 12 1765 1 1 7 SER HG H 41.462 29.689 17.226 1.00 . A A . 7 SER HG 1 1 12 1766 1 1 7 SER N N 40.043 29.606 15.179 1.00 . A A . 7 SER N 1 1 12 1767 1 1 7 SER O O 39.207 32.284 14.322 1.00 . A A . 7 SER O 1 1 12 1768 1 1 7 SER OG O 41.502 30.573 17.591 1.00 . A A . 7 SER OG 1 1 12 1769 1 1 8 . C C 35.260 32.511 15.588 1.00 . A A . 8 DTY C 1 1 12 1770 1 1 8 . CA C 36.679 33.016 15.413 1.00 . A A . 8 DTY CA 1 1 12 1771 1 1 8 . CB C 36.943 34.378 16.044 1.00 . A A . 8 DTY CB 1 1 12 1772 1 1 8 . CD1 C 38.420 36.029 14.907 1.00 . A A . 8 DTY CD1 1 1 12 1773 1 1 8 . CD2 C 39.348 34.698 16.740 1.00 . A A . 8 DTY CD2 1 1 12 1774 1 1 8 . CE1 C 39.631 36.721 14.723 1.00 . A A . 8 DTY CE1 1 1 12 1775 1 1 8 . CE2 C 40.530 35.448 16.665 1.00 . A A . 8 DTY CE2 1 1 12 1776 1 1 8 . CG C 38.293 35.047 15.892 1.00 . A A . 8 DTY CG 1 1 12 1777 1 1 8 . CZ C 40.599 36.488 15.711 1.00 . A A . 8 DTY CZ 1 1 12 1778 1 1 8 . H H 37.324 31.440 16.668 1.00 . A A . 8 DTY H 1 1 12 1779 1 1 8 . HA H 36.889 33.184 14.354 1.00 . A A . 8 DTY HA 1 1 12 1780 1 1 8 . HB2 H 36.676 34.417 17.102 1.00 . A A . 8 DTY HB2 1 1 12 1781 1 1 8 . HB3 H 36.189 35.012 15.581 1.00 . A A . 8 DTY HB3 1 1 12 1782 1 1 8 . HD1 H 37.605 36.296 14.247 1.00 . A A . 8 DTY HD1 1 1 12 1783 1 1 8 . HD2 H 39.230 33.903 17.453 1.00 . A A . 8 DTY HD2 1 1 12 1784 1 1 8 . HE1 H 39.626 37.608 14.110 1.00 . A A . 8 DTY HE1 1 1 12 1785 1 1 8 . HE2 H 41.295 35.314 17.429 1.00 . A A . 8 DTY HE2 1 1 12 1786 1 1 8 . HH H 42.303 37.173 16.458 1.00 . A A . 8 DTY HH 1 1 12 1787 1 1 8 . N N 37.643 32.053 15.928 1.00 . A A . 8 DTY N 1 1 12 1788 1 1 8 . O O 34.947 31.576 16.329 1.00 . A A . 8 DTY O 1 1 12 1789 1 1 8 . OH O 41.693 37.308 15.734 1.00 . A A . 8 DTY OH 1 1 12 1790 1 1 9 . C C 31.986 33.996 15.489 1.00 . A A . 9 DCY C 1 1 12 1791 1 1 9 . CA C 32.840 32.810 15.075 1.00 . A A . 9 DCY CA 1 1 12 1792 1 1 9 . CB C 32.327 32.051 13.851 1.00 . A A . 9 DCY CB 1 1 12 1793 1 1 9 . H H 34.468 33.843 14.286 1.00 . A A . 9 DCY H 1 1 12 1794 1 1 9 . HA H 32.742 32.059 15.854 1.00 . A A . 9 DCY HA 1 1 12 1795 1 1 9 . HB2 H 32.372 32.750 13.015 1.00 . A A . 9 DCY HB2 1 1 12 1796 1 1 9 . HB3 H 31.274 31.863 14.021 1.00 . A A . 9 DCY HB3 1 1 12 1797 1 1 9 . N N 34.256 33.119 14.949 1.00 . A A . 9 DCY N 1 1 12 1798 1 1 9 . O O 31.141 34.444 14.713 1.00 . A A . 9 DCY O 1 1 12 1799 1 1 9 . SG S 32.930 30.479 13.192 1.00 . A A . 9 DCY SG 1 1 12 1800 1 1 10 PRO C C 31.612 36.919 15.968 1.00 . A A . 10 PRO C 1 1 12 1801 1 1 10 PRO CA C 31.399 35.818 16.992 1.00 . A A . 10 PRO CA 1 1 12 1802 1 1 10 PRO CB C 31.947 36.189 18.364 1.00 . A A . 10 PRO CB 1 1 12 1803 1 1 10 PRO CD C 32.906 34.147 17.794 1.00 . A A . 10 PRO CD 1 1 12 1804 1 1 10 PRO CG C 32.363 34.875 19.024 1.00 . A A . 10 PRO CG 1 1 12 1805 1 1 10 PRO HA H 30.317 35.650 16.995 1.00 . A A . 10 PRO HA 1 1 12 1806 1 1 10 PRO HB2 H 32.757 36.905 18.268 1.00 . A A . 10 PRO HB2 1 1 12 1807 1 1 10 PRO HB3 H 31.089 36.583 18.930 1.00 . A A . 10 PRO HB3 1 1 12 1808 1 1 10 PRO HD2 H 33.963 34.390 17.639 1.00 . A A . 10 PRO HD2 1 1 12 1809 1 1 10 PRO HD3 H 32.787 33.081 17.945 1.00 . A A . 10 PRO HD3 1 1 12 1810 1 1 10 PRO HG2 H 33.050 35.070 19.847 1.00 . A A . 10 PRO HG2 1 1 12 1811 1 1 10 PRO HG3 H 31.425 34.448 19.378 1.00 . A A . 10 PRO HG3 1 1 12 1812 1 1 10 PRO N N 32.115 34.594 16.670 1.00 . A A . 10 PRO N 1 1 12 1813 1 1 10 PRO O O 32.781 37.221 15.747 1.00 . A A . 10 PRO O 1 1 12 1814 1 1 11 . C C 30.818 38.504 13.231 1.00 . A A . 11 DSN C 1 1 12 1815 1 1 11 . CA C 30.456 38.709 14.700 1.00 . A A . 11 DSN CA 1 1 12 1816 1 1 11 . CB C 29.101 39.361 14.919 1.00 . A A . 11 DSN CB 1 1 12 1817 1 1 11 . H H 29.704 37.191 16.006 1.00 . A A . 11 DSN H 1 1 12 1818 1 1 11 . HA H 31.153 39.426 15.151 1.00 . A A . 11 DSN HA 1 1 12 1819 1 1 11 . HB2 H 28.303 38.734 14.510 1.00 . A A . 11 DSN HB2 1 1 12 1820 1 1 11 . HB3 H 29.067 40.356 14.480 1.00 . A A . 11 DSN HB3 1 1 12 1821 1 1 11 . HG H 28.534 40.460 16.454 1.00 . A A . 11 DSN HG 1 1 12 1822 1 1 11 . N N 30.508 37.480 15.467 1.00 . A A . 11 DSN N 1 1 12 1823 1 1 11 . O O 31.108 39.524 12.607 1.00 . A A . 11 DSN O 1 1 12 1824 1 1 11 . OG O 28.923 39.582 16.302 1.00 . A A . 11 DSN OG 1 1 13 1825 1 1 1 DAL C C 32.597 37.075 11.449 1.00 . A A . 1 DAL C 1 1 13 1826 1 1 1 DAL CA C 31.133 37.405 11.715 1.00 . A A . 1 DAL CA 1 1 13 1827 1 1 1 DAL CB C 30.133 36.341 11.264 1.00 . A A . 1 DAL CB 1 1 13 1828 1 1 1 DAL H1 H 30.662 36.599 13.667 1.00 . A A . 1 DAL H1 1 1 13 1829 1 1 1 DAL HA H 30.844 38.303 11.174 1.00 . A A . 1 DAL HA 1 1 13 1830 1 1 1 DAL HB1 H 30.142 36.274 10.172 1.00 . A A . 1 DAL HB1 1 1 13 1831 1 1 1 DAL HB2 H 29.103 36.589 11.518 1.00 . A A . 1 DAL HB2 1 1 13 1832 1 1 1 DAL HB3 H 30.424 35.467 11.858 1.00 . A A . 1 DAL HB3 1 1 13 1833 1 1 1 DAL N N 30.861 37.436 13.139 1.00 . A A . 1 DAL N 1 1 13 1834 1 1 1 DAL O O 32.959 36.694 10.342 1.00 . A A . 1 DAL O 1 1 13 1835 1 1 2 GLN C C 35.641 36.135 12.006 1.00 . A A . 2 GLN C 1 1 13 1836 1 1 2 GLN CA C 34.944 37.480 12.115 1.00 . A A . 2 GLN CA 1 1 13 1837 1 1 2 GLN CB C 35.500 38.355 13.239 1.00 . A A . 2 GLN CB 1 1 13 1838 1 1 2 GLN CD C 35.446 40.650 14.143 1.00 . A A . 2 GLN CD 1 1 13 1839 1 1 2 GLN CG C 35.050 39.793 12.947 1.00 . A A . 2 GLN CG 1 1 13 1840 1 1 2 GLN H H 33.125 37.425 13.298 1.00 . A A . 2 GLN H 1 1 13 1841 1 1 2 GLN HA H 35.046 37.955 11.139 1.00 . A A . 2 GLN HA 1 1 13 1842 1 1 2 GLN HB2 H 35.148 38.130 14.247 1.00 . A A . 2 GLN HB2 1 1 13 1843 1 1 2 GLN HB3 H 36.587 38.332 13.260 1.00 . A A . 2 GLN HB3 1 1 13 1844 1 1 2 GLN HE21 H 37.393 41.062 13.585 1.00 . A A . 2 GLN HE21 1 1 13 1845 1 1 2 GLN HE22 H 36.724 41.884 15.000 1.00 . A A . 2 GLN HE22 1 1 13 1846 1 1 2 GLN HG2 H 35.447 40.222 12.038 1.00 . A A . 2 GLN HG2 1 1 13 1847 1 1 2 GLN HG3 H 33.967 39.690 12.842 1.00 . A A . 2 GLN HG3 1 1 13 1848 1 1 2 GLN N N 33.522 37.340 12.370 1.00 . A A . 2 GLN N 1 1 13 1849 1 1 2 GLN NE2 N 36.660 41.178 14.281 1.00 . A A . 2 GLN NE2 1 1 13 1850 1 1 2 GLN O O 35.218 35.244 12.740 1.00 . A A . 2 GLN O 1 1 13 1851 1 1 2 GLN OE1 O 34.592 40.868 14.995 1.00 . A A . 2 GLN OE1 1 1 13 1852 1 1 3 DPR C C 37.161 33.618 10.889 1.00 . A A . 3 DPR C 1 1 13 1853 1 1 3 DPR CA C 37.669 34.941 11.442 1.00 . A A . 3 DPR CA 1 1 13 1854 1 1 3 DPR CB C 38.936 35.326 10.675 1.00 . A A . 3 DPR CB 1 1 13 1855 1 1 3 DPR CD C 37.285 37.009 10.337 1.00 . A A . 3 DPR CD 1 1 13 1856 1 1 3 DPR CG C 38.416 36.285 9.608 1.00 . A A . 3 DPR CG 1 1 13 1857 1 1 3 DPR HA H 37.930 34.775 12.489 1.00 . A A . 3 DPR HA 1 1 13 1858 1 1 3 DPR HB2 H 39.451 34.459 10.267 1.00 . A A . 3 DPR HB2 1 1 13 1859 1 1 3 DPR HB3 H 39.502 35.877 11.425 1.00 . A A . 3 DPR HB3 1 1 13 1860 1 1 3 DPR HD2 H 36.508 37.362 9.656 1.00 . A A . 3 DPR HD2 1 1 13 1861 1 1 3 DPR HD3 H 37.742 37.777 10.956 1.00 . A A . 3 DPR HD3 1 1 13 1862 1 1 3 DPR HG2 H 37.988 35.817 8.727 1.00 . A A . 3 DPR HG2 1 1 13 1863 1 1 3 DPR HG3 H 39.199 36.946 9.232 1.00 . A A . 3 DPR HG3 1 1 13 1864 1 1 3 DPR N N 36.719 36.016 11.226 1.00 . A A . 3 DPR N 1 1 13 1865 1 1 3 DPR O O 36.364 33.521 9.955 1.00 . A A . 3 DPR O 1 1 13 1866 1 1 4 . C C 38.407 30.152 11.496 1.00 . A A . 4 DCY C 1 1 13 1867 1 1 4 . CA C 37.370 31.189 11.085 1.00 . A A . 4 DCY CA 1 1 13 1868 1 1 4 . CB C 36.025 30.853 11.730 1.00 . A A . 4 DCY CB 1 1 13 1869 1 1 4 . H H 38.267 32.663 12.304 1.00 . A A . 4 DCY H 1 1 13 1870 1 1 4 . HA H 37.185 31.193 10.018 1.00 . A A . 4 DCY HA 1 1 13 1871 1 1 4 . HB2 H 35.950 31.367 12.684 1.00 . A A . 4 DCY HB2 1 1 13 1872 1 1 4 . HB3 H 36.022 29.801 12.029 1.00 . A A . 4 DCY HB3 1 1 13 1873 1 1 4 . N N 37.612 32.545 11.537 1.00 . A A . 4 DCY N 1 1 13 1874 1 1 4 . O O 39.375 30.515 12.162 1.00 . A A . 4 DCY O 1 1 13 1875 1 1 4 . SG S 34.511 31.142 10.784 1.00 . A A . 4 DCY SG 1 1 13 1876 1 1 5 . C C 38.911 27.540 13.146 1.00 . A A . 5 DLY C 1 1 13 1877 1 1 5 . CA C 39.080 27.821 11.656 1.00 . A A . 5 DLY CA 1 1 13 1878 1 1 5 . CB C 38.841 26.617 10.754 1.00 . A A . 5 DLY CB 1 1 13 1879 1 1 5 . CD C 39.632 24.221 10.249 1.00 . A A . 5 DLY CD 1 1 13 1880 1 1 5 . CE C 40.881 23.352 10.399 1.00 . A A . 5 DLY CE 1 1 13 1881 1 1 5 . CG C 39.731 25.444 11.141 1.00 . A A . 5 DLY CG 1 1 13 1882 1 1 5 . H H 37.427 28.632 10.606 1.00 . A A . 5 DLY H 1 1 13 1883 1 1 5 . HA H 40.099 28.183 11.591 1.00 . A A . 5 DLY HA 1 1 13 1884 1 1 5 . HB2 H 39.061 26.997 9.757 1.00 . A A . 5 DLY HB2 1 1 13 1885 1 1 5 . HB3 H 37.797 26.295 10.821 1.00 . A A . 5 DLY HB3 1 1 13 1886 1 1 5 . HD2 H 39.602 24.468 9.182 1.00 . A A . 5 DLY HD2 1 1 13 1887 1 1 5 . HD3 H 38.691 23.742 10.525 1.00 . A A . 5 DLY HD3 1 1 13 1888 1 1 5 . HE2 H 40.958 23.097 11.450 1.00 . A A . 5 DLY HE2 1 1 13 1889 1 1 5 . HE3 H 41.789 23.862 10.075 1.00 . A A . 5 DLY HE3 1 1 13 1890 1 1 5 . HG2 H 39.481 25.032 12.125 1.00 . A A . 5 DLY HG2 1 1 13 1891 1 1 5 . HG3 H 40.765 25.778 11.160 1.00 . A A . 5 DLY HG3 1 1 13 1892 1 1 5 . HZ1 H 39.901 21.599 10.122 1.00 . A A . 5 DLY HZ1 1 1 13 1893 1 1 5 . HZ2 H 41.478 21.521 9.615 1.00 . A A . 5 DLY HZ2 1 1 13 1894 1 1 5 . HZ3 H 40.360 22.278 8.705 1.00 . A A . 5 DLY HZ3 1 1 13 1895 1 1 5 . N N 38.259 28.886 11.116 1.00 . A A . 5 DLY N 1 1 13 1896 1 1 5 . NZ N 40.650 22.097 9.659 1.00 . A A . 5 DLY NZ 1 1 13 1897 1 1 5 . O O 37.787 27.453 13.640 1.00 . A A . 5 DLY O 1 1 13 1898 1 1 6 ASP C C 39.913 28.810 15.894 1.00 . A A . 6 ASP C 1 1 13 1899 1 1 6 ASP CA C 40.134 27.427 15.307 1.00 . A A . 6 ASP CA 1 1 13 1900 1 1 6 ASP CB C 41.493 26.859 15.699 1.00 . A A . 6 ASP CB 1 1 13 1901 1 1 6 ASP CG C 42.591 27.567 14.919 1.00 . A A . 6 ASP CG 1 1 13 1902 1 1 6 ASP H H 40.885 27.578 13.340 1.00 . A A . 6 ASP H 1 1 13 1903 1 1 6 ASP HA H 39.290 26.876 15.736 1.00 . A A . 6 ASP HA 1 1 13 1904 1 1 6 ASP HB2 H 41.560 26.807 16.784 1.00 . A A . 6 ASP HB2 1 1 13 1905 1 1 6 ASP HB3 H 41.537 25.837 15.329 1.00 . A A . 6 ASP HB3 1 1 13 1906 1 1 6 ASP N N 40.030 27.433 13.866 1.00 . A A . 6 ASP N 1 1 13 1907 1 1 6 ASP O O 39.918 28.952 17.116 1.00 . A A . 6 ASP O 1 1 13 1908 1 1 6 ASP OD1 O 42.955 27.086 13.826 1.00 . A A . 6 ASP OD1 1 1 13 1909 1 1 6 ASP OD2 O 43.087 28.610 15.406 1.00 . A A . 6 ASP OD2 1 1 13 1910 1 1 7 SER C C 38.920 32.091 14.933 1.00 . A A . 7 SER C 1 1 13 1911 1 1 7 SER CA C 40.041 31.250 15.526 1.00 . A A . 7 SER CA 1 1 13 1912 1 1 7 SER CB C 41.388 31.785 15.040 1.00 . A A . 7 SER CB 1 1 13 1913 1 1 7 SER H H 39.847 29.776 14.081 1.00 . A A . 7 SER H 1 1 13 1914 1 1 7 SER HA H 40.063 31.319 16.614 1.00 . A A . 7 SER HA 1 1 13 1915 1 1 7 SER HB2 H 41.325 31.915 13.961 1.00 . A A . 7 SER HB2 1 1 13 1916 1 1 7 SER HB3 H 41.373 32.822 15.362 1.00 . A A . 7 SER HB3 1 1 13 1917 1 1 7 SER HG H 42.678 30.242 15.116 1.00 . A A . 7 SER HG 1 1 13 1918 1 1 7 SER N N 39.916 29.878 15.077 1.00 . A A . 7 SER N 1 1 13 1919 1 1 7 SER O O 39.111 32.900 14.033 1.00 . A A . 7 SER O 1 1 13 1920 1 1 7 SER OG O 42.502 31.078 15.554 1.00 . A A . 7 SER OG 1 1 13 1921 1 1 8 . C C 35.223 32.224 15.125 1.00 . A A . 8 DTY C 1 1 13 1922 1 1 8 . CA C 36.605 32.850 15.242 1.00 . A A . 8 DTY CA 1 1 13 1923 1 1 8 . CB C 36.531 33.815 16.425 1.00 . A A . 8 DTY CB 1 1 13 1924 1 1 8 . CD1 C 37.598 36.053 15.738 1.00 . A A . 8 DTY CD1 1 1 13 1925 1 1 8 . CD2 C 38.825 34.514 17.113 1.00 . A A . 8 DTY CD2 1 1 13 1926 1 1 8 . CE1 C 38.727 36.887 15.714 1.00 . A A . 8 DTY CE1 1 1 13 1927 1 1 8 . CE2 C 39.906 35.390 17.241 1.00 . A A . 8 DTY CE2 1 1 13 1928 1 1 8 . CG C 37.645 34.831 16.430 1.00 . A A . 8 DTY CG 1 1 13 1929 1 1 8 . CZ C 39.877 36.563 16.467 1.00 . A A . 8 DTY CZ 1 1 13 1930 1 1 8 . H H 37.638 31.487 16.416 1.00 . A A . 8 DTY H 1 1 13 1931 1 1 8 . HA H 36.734 33.504 14.385 1.00 . A A . 8 DTY HA 1 1 13 1932 1 1 8 . HB2 H 36.601 33.220 17.332 1.00 . A A . 8 DTY HB2 1 1 13 1933 1 1 8 . HB3 H 35.617 34.407 16.401 1.00 . A A . 8 DTY HB3 1 1 13 1934 1 1 8 . HD1 H 36.774 36.293 15.095 1.00 . A A . 8 DTY HD1 1 1 13 1935 1 1 8 . HD2 H 38.881 33.601 17.699 1.00 . A A . 8 DTY HD2 1 1 13 1936 1 1 8 . HE1 H 38.816 37.772 15.099 1.00 . A A . 8 DTY HE1 1 1 13 1937 1 1 8 . HE2 H 40.862 35.086 17.650 1.00 . A A . 8 DTY HE2 1 1 13 1938 1 1 8 . HH H 41.758 36.825 16.576 1.00 . A A . 8 DTY HH 1 1 13 1939 1 1 8 . N N 37.739 31.995 15.545 1.00 . A A . 8 DTY N 1 1 13 1940 1 1 8 . O O 34.922 31.175 15.702 1.00 . A A . 8 DTY O 1 1 13 1941 1 1 8 . OH O 40.988 37.337 16.299 1.00 . A A . 8 DTY OH 1 1 13 1942 1 1 9 . C C 32.087 33.720 14.734 1.00 . A A . 9 DCY C 1 1 13 1943 1 1 9 . CA C 32.935 32.545 14.250 1.00 . A A . 9 DCY CA 1 1 13 1944 1 1 9 . CB C 32.521 32.288 12.804 1.00 . A A . 9 DCY CB 1 1 13 1945 1 1 9 . H H 34.671 33.828 14.173 1.00 . A A . 9 DCY H 1 1 13 1946 1 1 9 . HA H 32.758 31.666 14.859 1.00 . A A . 9 DCY HA 1 1 13 1947 1 1 9 . HB2 H 32.793 33.117 12.153 1.00 . A A . 9 DCY HB2 1 1 13 1948 1 1 9 . HB3 H 31.436 32.244 12.730 1.00 . A A . 9 DCY HB3 1 1 13 1949 1 1 9 . N N 34.330 32.906 14.397 1.00 . A A . 9 DCY N 1 1 13 1950 1 1 9 . O O 31.513 34.417 13.901 1.00 . A A . 9 DCY O 1 1 13 1951 1 1 9 . SG S 33.167 30.695 12.238 1.00 . A A . 9 DCY SG 1 1 13 1952 1 1 10 PRO C C 31.753 36.231 16.143 1.00 . A A . 10 PRO C 1 1 13 1953 1 1 10 PRO CA C 31.250 34.926 16.744 1.00 . A A . 10 PRO CA 1 1 13 1954 1 1 10 PRO CB C 31.616 34.654 18.194 1.00 . A A . 10 PRO CB 1 1 13 1955 1 1 10 PRO CD C 32.466 32.886 17.007 1.00 . A A . 10 PRO CD 1 1 13 1956 1 1 10 PRO CG C 31.805 33.147 18.353 1.00 . A A . 10 PRO CG 1 1 13 1957 1 1 10 PRO HA H 30.178 34.884 16.583 1.00 . A A . 10 PRO HA 1 1 13 1958 1 1 10 PRO HB2 H 32.612 35.018 18.453 1.00 . A A . 10 PRO HB2 1 1 13 1959 1 1 10 PRO HB3 H 30.924 35.073 18.931 1.00 . A A . 10 PRO HB3 1 1 13 1960 1 1 10 PRO HD2 H 33.494 33.213 17.164 1.00 . A A . 10 PRO HD2 1 1 13 1961 1 1 10 PRO HD3 H 32.400 31.823 16.803 1.00 . A A . 10 PRO HD3 1 1 13 1962 1 1 10 PRO HG2 H 32.446 32.877 19.189 1.00 . A A . 10 PRO HG2 1 1 13 1963 1 1 10 PRO HG3 H 30.812 32.690 18.445 1.00 . A A . 10 PRO HG3 1 1 13 1964 1 1 10 PRO N N 31.909 33.827 16.058 1.00 . A A . 10 PRO N 1 1 13 1965 1 1 10 PRO O O 32.951 36.456 15.946 1.00 . A A . 10 PRO O 1 1 13 1966 1 1 11 . C C 31.020 38.591 13.807 1.00 . A A . 11 DSN C 1 1 13 1967 1 1 11 . CA C 31.008 38.446 15.317 1.00 . A A . 11 DSN CA 1 1 13 1968 1 1 11 . CB C 29.919 39.357 15.869 1.00 . A A . 11 DSN CB 1 1 13 1969 1 1 11 . H H 29.833 36.813 15.920 1.00 . A A . 11 DSN H 1 1 13 1970 1 1 11 . HA H 32.006 38.776 15.627 1.00 . A A . 11 DSN HA 1 1 13 1971 1 1 11 . HB2 H 28.949 38.877 16.005 1.00 . A A . 11 DSN HB2 1 1 13 1972 1 1 11 . HB3 H 29.735 40.192 15.199 1.00 . A A . 11 DSN HB3 1 1 13 1973 1 1 11 . HG H 29.609 40.431 17.309 1.00 . A A . 11 DSN HG 1 1 13 1974 1 1 11 . N N 30.798 37.103 15.822 1.00 . A A . 11 DSN N 1 1 13 1975 1 1 11 . O O 31.244 39.659 13.250 1.00 . A A . 11 DSN O 1 1 13 1976 1 1 11 . OG O 30.382 39.927 17.076 1.00 . A A . 11 DSN OG 1 1 14 1977 1 1 1 DAL C C 32.872 37.037 11.431 1.00 . A A . 1 DAL C 1 1 14 1978 1 1 1 DAL CA C 31.378 36.783 11.509 1.00 . A A . 1 DAL CA 1 1 14 1979 1 1 1 DAL CB C 30.941 35.345 11.230 1.00 . A A . 1 DAL CB 1 1 14 1980 1 1 1 DAL H1 H 30.652 36.256 13.430 1.00 . A A . 1 DAL H1 1 1 14 1981 1 1 1 DAL HA H 30.893 37.467 10.822 1.00 . A A . 1 DAL HA 1 1 14 1982 1 1 1 DAL HB1 H 31.504 34.560 11.723 1.00 . A A . 1 DAL HB1 1 1 14 1983 1 1 1 DAL HB2 H 31.077 35.257 10.144 1.00 . A A . 1 DAL HB2 1 1 14 1984 1 1 1 DAL HB3 H 29.874 35.213 11.377 1.00 . A A . 1 DAL HB3 1 1 14 1985 1 1 1 DAL N N 30.938 37.054 12.867 1.00 . A A . 1 DAL N 1 1 14 1986 1 1 1 DAL O O 33.341 37.309 10.319 1.00 . A A . 1 DAL O 1 1 14 1987 1 1 2 GLN C C 35.955 36.105 12.222 1.00 . A A . 2 GLN C 1 1 14 1988 1 1 2 GLN CA C 35.059 37.283 12.560 1.00 . A A . 2 GLN CA 1 1 14 1989 1 1 2 GLN CB C 35.317 37.771 13.993 1.00 . A A . 2 GLN CB 1 1 14 1990 1 1 2 GLN CD C 35.035 39.638 15.765 1.00 . A A . 2 GLN CD 1 1 14 1991 1 1 2 GLN CG C 34.652 39.079 14.406 1.00 . A A . 2 GLN CG 1 1 14 1992 1 1 2 GLN H H 33.201 36.367 13.233 1.00 . A A . 2 GLN H 1 1 14 1993 1 1 2 GLN HA H 35.237 38.159 11.947 1.00 . A A . 2 GLN HA 1 1 14 1994 1 1 2 GLN HB2 H 35.139 36.995 14.737 1.00 . A A . 2 GLN HB2 1 1 14 1995 1 1 2 GLN HB3 H 36.389 37.942 14.092 1.00 . A A . 2 GLN HB3 1 1 14 1996 1 1 2 GLN HE21 H 34.133 41.481 15.584 1.00 . A A . 2 GLN HE21 1 1 14 1997 1 1 2 GLN HE22 H 35.030 41.145 17.070 1.00 . A A . 2 GLN HE22 1 1 14 1998 1 1 2 GLN HG2 H 35.071 39.728 13.632 1.00 . A A . 2 GLN HG2 1 1 14 1999 1 1 2 GLN HG3 H 33.573 39.021 14.280 1.00 . A A . 2 GLN HG3 1 1 14 2000 1 1 2 GLN N N 33.669 36.871 12.488 1.00 . A A . 2 GLN N 1 1 14 2001 1 1 2 GLN NE2 N 34.724 40.885 16.140 1.00 . A A . 2 GLN NE2 1 1 14 2002 1 1 2 GLN O O 35.887 35.127 12.968 1.00 . A A . 2 GLN O 1 1 14 2003 1 1 2 GLN OE1 O 35.698 39.005 16.580 1.00 . A A . 2 GLN OE1 1 1 14 2004 1 1 3 DPR C C 37.167 33.746 10.720 1.00 . A A . 3 DPR C 1 1 14 2005 1 1 3 DPR CA C 37.848 35.063 11.057 1.00 . A A . 3 DPR CA 1 1 14 2006 1 1 3 DPR CB C 38.786 35.552 9.951 1.00 . A A . 3 DPR CB 1 1 14 2007 1 1 3 DPR CD C 37.140 37.189 10.321 1.00 . A A . 3 DPR CD 1 1 14 2008 1 1 3 DPR CG C 38.044 36.657 9.212 1.00 . A A . 3 DPR CG 1 1 14 2009 1 1 3 DPR HA H 38.406 34.925 11.985 1.00 . A A . 3 DPR HA 1 1 14 2010 1 1 3 DPR HB2 H 39.046 34.740 9.282 1.00 . A A . 3 DPR HB2 1 1 14 2011 1 1 3 DPR HB3 H 39.646 36.022 10.444 1.00 . A A . 3 DPR HB3 1 1 14 2012 1 1 3 DPR HD2 H 36.204 37.481 9.848 1.00 . A A . 3 DPR HD2 1 1 14 2013 1 1 3 DPR HD3 H 37.688 38.064 10.670 1.00 . A A . 3 DPR HD3 1 1 14 2014 1 1 3 DPR HG2 H 37.373 36.246 8.459 1.00 . A A . 3 DPR HG2 1 1 14 2015 1 1 3 DPR HG3 H 38.609 37.397 8.644 1.00 . A A . 3 DPR HG3 1 1 14 2016 1 1 3 DPR N N 36.914 36.147 11.299 1.00 . A A . 3 DPR N 1 1 14 2017 1 1 3 DPR O O 36.012 33.672 10.306 1.00 . A A . 3 DPR O 1 1 14 2018 1 1 4 . C C 38.303 30.283 11.075 1.00 . A A . 4 DCY C 1 1 14 2019 1 1 4 . CA C 37.202 31.322 10.986 1.00 . A A . 4 DCY CA 1 1 14 2020 1 1 4 . CB C 36.179 31.206 12.115 1.00 . A A . 4 DCY CB 1 1 14 2021 1 1 4 . H H 38.818 32.641 11.233 1.00 . A A . 4 DCY H 1 1 14 2022 1 1 4 . HA H 36.760 31.287 9.989 1.00 . A A . 4 DCY HA 1 1 14 2023 1 1 4 . HB2 H 35.785 32.151 12.489 1.00 . A A . 4 DCY HB2 1 1 14 2024 1 1 4 . HB3 H 36.673 30.898 13.034 1.00 . A A . 4 DCY HB3 1 1 14 2025 1 1 4 . N N 37.824 32.637 11.043 1.00 . A A . 4 DCY N 1 1 14 2026 1 1 4 . O O 39.474 30.622 11.196 1.00 . A A . 4 DCY O 1 1 14 2027 1 1 4 . SG S 34.647 30.262 11.882 1.00 . A A . 4 DCY SG 1 1 14 2028 1 1 5 . C C 38.935 27.966 12.923 1.00 . A A . 5 DLY C 1 1 14 2029 1 1 5 . CA C 38.791 27.966 11.408 1.00 . A A . 5 DLY CA 1 1 14 2030 1 1 5 . CB C 38.335 26.625 10.832 1.00 . A A . 5 DLY CB 1 1 14 2031 1 1 5 . CD C 38.978 24.203 10.705 1.00 . A A . 5 DLY CD 1 1 14 2032 1 1 5 . CE C 39.981 23.121 11.076 1.00 . A A . 5 DLY CE 1 1 14 2033 1 1 5 . CG C 39.338 25.572 11.290 1.00 . A A . 5 DLY CG 1 1 14 2034 1 1 5 . H H 36.933 28.783 10.947 1.00 . A A . 5 DLY H 1 1 14 2035 1 1 5 . HA H 39.721 28.200 10.907 1.00 . A A . 5 DLY HA 1 1 14 2036 1 1 5 . HB2 H 38.204 26.613 9.752 1.00 . A A . 5 DLY HB2 1 1 14 2037 1 1 5 . HB3 H 37.338 26.416 11.230 1.00 . A A . 5 DLY HB3 1 1 14 2038 1 1 5 . HD2 H 39.093 24.208 9.621 1.00 . A A . 5 DLY HD2 1 1 14 2039 1 1 5 . HD3 H 37.965 23.868 10.913 1.00 . A A . 5 DLY HD3 1 1 14 2040 1 1 5 . HE2 H 40.997 23.483 10.909 1.00 . A A . 5 DLY HE2 1 1 14 2041 1 1 5 . HE3 H 39.876 22.176 10.538 1.00 . A A . 5 DLY HE3 1 1 14 2042 1 1 5 . HG2 H 39.261 25.490 12.382 1.00 . A A . 5 DLY HG2 1 1 14 2043 1 1 5 . HG3 H 40.332 25.882 10.969 1.00 . A A . 5 DLY HG3 1 1 14 2044 1 1 5 . HZ1 H 40.257 23.549 13.110 1.00 . A A . 5 DLY HZ1 1 1 14 2045 1 1 5 . HZ2 H 40.479 21.954 12.685 1.00 . A A . 5 DLY HZ2 1 1 14 2046 1 1 5 . HZ3 H 39.033 22.513 12.857 1.00 . A A . 5 DLY HZ3 1 1 14 2047 1 1 5 . N N 37.914 29.017 10.916 1.00 . A A . 5 DLY N 1 1 14 2048 1 1 5 . NZ N 39.941 22.795 12.517 1.00 . A A . 5 DLY NZ 1 1 14 2049 1 1 5 . O O 37.907 28.011 13.599 1.00 . A A . 5 DLY O 1 1 14 2050 1 1 6 ASP C C 40.020 28.444 15.710 1.00 . A A . 6 ASP C 1 1 14 2051 1 1 6 ASP CA C 40.424 27.332 14.758 1.00 . A A . 6 ASP CA 1 1 14 2052 1 1 6 ASP CB C 41.830 26.763 14.967 1.00 . A A . 6 ASP CB 1 1 14 2053 1 1 6 ASP CG C 42.305 25.587 14.134 1.00 . A A . 6 ASP CG 1 1 14 2054 1 1 6 ASP H H 40.868 27.813 12.671 1.00 . A A . 6 ASP H 1 1 14 2055 1 1 6 ASP HA H 39.819 26.439 14.898 1.00 . A A . 6 ASP HA 1 1 14 2056 1 1 6 ASP HB2 H 42.543 27.586 14.911 1.00 . A A . 6 ASP HB2 1 1 14 2057 1 1 6 ASP HB3 H 41.771 26.273 15.943 1.00 . A A . 6 ASP HB3 1 1 14 2058 1 1 6 ASP N N 40.156 27.699 13.378 1.00 . A A . 6 ASP N 1 1 14 2059 1 1 6 ASP O O 39.485 28.190 16.786 1.00 . A A . 6 ASP O 1 1 14 2060 1 1 6 ASP OD1 O 42.045 24.436 14.549 1.00 . A A . 6 ASP OD1 1 1 14 2061 1 1 6 ASP OD2 O 42.997 25.785 13.109 1.00 . A A . 6 ASP OD2 1 1 14 2062 1 1 7 SER C C 39.071 31.773 15.236 1.00 . A A . 7 SER C 1 1 14 2063 1 1 7 SER CA C 39.886 30.823 16.093 1.00 . A A . 7 SER CA 1 1 14 2064 1 1 7 SER CB C 41.032 31.498 16.846 1.00 . A A . 7 SER CB 1 1 14 2065 1 1 7 SER H H 40.785 29.737 14.416 1.00 . A A . 7 SER H 1 1 14 2066 1 1 7 SER HA H 39.237 30.496 16.906 1.00 . A A . 7 SER HA 1 1 14 2067 1 1 7 SER HB2 H 41.505 32.275 16.262 1.00 . A A . 7 SER HB2 1 1 14 2068 1 1 7 SER HB3 H 40.605 31.995 17.717 1.00 . A A . 7 SER HB3 1 1 14 2069 1 1 7 SER HG H 41.611 30.099 17.996 1.00 . A A . 7 SER HG 1 1 14 2070 1 1 7 SER N N 40.363 29.681 15.335 1.00 . A A . 7 SER N 1 1 14 2071 1 1 7 SER O O 39.343 32.026 14.060 1.00 . A A . 7 SER O 1 1 14 2072 1 1 7 SER OG O 41.989 30.524 17.220 1.00 . A A . 7 SER OG 1 1 14 2073 1 1 8 . C C 35.553 32.627 15.475 1.00 . A A . 8 DTY C 1 1 14 2074 1 1 8 . CA C 36.982 33.123 15.410 1.00 . A A . 8 DTY CA 1 1 14 2075 1 1 8 . CB C 37.175 34.456 16.136 1.00 . A A . 8 DTY CB 1 1 14 2076 1 1 8 . CD1 C 38.877 35.845 14.951 1.00 . A A . 8 DTY CD1 1 1 14 2077 1 1 8 . CD2 C 39.442 35.138 17.164 1.00 . A A . 8 DTY CD2 1 1 14 2078 1 1 8 . CE1 C 40.104 36.490 14.769 1.00 . A A . 8 DTY CE1 1 1 14 2079 1 1 8 . CE2 C 40.699 35.739 17.017 1.00 . A A . 8 DTY CE2 1 1 14 2080 1 1 8 . CG C 38.513 35.154 16.110 1.00 . A A . 8 DTY CG 1 1 14 2081 1 1 8 . CZ C 41.016 36.444 15.848 1.00 . A A . 8 DTY CZ 1 1 14 2082 1 1 8 . H H 37.813 31.948 16.843 1.00 . A A . 8 DTY H 1 1 14 2083 1 1 8 . HA H 37.155 33.338 14.347 1.00 . A A . 8 DTY HA 1 1 14 2084 1 1 8 . HB2 H 36.964 34.257 17.182 1.00 . A A . 8 DTY HB2 1 1 14 2085 1 1 8 . HB3 H 36.419 35.154 15.791 1.00 . A A . 8 DTY HB3 1 1 14 2086 1 1 8 . HD1 H 38.159 36.064 14.173 1.00 . A A . 8 DTY HD1 1 1 14 2087 1 1 8 . HD2 H 39.331 34.490 18.016 1.00 . A A . 8 DTY HD2 1 1 14 2088 1 1 8 . HE1 H 40.389 36.966 13.843 1.00 . A A . 8 DTY HE1 1 1 14 2089 1 1 8 . HE2 H 41.485 35.697 17.760 1.00 . A A . 8 DTY HE2 1 1 14 2090 1 1 8 . HH H 42.699 36.922 16.687 1.00 . A A . 8 DTY HH 1 1 14 2091 1 1 8 . N N 38.028 32.261 15.919 1.00 . A A . 8 DTY N 1 1 14 2092 1 1 8 . O O 35.301 31.610 16.121 1.00 . A A . 8 DTY O 1 1 14 2093 1 1 8 . OH O 42.197 37.123 15.894 1.00 . A A . 8 DTY OH 1 1 14 2094 1 1 9 . C C 32.204 33.991 15.159 1.00 . A A . 9 DCY C 1 1 14 2095 1 1 9 . CA C 33.203 32.868 14.898 1.00 . A A . 9 DCY CA 1 1 14 2096 1 1 9 . CB C 32.968 32.101 13.592 1.00 . A A . 9 DCY CB 1 1 14 2097 1 1 9 . H H 34.895 34.075 14.277 1.00 . A A . 9 DCY H 1 1 14 2098 1 1 9 . HA H 33.098 32.054 15.617 1.00 . A A . 9 DCY HA 1 1 14 2099 1 1 9 . HB2 H 33.477 32.667 12.809 1.00 . A A . 9 DCY HB2 1 1 14 2100 1 1 9 . HB3 H 31.936 31.966 13.283 1.00 . A A . 9 DCY HB3 1 1 14 2101 1 1 9 . N N 34.574 33.318 14.866 1.00 . A A . 9 DCY N 1 1 14 2102 1 1 9 . O O 31.864 34.712 14.234 1.00 . A A . 9 DCY O 1 1 14 2103 1 1 9 . SG S 33.683 30.442 13.666 1.00 . A A . 9 DCY SG 1 1 14 2104 1 1 10 PRO C C 31.185 36.588 16.263 1.00 . A A . 10 PRO C 1 1 14 2105 1 1 10 PRO CA C 30.838 35.224 16.834 1.00 . A A . 10 PRO CA 1 1 14 2106 1 1 10 PRO CB C 30.814 35.255 18.363 1.00 . A A . 10 PRO CB 1 1 14 2107 1 1 10 PRO CD C 32.404 33.612 17.567 1.00 . A A . 10 PRO CD 1 1 14 2108 1 1 10 PRO CG C 32.132 34.581 18.709 1.00 . A A . 10 PRO CG 1 1 14 2109 1 1 10 PRO HA H 29.884 34.948 16.377 1.00 . A A . 10 PRO HA 1 1 14 2110 1 1 10 PRO HB2 H 30.682 36.310 18.634 1.00 . A A . 10 PRO HB2 1 1 14 2111 1 1 10 PRO HB3 H 30.103 34.565 18.810 1.00 . A A . 10 PRO HB3 1 1 14 2112 1 1 10 PRO HD2 H 33.474 33.447 17.466 1.00 . A A . 10 PRO HD2 1 1 14 2113 1 1 10 PRO HD3 H 31.923 32.643 17.745 1.00 . A A . 10 PRO HD3 1 1 14 2114 1 1 10 PRO HG2 H 32.924 35.320 18.864 1.00 . A A . 10 PRO HG2 1 1 14 2115 1 1 10 PRO HG3 H 32.018 34.140 19.701 1.00 . A A . 10 PRO HG3 1 1 14 2116 1 1 10 PRO N N 31.799 34.224 16.407 1.00 . A A . 10 PRO N 1 1 14 2117 1 1 10 PRO O O 32.345 36.994 16.362 1.00 . A A . 10 PRO O 1 1 14 2118 1 1 11 . C C 31.091 38.221 13.484 1.00 . A A . 11 DSN C 1 1 14 2119 1 1 11 . CA C 30.560 38.492 14.887 1.00 . A A . 11 DSN CA 1 1 14 2120 1 1 11 . CB C 29.367 39.428 14.695 1.00 . A A . 11 DSN CB 1 1 14 2121 1 1 11 . H H 29.323 37.051 15.933 1.00 . A A . 11 DSN H 1 1 14 2122 1 1 11 . HA H 31.248 39.093 15.470 1.00 . A A . 11 DSN HA 1 1 14 2123 1 1 11 . HB2 H 28.579 39.000 14.069 1.00 . A A . 11 DSN HB2 1 1 14 2124 1 1 11 . HB3 H 29.788 40.281 14.170 1.00 . A A . 11 DSN HB3 1 1 14 2125 1 1 11 . HG H 28.240 40.396 15.934 1.00 . A A . 11 DSN HG 1 1 14 2126 1 1 11 . N N 30.252 37.275 15.614 1.00 . A A . 11 DSN N 1 1 14 2127 1 1 11 . O O 31.651 39.145 12.902 1.00 . A A . 11 DSN O 1 1 14 2128 1 1 11 . OG O 28.960 39.757 16.004 1.00 . A A . 11 DSN OG 1 1 15 2129 1 1 1 DAL C C 33.259 36.745 11.417 1.00 . A A . 1 DAL C 1 1 15 2130 1 1 1 DAL CA C 31.771 36.428 11.389 1.00 . A A . 1 DAL CA 1 1 15 2131 1 1 1 DAL CB C 31.482 34.941 11.260 1.00 . A A . 1 DAL CB 1 1 15 2132 1 1 1 DAL H1 H 30.876 36.272 13.278 1.00 . A A . 1 DAL H1 1 1 15 2133 1 1 1 DAL HA H 31.394 36.915 10.487 1.00 . A A . 1 DAL HA 1 1 15 2134 1 1 1 DAL HB1 H 32.125 34.294 11.859 1.00 . A A . 1 DAL HB1 1 1 15 2135 1 1 1 DAL HB2 H 31.525 34.681 10.201 1.00 . A A . 1 DAL HB2 1 1 15 2136 1 1 1 DAL HB3 H 30.447 34.784 11.586 1.00 . A A . 1 DAL HB3 1 1 15 2137 1 1 1 DAL N N 31.037 36.936 12.539 1.00 . A A . 1 DAL N 1 1 15 2138 1 1 1 DAL O O 33.840 37.077 10.391 1.00 . A A . 1 DAL O 1 1 15 2139 1 1 2 GLN C C 36.101 36.024 12.727 1.00 . A A . 2 GLN C 1 1 15 2140 1 1 2 GLN CA C 35.139 37.176 12.993 1.00 . A A . 2 GLN CA 1 1 15 2141 1 1 2 GLN CB C 35.150 37.905 14.335 1.00 . A A . 2 GLN CB 1 1 15 2142 1 1 2 GLN CD C 34.407 40.011 15.504 1.00 . A A . 2 GLN CD 1 1 15 2143 1 1 2 GLN CG C 34.621 39.323 14.160 1.00 . A A . 2 GLN CG 1 1 15 2144 1 1 2 GLN H H 33.336 36.132 13.313 1.00 . A A . 2 GLN H 1 1 15 2145 1 1 2 GLN HA H 35.333 37.954 12.248 1.00 . A A . 2 GLN HA 1 1 15 2146 1 1 2 GLN HB2 H 34.433 37.366 14.967 1.00 . A A . 2 GLN HB2 1 1 15 2147 1 1 2 GLN HB3 H 36.144 37.871 14.789 1.00 . A A . 2 GLN HB3 1 1 15 2148 1 1 2 GLN HE21 H 36.421 40.131 15.707 1.00 . A A . 2 GLN HE21 1 1 15 2149 1 1 2 GLN HE22 H 35.434 40.644 17.087 1.00 . A A . 2 GLN HE22 1 1 15 2150 1 1 2 GLN HG2 H 35.369 39.884 13.605 1.00 . A A . 2 GLN HG2 1 1 15 2151 1 1 2 GLN HG3 H 33.671 39.352 13.625 1.00 . A A . 2 GLN HG3 1 1 15 2152 1 1 2 GLN N N 33.810 36.704 12.635 1.00 . A A . 2 GLN N 1 1 15 2153 1 1 2 GLN NE2 N 35.528 40.342 16.132 1.00 . A A . 2 GLN NE2 1 1 15 2154 1 1 2 GLN O O 36.021 35.086 13.521 1.00 . A A . 2 GLN O 1 1 15 2155 1 1 2 GLN OE1 O 33.307 40.193 16.035 1.00 . A A . 2 GLN OE1 1 1 15 2156 1 1 3 DPR C C 37.294 33.776 10.956 1.00 . A A . 3 DPR C 1 1 15 2157 1 1 3 DPR CA C 37.957 35.077 11.389 1.00 . A A . 3 DPR CA 1 1 15 2158 1 1 3 DPR CB C 38.884 35.667 10.331 1.00 . A A . 3 DPR CB 1 1 15 2159 1 1 3 DPR CD C 37.250 37.260 10.918 1.00 . A A . 3 DPR CD 1 1 15 2160 1 1 3 DPR CG C 38.725 37.172 10.521 1.00 . A A . 3 DPR CG 1 1 15 2161 1 1 3 DPR HA H 38.619 34.892 12.237 1.00 . A A . 3 DPR HA 1 1 15 2162 1 1 3 DPR HB2 H 38.589 35.413 9.312 1.00 . A A . 3 DPR HB2 1 1 15 2163 1 1 3 DPR HB3 H 39.947 35.535 10.556 1.00 . A A . 3 DPR HB3 1 1 15 2164 1 1 3 DPR HD2 H 36.591 37.159 10.062 1.00 . A A . 3 DPR HD2 1 1 15 2165 1 1 3 DPR HD3 H 37.039 38.181 11.466 1.00 . A A . 3 DPR HD3 1 1 15 2166 1 1 3 DPR HG2 H 39.065 37.722 9.638 1.00 . A A . 3 DPR HG2 1 1 15 2167 1 1 3 DPR HG3 H 39.269 37.606 11.370 1.00 . A A . 3 DPR HG3 1 1 15 2168 1 1 3 DPR N N 37.011 36.105 11.757 1.00 . A A . 3 DPR N 1 1 15 2169 1 1 3 DPR O O 36.556 33.758 9.976 1.00 . A A . 3 DPR O 1 1 15 2170 1 1 4 . C C 37.930 30.256 11.519 1.00 . A A . 4 DCY C 1 1 15 2171 1 1 4 . CA C 36.976 31.444 11.558 1.00 . A A . 4 DCY CA 1 1 15 2172 1 1 4 . CB C 36.139 31.345 12.827 1.00 . A A . 4 DCY CB 1 1 15 2173 1 1 4 . H H 38.429 32.778 12.307 1.00 . A A . 4 DCY H 1 1 15 2174 1 1 4 . HA H 36.240 31.370 10.752 1.00 . A A . 4 DCY HA 1 1 15 2175 1 1 4 . HB2 H 35.742 32.351 12.977 1.00 . A A . 4 DCY HB2 1 1 15 2176 1 1 4 . HB3 H 36.800 31.146 13.673 1.00 . A A . 4 DCY HB3 1 1 15 2177 1 1 4 . N N 37.688 32.699 11.625 1.00 . A A . 4 DCY N 1 1 15 2178 1 1 4 . O O 39.045 30.416 12.002 1.00 . A A . 4 DCY O 1 1 15 2179 1 1 4 . SG S 34.770 30.183 12.586 1.00 . A A . 4 DCY SG 1 1 15 2180 1 1 5 . C C 38.550 27.702 12.662 1.00 . A A . 5 DLY C 1 1 15 2181 1 1 5 . CA C 38.344 27.852 11.169 1.00 . A A . 5 DLY CA 1 1 15 2182 1 1 5 . CB C 37.462 26.731 10.608 1.00 . A A . 5 DLY CB 1 1 15 2183 1 1 5 . CD C 37.457 24.276 10.203 1.00 . A A . 5 DLY CD 1 1 15 2184 1 1 5 . CE C 38.003 22.905 10.611 1.00 . A A . 5 DLY CE 1 1 15 2185 1 1 5 . CG C 38.192 25.426 10.880 1.00 . A A . 5 DLY CG 1 1 15 2186 1 1 5 . H H 36.634 28.905 10.706 1.00 . A A . 5 DLY H 1 1 15 2187 1 1 5 . HA H 39.302 27.924 10.648 1.00 . A A . 5 DLY HA 1 1 15 2188 1 1 5 . HB2 H 37.310 26.827 9.530 1.00 . A A . 5 DLY HB2 1 1 15 2189 1 1 5 . HB3 H 36.510 26.693 11.140 1.00 . A A . 5 DLY HB3 1 1 15 2190 1 1 5 . HD2 H 37.428 24.306 9.111 1.00 . A A . 5 DLY HD2 1 1 15 2191 1 1 5 . HD3 H 36.435 24.321 10.554 1.00 . A A . 5 DLY HD3 1 1 15 2192 1 1 5 . HE2 H 38.579 22.967 11.531 1.00 . A A . 5 DLY HE2 1 1 15 2193 1 1 5 . HE3 H 38.670 22.643 9.802 1.00 . A A . 5 DLY HE3 1 1 15 2194 1 1 5 . HG2 H 38.366 25.224 11.937 1.00 . A A . 5 DLY HG2 1 1 15 2195 1 1 5 . HG3 H 39.186 25.477 10.427 1.00 . A A . 5 DLY HG3 1 1 15 2196 1 1 5 . HZ1 H 36.372 21.775 9.977 1.00 . A A . 5 DLY HZ1 1 1 15 2197 1 1 5 . HZ2 H 36.384 22.170 11.610 1.00 . A A . 5 DLY HZ2 1 1 15 2198 1 1 5 . HZ3 H 37.346 21.015 11.043 1.00 . A A . 5 DLY HZ3 1 1 15 2199 1 1 5 . N N 37.586 29.081 10.993 1.00 . A A . 5 DLY N 1 1 15 2200 1 1 5 . NZ N 36.933 21.903 10.800 1.00 . A A . 5 DLY NZ 1 1 15 2201 1 1 5 . O O 37.678 27.769 13.530 1.00 . A A . 5 DLY O 1 1 15 2202 1 1 6 ASP C C 40.254 28.561 15.250 1.00 . A A . 6 ASP C 1 1 15 2203 1 1 6 ASP CA C 40.240 27.305 14.388 1.00 . A A . 6 ASP CA 1 1 15 2204 1 1 6 ASP CB C 41.508 26.486 14.589 1.00 . A A . 6 ASP CB 1 1 15 2205 1 1 6 ASP CG C 41.558 25.329 13.613 1.00 . A A . 6 ASP CG 1 1 15 2206 1 1 6 ASP H H 40.504 27.639 12.277 1.00 . A A . 6 ASP H 1 1 15 2207 1 1 6 ASP HA H 39.422 26.737 14.846 1.00 . A A . 6 ASP HA 1 1 15 2208 1 1 6 ASP HB2 H 42.318 27.168 14.325 1.00 . A A . 6 ASP HB2 1 1 15 2209 1 1 6 ASP HB3 H 41.650 26.086 15.598 1.00 . A A . 6 ASP HB3 1 1 15 2210 1 1 6 ASP N N 39.828 27.552 13.023 1.00 . A A . 6 ASP N 1 1 15 2211 1 1 6 ASP O O 40.292 28.451 16.477 1.00 . A A . 6 ASP O 1 1 15 2212 1 1 6 ASP OD1 O 41.129 24.209 13.962 1.00 . A A . 6 ASP OD1 1 1 15 2213 1 1 6 ASP OD2 O 42.095 25.386 12.483 1.00 . A A . 6 ASP OD2 1 1 15 2214 1 1 7 SER C C 39.139 31.949 15.033 1.00 . A A . 7 SER C 1 1 15 2215 1 1 7 SER CA C 40.328 31.068 15.391 1.00 . A A . 7 SER CA 1 1 15 2216 1 1 7 SER CB C 41.686 31.652 15.020 1.00 . A A . 7 SER CB 1 1 15 2217 1 1 7 SER H H 40.063 29.865 13.720 1.00 . A A . 7 SER H 1 1 15 2218 1 1 7 SER HA H 40.388 31.028 16.477 1.00 . A A . 7 SER HA 1 1 15 2219 1 1 7 SER HB2 H 41.754 31.732 13.930 1.00 . A A . 7 SER HB2 1 1 15 2220 1 1 7 SER HB3 H 41.808 32.648 15.429 1.00 . A A . 7 SER HB3 1 1 15 2221 1 1 7 SER HG H 42.910 30.267 14.638 1.00 . A A . 7 SER HG 1 1 15 2222 1 1 7 SER N N 40.176 29.785 14.724 1.00 . A A . 7 SER N 1 1 15 2223 1 1 7 SER O O 39.214 32.628 14.014 1.00 . A A . 7 SER O 1 1 15 2224 1 1 7 SER OG O 42.683 30.740 15.439 1.00 . A A . 7 SER OG 1 1 15 2225 1 1 8 . C C 35.838 32.761 16.251 1.00 . A A . 8 DTY C 1 1 15 2226 1 1 8 . CA C 37.213 33.243 15.793 1.00 . A A . 8 DTY CA 1 1 15 2227 1 1 8 . CB C 37.671 34.461 16.583 1.00 . A A . 8 DTY CB 1 1 15 2228 1 1 8 . CD1 C 39.193 35.997 15.332 1.00 . A A . 8 DTY CD1 1 1 15 2229 1 1 8 . CD2 C 40.179 34.427 16.927 1.00 . A A . 8 DTY CD2 1 1 15 2230 1 1 8 . CE1 C 40.486 36.306 14.919 1.00 . A A . 8 DTY CE1 1 1 15 2231 1 1 8 . CE2 C 41.478 34.836 16.607 1.00 . A A . 8 DTY CE2 1 1 15 2232 1 1 8 . CG C 39.062 34.961 16.275 1.00 . A A . 8 DTY CG 1 1 15 2233 1 1 8 . CZ C 41.613 35.715 15.518 1.00 . A A . 8 DTY CZ 1 1 15 2234 1 1 8 . H H 38.230 31.743 16.834 1.00 . A A . 8 DTY H 1 1 15 2235 1 1 8 . HA H 37.158 33.485 14.735 1.00 . A A . 8 DTY HA 1 1 15 2236 1 1 8 . HB2 H 37.581 34.264 17.651 1.00 . A A . 8 DTY HB2 1 1 15 2237 1 1 8 . HB3 H 36.978 35.271 16.342 1.00 . A A . 8 DTY HB3 1 1 15 2238 1 1 8 . HD1 H 38.271 36.422 14.962 1.00 . A A . 8 DTY HD1 1 1 15 2239 1 1 8 . HD2 H 39.957 33.775 17.761 1.00 . A A . 8 DTY HD2 1 1 15 2240 1 1 8 . HE1 H 40.649 37.095 14.203 1.00 . A A . 8 DTY HE1 1 1 15 2241 1 1 8 . HE2 H 42.304 34.329 17.092 1.00 . A A . 8 DTY HE2 1 1 15 2242 1 1 8 . HH H 43.437 35.620 15.762 1.00 . A A . 8 DTY HH 1 1 15 2243 1 1 8 . N N 38.157 32.159 15.916 1.00 . A A . 8 DTY N 1 1 15 2244 1 1 8 . O O 35.688 32.057 17.241 1.00 . A A . 8 DTY O 1 1 15 2245 1 1 8 . OH O 42.866 36.143 15.189 1.00 . A A . 8 DTY OH 1 1 15 2246 1 1 9 . C C 32.496 34.063 15.561 1.00 . A A . 9 DCY C 1 1 15 2247 1 1 9 . CA C 33.462 32.892 15.636 1.00 . A A . 9 DCY CA 1 1 15 2248 1 1 9 . CB C 33.096 31.952 14.493 1.00 . A A . 9 DCY CB 1 1 15 2249 1 1 9 . H H 35.156 33.905 14.791 1.00 . A A . 9 DCY H 1 1 15 2250 1 1 9 . HA H 33.404 32.299 16.556 1.00 . A A . 9 DCY HA 1 1 15 2251 1 1 9 . HB2 H 33.232 32.384 13.504 1.00 . A A . 9 DCY HB2 1 1 15 2252 1 1 9 . HB3 H 32.032 31.722 14.609 1.00 . A A . 9 DCY HB3 1 1 15 2253 1 1 9 . N N 34.855 33.264 15.503 1.00 . A A . 9 DCY N 1 1 15 2254 1 1 9 . O O 32.628 34.679 14.501 1.00 . A A . 9 DCY O 1 1 15 2255 1 1 9 . SG S 33.941 30.351 14.441 1.00 . A A . 9 DCY SG 1 1 15 2256 1 1 10 PRO C C 30.938 36.743 15.860 1.00 . A A . 10 PRO C 1 1 15 2257 1 1 10 PRO CA C 30.609 35.377 16.448 1.00 . A A . 10 PRO CA 1 1 15 2258 1 1 10 PRO CB C 30.071 35.533 17.865 1.00 . A A . 10 PRO CB 1 1 15 2259 1 1 10 PRO CD C 31.766 33.813 17.877 1.00 . A A . 10 PRO CD 1 1 15 2260 1 1 10 PRO CG C 30.440 34.207 18.535 1.00 . A A . 10 PRO CG 1 1 15 2261 1 1 10 PRO HA H 29.757 35.057 15.849 1.00 . A A . 10 PRO HA 1 1 15 2262 1 1 10 PRO HB2 H 30.579 36.386 18.305 1.00 . A A . 10 PRO HB2 1 1 15 2263 1 1 10 PRO HB3 H 28.983 35.677 17.852 1.00 . A A . 10 PRO HB3 1 1 15 2264 1 1 10 PRO HD2 H 32.656 34.207 18.352 1.00 . A A . 10 PRO HD2 1 1 15 2265 1 1 10 PRO HD3 H 31.782 32.718 17.935 1.00 . A A . 10 PRO HD3 1 1 15 2266 1 1 10 PRO HG2 H 30.643 34.203 19.603 1.00 . A A . 10 PRO HG2 1 1 15 2267 1 1 10 PRO HG3 H 29.712 33.471 18.187 1.00 . A A . 10 PRO HG3 1 1 15 2268 1 1 10 PRO N N 31.675 34.395 16.550 1.00 . A A . 10 PRO N 1 1 15 2269 1 1 10 PRO O O 31.908 37.438 16.169 1.00 . A A . 10 PRO O 1 1 15 2270 1 1 11 . C C 30.753 38.195 12.886 1.00 . A A . 11 DSN C 1 1 15 2271 1 1 11 . CA C 30.130 38.417 14.248 1.00 . A A . 11 DSN CA 1 1 15 2272 1 1 11 . CB C 28.710 38.908 13.975 1.00 . A A . 11 DSN CB 1 1 15 2273 1 1 11 . H H 29.314 36.557 14.654 1.00 . A A . 11 DSN H 1 1 15 2274 1 1 11 . HA H 30.624 39.189 14.847 1.00 . A A . 11 DSN HA 1 1 15 2275 1 1 11 . HB2 H 28.700 39.926 13.577 1.00 . A A . 11 DSN HB2 1 1 15 2276 1 1 11 . HB3 H 28.071 38.961 14.864 1.00 . A A . 11 DSN HB3 1 1 15 2277 1 1 11 . HG H 27.297 38.520 12.849 1.00 . A A . 11 DSN HG 1 1 15 2278 1 1 11 . N N 30.023 37.185 15.013 1.00 . A A . 11 DSN N 1 1 15 2279 1 1 11 . O O 31.080 39.119 12.147 1.00 . A A . 11 DSN O 1 1 15 2280 1 1 11 . OG O 28.095 38.029 13.071 1.00 . A A . 11 DSN OG 1 1 16 2281 1 1 1 DAL C C 33.131 37.200 11.275 1.00 . A A . 1 DAL C 1 1 16 2282 1 1 1 DAL CA C 31.769 36.565 11.476 1.00 . A A . 1 DAL CA 1 1 16 2283 1 1 1 DAL CB C 31.725 35.056 11.263 1.00 . A A . 1 DAL CB 1 1 16 2284 1 1 1 DAL H1 H 31.211 36.051 13.474 1.00 . A A . 1 DAL H1 1 1 16 2285 1 1 1 DAL HA H 31.071 36.904 10.703 1.00 . A A . 1 DAL HA 1 1 16 2286 1 1 1 DAL HB1 H 30.701 34.736 11.426 1.00 . A A . 1 DAL HB1 1 1 16 2287 1 1 1 DAL HB2 H 32.556 34.584 11.789 1.00 . A A . 1 DAL HB2 1 1 16 2288 1 1 1 DAL HB3 H 31.807 34.884 10.185 1.00 . A A . 1 DAL HB3 1 1 16 2289 1 1 1 DAL N N 31.148 36.780 12.773 1.00 . A A . 1 DAL N 1 1 16 2290 1 1 1 DAL O O 33.623 37.425 10.169 1.00 . A A . 1 DAL O 1 1 16 2291 1 1 2 GLN C C 36.011 36.453 12.325 1.00 . A A . 2 GLN C 1 1 16 2292 1 1 2 GLN CA C 35.201 37.734 12.466 1.00 . A A . 2 GLN CA 1 1 16 2293 1 1 2 GLN CB C 35.596 38.527 13.704 1.00 . A A . 2 GLN CB 1 1 16 2294 1 1 2 GLN CD C 35.624 40.794 12.676 1.00 . A A . 2 GLN CD 1 1 16 2295 1 1 2 GLN CG C 35.024 39.939 13.777 1.00 . A A . 2 GLN CG 1 1 16 2296 1 1 2 GLN H H 33.367 37.061 13.266 1.00 . A A . 2 GLN H 1 1 16 2297 1 1 2 GLN HA H 35.417 38.399 11.620 1.00 . A A . 2 GLN HA 1 1 16 2298 1 1 2 GLN HB2 H 35.313 37.895 14.537 1.00 . A A . 2 GLN HB2 1 1 16 2299 1 1 2 GLN HB3 H 36.683 38.614 13.844 1.00 . A A . 2 GLN HB3 1 1 16 2300 1 1 2 GLN HE21 H 33.833 41.357 11.972 1.00 . A A . 2 GLN HE21 1 1 16 2301 1 1 2 GLN HE22 H 35.152 42.257 11.283 1.00 . A A . 2 GLN HE22 1 1 16 2302 1 1 2 GLN HG2 H 33.961 39.796 13.571 1.00 . A A . 2 GLN HG2 1 1 16 2303 1 1 2 GLN HG3 H 35.253 40.362 14.753 1.00 . A A . 2 GLN HG3 1 1 16 2304 1 1 2 GLN N N 33.795 37.378 12.413 1.00 . A A . 2 GLN N 1 1 16 2305 1 1 2 GLN NE2 N 34.826 41.526 11.899 1.00 . A A . 2 GLN NE2 1 1 16 2306 1 1 2 GLN O O 35.810 35.564 13.149 1.00 . A A . 2 GLN O 1 1 16 2307 1 1 2 GLN OE1 O 36.840 40.907 12.541 1.00 . A A . 2 GLN OE1 1 1 16 2308 1 1 3 DPR C C 36.982 33.914 10.986 1.00 . A A . 3 DPR C 1 1 16 2309 1 1 3 DPR CA C 37.747 35.234 11.033 1.00 . A A . 3 DPR CA 1 1 16 2310 1 1 3 DPR CB C 38.351 35.583 9.684 1.00 . A A . 3 DPR CB 1 1 16 2311 1 1 3 DPR CD C 37.221 37.479 10.466 1.00 . A A . 3 DPR CD 1 1 16 2312 1 1 3 DPR CG C 38.576 37.079 9.865 1.00 . A A . 3 DPR CG 1 1 16 2313 1 1 3 DPR HA H 38.630 35.079 11.648 1.00 . A A . 3 DPR HA 1 1 16 2314 1 1 3 DPR HB2 H 37.657 35.468 8.850 1.00 . A A . 3 DPR HB2 1 1 16 2315 1 1 3 DPR HB3 H 39.262 35.006 9.511 1.00 . A A . 3 DPR HB3 1 1 16 2316 1 1 3 DPR HD2 H 36.513 37.511 9.637 1.00 . A A . 3 DPR HD2 1 1 16 2317 1 1 3 DPR HD3 H 37.306 38.452 10.947 1.00 . A A . 3 DPR HD3 1 1 16 2318 1 1 3 DPR HG2 H 38.691 37.511 8.868 1.00 . A A . 3 DPR HG2 1 1 16 2319 1 1 3 DPR HG3 H 39.399 37.292 10.538 1.00 . A A . 3 DPR HG3 1 1 16 2320 1 1 3 DPR N N 36.916 36.375 11.354 1.00 . A A . 3 DPR N 1 1 16 2321 1 1 3 DPR O O 35.854 33.769 10.524 1.00 . A A . 3 DPR O 1 1 16 2322 1 1 4 . C C 38.239 30.432 11.427 1.00 . A A . 4 DCY C 1 1 16 2323 1 1 4 . CA C 37.174 31.517 11.494 1.00 . A A . 4 DCY CA 1 1 16 2324 1 1 4 . CB C 36.315 31.345 12.749 1.00 . A A . 4 DCY CB 1 1 16 2325 1 1 4 . H H 38.573 32.940 11.900 1.00 . A A . 4 DCY H 1 1 16 2326 1 1 4 . HA H 36.570 31.410 10.590 1.00 . A A . 4 DCY HA 1 1 16 2327 1 1 4 . HB2 H 35.839 32.254 13.110 1.00 . A A . 4 DCY HB2 1 1 16 2328 1 1 4 . HB3 H 36.912 30.913 13.552 1.00 . A A . 4 DCY HB3 1 1 16 2329 1 1 4 . N N 37.635 32.888 11.538 1.00 . A A . 4 DCY N 1 1 16 2330 1 1 4 . O O 39.390 30.771 11.689 1.00 . A A . 4 DCY O 1 1 16 2331 1 1 4 . SG S 34.969 30.181 12.467 1.00 . A A . 4 DCY SG 1 1 16 2332 1 1 5 . C C 38.719 27.486 12.591 1.00 . A A . 5 DLY C 1 1 16 2333 1 1 5 . CA C 38.812 28.037 11.171 1.00 . A A . 5 DLY CA 1 1 16 2334 1 1 5 . CB C 38.429 26.984 10.146 1.00 . A A . 5 DLY CB 1 1 16 2335 1 1 5 . CD C 38.806 26.480 7.671 1.00 . A A . 5 DLY CD 1 1 16 2336 1 1 5 . CE C 39.512 25.146 7.893 1.00 . A A . 5 DLY CE 1 1 16 2337 1 1 5 . CG C 38.973 27.479 8.801 1.00 . A A . 5 DLY CG 1 1 16 2338 1 1 5 . H H 36.942 28.947 11.001 1.00 . A A . 5 DLY H 1 1 16 2339 1 1 5 . HA H 39.762 28.522 10.963 1.00 . A A . 5 DLY HA 1 1 16 2340 1 1 5 . HB2 H 37.355 26.790 10.061 1.00 . A A . 5 DLY HB2 1 1 16 2341 1 1 5 . HB3 H 38.987 26.069 10.338 1.00 . A A . 5 DLY HB3 1 1 16 2342 1 1 5 . HD2 H 39.204 26.948 6.774 1.00 . A A . 5 DLY HD2 1 1 16 2343 1 1 5 . HD3 H 37.721 26.427 7.543 1.00 . A A . 5 DLY HD3 1 1 16 2344 1 1 5 . HE2 H 39.311 24.828 8.924 1.00 . A A . 5 DLY HE2 1 1 16 2345 1 1 5 . HE3 H 40.567 25.408 7.858 1.00 . A A . 5 DLY HE3 1 1 16 2346 1 1 5 . HG2 H 40.025 27.764 8.883 1.00 . A A . 5 DLY HG2 1 1 16 2347 1 1 5 . HG3 H 38.441 28.408 8.592 1.00 . A A . 5 DLY HG3 1 1 16 2348 1 1 5 . HZ1 H 39.311 24.326 5.916 1.00 . A A . 5 DLY HZ1 1 1 16 2349 1 1 5 . HZ2 H 38.278 23.689 6.920 1.00 . A A . 5 DLY HZ2 1 1 16 2350 1 1 5 . HZ3 H 39.816 23.346 7.031 1.00 . A A . 5 DLY HZ3 1 1 16 2351 1 1 5 . N N 37.919 29.173 11.106 1.00 . A A . 5 DLY N 1 1 16 2352 1 1 5 . NZ N 39.193 24.122 6.893 1.00 . A A . 5 DLY NZ 1 1 16 2353 1 1 5 . O O 37.655 27.307 13.192 1.00 . A A . 5 DLY O 1 1 16 2354 1 1 6 ASP C C 39.850 28.084 15.584 1.00 . A A . 6 ASP C 1 1 16 2355 1 1 6 ASP CA C 40.072 26.971 14.569 1.00 . A A . 6 ASP CA 1 1 16 2356 1 1 6 ASP CB C 41.464 26.370 14.740 1.00 . A A . 6 ASP CB 1 1 16 2357 1 1 6 ASP CG C 41.733 25.179 13.836 1.00 . A A . 6 ASP CG 1 1 16 2358 1 1 6 ASP H H 40.722 27.744 12.711 1.00 . A A . 6 ASP H 1 1 16 2359 1 1 6 ASP HA H 39.310 26.252 14.841 1.00 . A A . 6 ASP HA 1 1 16 2360 1 1 6 ASP HB2 H 42.244 27.133 14.724 1.00 . A A . 6 ASP HB2 1 1 16 2361 1 1 6 ASP HB3 H 41.577 26.069 15.788 1.00 . A A . 6 ASP HB3 1 1 16 2362 1 1 6 ASP N N 39.899 27.427 13.203 1.00 . A A . 6 ASP N 1 1 16 2363 1 1 6 ASP O O 39.693 27.879 16.794 1.00 . A A . 6 ASP O 1 1 16 2364 1 1 6 ASP OD1 O 42.764 25.141 13.135 1.00 . A A . 6 ASP OD1 1 1 16 2365 1 1 6 ASP OD2 O 40.921 24.231 13.971 1.00 . A A . 6 ASP OD2 1 1 16 2366 1 1 7 SER C C 38.982 31.582 15.296 1.00 . A A . 7 SER C 1 1 16 2367 1 1 7 SER CA C 39.887 30.518 15.905 1.00 . A A . 7 SER CA 1 1 16 2368 1 1 7 SER CB C 41.346 30.966 15.966 1.00 . A A . 7 SER CB 1 1 16 2369 1 1 7 SER H H 39.747 29.580 14.118 1.00 . A A . 7 SER H 1 1 16 2370 1 1 7 SER HA H 39.484 30.358 16.905 1.00 . A A . 7 SER HA 1 1 16 2371 1 1 7 SER HB2 H 41.773 31.048 14.972 1.00 . A A . 7 SER HB2 1 1 16 2372 1 1 7 SER HB3 H 41.254 31.942 16.449 1.00 . A A . 7 SER HB3 1 1 16 2373 1 1 7 SER HG H 42.914 30.004 16.413 1.00 . A A . 7 SER HG 1 1 16 2374 1 1 7 SER N N 39.816 29.314 15.093 1.00 . A A . 7 SER N 1 1 16 2375 1 1 7 SER O O 39.104 31.799 14.091 1.00 . A A . 7 SER O 1 1 16 2376 1 1 7 SER OG O 42.035 30.051 16.792 1.00 . A A . 7 SER OG 1 1 16 2377 1 1 8 . C C 35.805 32.769 16.000 1.00 . A A . 8 DTY C 1 1 16 2378 1 1 8 . CA C 37.214 33.237 15.685 1.00 . A A . 8 DTY CA 1 1 16 2379 1 1 8 . CB C 37.443 34.560 16.397 1.00 . A A . 8 DTY CB 1 1 16 2380 1 1 8 . CD1 C 39.166 35.541 14.816 1.00 . A A . 8 DTY CD1 1 1 16 2381 1 1 8 . CD2 C 39.727 35.215 17.166 1.00 . A A . 8 DTY CD2 1 1 16 2382 1 1 8 . CE1 C 40.458 36.047 14.618 1.00 . A A . 8 DTY CE1 1 1 16 2383 1 1 8 . CE2 C 41.018 35.708 16.924 1.00 . A A . 8 DTY CE2 1 1 16 2384 1 1 8 . CG C 38.824 35.094 16.097 1.00 . A A . 8 DTY CG 1 1 16 2385 1 1 8 . CZ C 41.418 36.160 15.645 1.00 . A A . 8 DTY CZ 1 1 16 2386 1 1 8 . H H 38.297 32.073 17.111 1.00 . A A . 8 DTY H 1 1 16 2387 1 1 8 . HA H 37.290 33.357 14.600 1.00 . A A . 8 DTY HA 1 1 16 2388 1 1 8 . HB2 H 37.272 34.449 17.467 1.00 . A A . 8 DTY HB2 1 1 16 2389 1 1 8 . HB3 H 36.775 35.358 16.060 1.00 . A A . 8 DTY HB3 1 1 16 2390 1 1 8 . HD1 H 38.471 35.466 14.001 1.00 . A A . 8 DTY HD1 1 1 16 2391 1 1 8 . HD2 H 39.425 34.866 18.133 1.00 . A A . 8 DTY HD2 1 1 16 2392 1 1 8 . HE1 H 40.629 36.528 13.668 1.00 . A A . 8 DTY HE1 1 1 16 2393 1 1 8 . HE2 H 41.787 35.754 17.680 1.00 . A A . 8 DTY HE2 1 1 16 2394 1 1 8 . HH H 43.304 36.249 16.018 1.00 . A A . 8 DTY HH 1 1 16 2395 1 1 8 . N N 38.192 32.259 16.123 1.00 . A A . 8 DTY N 1 1 16 2396 1 1 8 . O O 35.635 32.005 16.946 1.00 . A A . 8 DTY O 1 1 16 2397 1 1 8 . OH O 42.701 36.471 15.296 1.00 . A A . 8 DTY OH 1 1 16 2398 1 1 9 . C C 32.412 34.010 15.420 1.00 . A A . 9 DCY C 1 1 16 2399 1 1 9 . CA C 33.436 32.896 15.268 1.00 . A A . 9 DCY CA 1 1 16 2400 1 1 9 . CB C 33.255 32.028 14.035 1.00 . A A . 9 DCY CB 1 1 16 2401 1 1 9 . H H 35.040 33.978 14.553 1.00 . A A . 9 DCY H 1 1 16 2402 1 1 9 . HA H 33.285 32.220 16.118 1.00 . A A . 9 DCY HA 1 1 16 2403 1 1 9 . HB2 H 33.777 32.581 13.246 1.00 . A A . 9 DCY HB2 1 1 16 2404 1 1 9 . HB3 H 32.198 32.021 13.755 1.00 . A A . 9 DCY HB3 1 1 16 2405 1 1 9 . N N 34.821 33.320 15.282 1.00 . A A . 9 DCY N 1 1 16 2406 1 1 9 . O O 31.745 34.299 14.427 1.00 . A A . 9 DCY O 1 1 16 2407 1 1 9 . SG S 33.801 30.303 14.138 1.00 . A A . 9 DCY SG 1 1 16 2408 1 1 10 PRO C C 31.089 36.736 15.954 1.00 . A A . 10 PRO C 1 1 16 2409 1 1 10 PRO CA C 31.212 35.574 16.937 1.00 . A A . 10 PRO CA 1 1 16 2410 1 1 10 PRO CB C 31.504 36.151 18.322 1.00 . A A . 10 PRO CB 1 1 16 2411 1 1 10 PRO CD C 33.078 34.489 17.774 1.00 . A A . 10 PRO CD 1 1 16 2412 1 1 10 PRO CG C 32.220 34.949 18.954 1.00 . A A . 10 PRO CG 1 1 16 2413 1 1 10 PRO HA H 30.278 35.021 16.882 1.00 . A A . 10 PRO HA 1 1 16 2414 1 1 10 PRO HB2 H 32.216 36.968 18.304 1.00 . A A . 10 PRO HB2 1 1 16 2415 1 1 10 PRO HB3 H 30.646 36.344 18.953 1.00 . A A . 10 PRO HB3 1 1 16 2416 1 1 10 PRO HD2 H 34.033 34.997 17.671 1.00 . A A . 10 PRO HD2 1 1 16 2417 1 1 10 PRO HD3 H 33.278 33.422 17.885 1.00 . A A . 10 PRO HD3 1 1 16 2418 1 1 10 PRO HG2 H 32.852 35.365 19.740 1.00 . A A . 10 PRO HG2 1 1 16 2419 1 1 10 PRO HG3 H 31.525 34.212 19.347 1.00 . A A . 10 PRO HG3 1 1 16 2420 1 1 10 PRO N N 32.269 34.647 16.583 1.00 . A A . 10 PRO N 1 1 16 2421 1 1 10 PRO O O 32.122 37.245 15.551 1.00 . A A . 10 PRO O 1 1 16 2422 1 1 11 . C C 30.456 37.861 13.113 1.00 . A A . 11 DSN C 1 1 16 2423 1 1 11 . CA C 29.646 37.998 14.396 1.00 . A A . 11 DSN CA 1 1 16 2424 1 1 11 . CB C 28.171 37.968 14.012 1.00 . A A . 11 DSN CB 1 1 16 2425 1 1 11 . H H 29.070 36.553 15.791 1.00 . A A . 11 DSN H 1 1 16 2426 1 1 11 . HA H 29.879 39.004 14.738 1.00 . A A . 11 DSN HA 1 1 16 2427 1 1 11 . HB2 H 27.728 36.981 13.960 1.00 . A A . 11 DSN HB2 1 1 16 2428 1 1 11 . HB3 H 28.051 38.358 12.994 1.00 . A A . 11 DSN HB3 1 1 16 2429 1 1 11 . HG H 26.584 38.272 15.035 1.00 . A A . 11 DSN HG 1 1 16 2430 1 1 11 . N N 29.887 37.049 15.471 1.00 . A A . 11 DSN N 1 1 16 2431 1 1 11 . O O 30.602 38.899 12.471 1.00 . A A . 11 DSN O 1 1 16 2432 1 1 11 . OG O 27.462 38.666 15.015 1.00 . A A . 11 DSN OG 1 1 17 2433 1 1 1 DAL C C 33.222 36.863 11.392 1.00 . A A . 1 DAL C 1 1 17 2434 1 1 1 DAL CA C 31.730 36.592 11.393 1.00 . A A . 1 DAL CA 1 1 17 2435 1 1 1 DAL CB C 31.389 35.190 10.896 1.00 . A A . 1 DAL CB 1 1 17 2436 1 1 1 DAL H1 H 30.687 35.915 13.110 1.00 . A A . 1 DAL H1 1 1 17 2437 1 1 1 DAL HA H 31.292 37.385 10.785 1.00 . A A . 1 DAL HA 1 1 17 2438 1 1 1 DAL HB1 H 30.335 34.930 11.042 1.00 . A A . 1 DAL HB1 1 1 17 2439 1 1 1 DAL HB2 H 31.920 34.412 11.455 1.00 . A A . 1 DAL HB2 1 1 17 2440 1 1 1 DAL HB3 H 31.565 35.029 9.831 1.00 . A A . 1 DAL HB3 1 1 17 2441 1 1 1 DAL N N 31.008 36.752 12.640 1.00 . A A . 1 DAL N 1 1 17 2442 1 1 1 DAL O O 33.926 36.972 10.386 1.00 . A A . 1 DAL O 1 1 17 2443 1 1 2 GLN C C 36.042 36.137 12.536 1.00 . A A . 2 GLN C 1 1 17 2444 1 1 2 GLN CA C 35.217 37.405 12.686 1.00 . A A . 2 GLN CA 1 1 17 2445 1 1 2 GLN CB C 35.413 38.081 14.035 1.00 . A A . 2 GLN CB 1 1 17 2446 1 1 2 GLN CD C 35.118 40.433 13.223 1.00 . A A . 2 GLN CD 1 1 17 2447 1 1 2 GLN CG C 34.579 39.359 14.158 1.00 . A A . 2 GLN CG 1 1 17 2448 1 1 2 GLN H H 33.366 36.803 13.447 1.00 . A A . 2 GLN H 1 1 17 2449 1 1 2 GLN HA H 35.415 38.190 11.950 1.00 . A A . 2 GLN HA 1 1 17 2450 1 1 2 GLN HB2 H 35.017 37.506 14.875 1.00 . A A . 2 GLN HB2 1 1 17 2451 1 1 2 GLN HB3 H 36.479 38.232 14.215 1.00 . A A . 2 GLN HB3 1 1 17 2452 1 1 2 GLN HE21 H 36.943 40.426 14.079 1.00 . A A . 2 GLN HE21 1 1 17 2453 1 1 2 GLN HE22 H 36.736 41.431 12.614 1.00 . A A . 2 GLN HE22 1 1 17 2454 1 1 2 GLN HG2 H 33.552 39.135 13.857 1.00 . A A . 2 GLN HG2 1 1 17 2455 1 1 2 GLN HG3 H 34.619 39.709 15.187 1.00 . A A . 2 GLN HG3 1 1 17 2456 1 1 2 GLN N N 33.812 37.044 12.569 1.00 . A A . 2 GLN N 1 1 17 2457 1 1 2 GLN NE2 N 36.406 40.773 13.302 1.00 . A A . 2 GLN NE2 1 1 17 2458 1 1 2 GLN O O 35.680 35.080 13.048 1.00 . A A . 2 GLN O 1 1 17 2459 1 1 2 GLN OE1 O 34.433 40.896 12.311 1.00 . A A . 2 GLN OE1 1 1 17 2460 1 1 3 DPR C C 37.523 34.047 10.954 1.00 . A A . 3 DPR C 1 1 17 2461 1 1 3 DPR CA C 38.169 35.264 11.600 1.00 . A A . 3 DPR CA 1 1 17 2462 1 1 3 DPR CB C 39.247 35.860 10.708 1.00 . A A . 3 DPR CB 1 1 17 2463 1 1 3 DPR CD C 37.740 37.571 11.435 1.00 . A A . 3 DPR CD 1 1 17 2464 1 1 3 DPR CG C 39.221 37.290 11.231 1.00 . A A . 3 DPR CG 1 1 17 2465 1 1 3 DPR HA H 38.730 35.068 12.510 1.00 . A A . 3 DPR HA 1 1 17 2466 1 1 3 DPR HB2 H 38.916 35.914 9.675 1.00 . A A . 3 DPR HB2 1 1 17 2467 1 1 3 DPR HB3 H 40.264 35.467 10.808 1.00 . A A . 3 DPR HB3 1 1 17 2468 1 1 3 DPR HD2 H 37.301 37.925 10.499 1.00 . A A . 3 DPR HD2 1 1 17 2469 1 1 3 DPR HD3 H 37.650 38.286 12.243 1.00 . A A . 3 DPR HD3 1 1 17 2470 1 1 3 DPR HG2 H 39.662 38.013 10.530 1.00 . A A . 3 DPR HG2 1 1 17 2471 1 1 3 DPR HG3 H 39.659 37.454 12.220 1.00 . A A . 3 DPR HG3 1 1 17 2472 1 1 3 DPR N N 37.197 36.306 11.877 1.00 . A A . 3 DPR N 1 1 17 2473 1 1 3 DPR O O 36.836 34.173 9.940 1.00 . A A . 3 DPR O 1 1 17 2474 1 1 4 . C C 38.084 30.439 11.284 1.00 . A A . 4 DCY C 1 1 17 2475 1 1 4 . CA C 37.124 31.617 11.234 1.00 . A A . 4 DCY CA 1 1 17 2476 1 1 4 . CB C 35.961 31.370 12.195 1.00 . A A . 4 DCY CB 1 1 17 2477 1 1 4 . H H 38.523 32.823 12.230 1.00 . A A . 4 DCY H 1 1 17 2478 1 1 4 . HA H 36.743 31.614 10.221 1.00 . A A . 4 DCY HA 1 1 17 2479 1 1 4 . HB2 H 35.577 32.358 12.431 1.00 . A A . 4 DCY HB2 1 1 17 2480 1 1 4 . HB3 H 36.386 30.931 13.102 1.00 . A A . 4 DCY HB3 1 1 17 2481 1 1 4 . N N 37.822 32.861 11.503 1.00 . A A . 4 DCY N 1 1 17 2482 1 1 4 . O O 39.259 30.598 11.600 1.00 . A A . 4 DCY O 1 1 17 2483 1 1 4 . SG S 34.533 30.416 11.630 1.00 . A A . 4 DCY SG 1 1 17 2484 1 1 5 . C C 38.383 27.963 12.936 1.00 . A A . 5 DLY C 1 1 17 2485 1 1 5 . CA C 38.145 27.990 11.430 1.00 . A A . 5 DLY CA 1 1 17 2486 1 1 5 . CB C 37.306 26.792 10.992 1.00 . A A . 5 DLY CB 1 1 17 2487 1 1 5 . CD C 36.930 25.348 8.895 1.00 . A A . 5 DLY CD 1 1 17 2488 1 1 5 . CE C 37.500 23.995 9.295 1.00 . A A . 5 DLY CE 1 1 17 2489 1 1 5 . CG C 37.439 26.665 9.475 1.00 . A A . 5 DLY CG 1 1 17 2490 1 1 5 . H H 36.566 29.263 10.733 1.00 . A A . 5 DLY H 1 1 17 2491 1 1 5 . HA H 39.140 27.813 11.030 1.00 . A A . 5 DLY HA 1 1 17 2492 1 1 5 . HB2 H 36.260 27.018 11.208 1.00 . A A . 5 DLY HB2 1 1 17 2493 1 1 5 . HB3 H 37.766 25.935 11.481 1.00 . A A . 5 DLY HB3 1 1 17 2494 1 1 5 . HD2 H 37.086 25.371 7.813 1.00 . A A . 5 DLY HD2 1 1 17 2495 1 1 5 . HD3 H 35.848 25.333 8.977 1.00 . A A . 5 DLY HD3 1 1 17 2496 1 1 5 . HE2 H 36.912 23.679 10.155 1.00 . A A . 5 DLY HE2 1 1 17 2497 1 1 5 . HE3 H 38.542 24.047 9.609 1.00 . A A . 5 DLY HE3 1 1 17 2498 1 1 5 . HG2 H 38.505 26.657 9.239 1.00 . A A . 5 DLY HG2 1 1 17 2499 1 1 5 . HG3 H 36.938 27.489 8.974 1.00 . A A . 5 DLY HG3 1 1 17 2500 1 1 5 . HZ1 H 37.762 23.336 7.302 1.00 . A A . 5 DLY HZ1 1 1 17 2501 1 1 5 . HZ2 H 36.468 22.771 7.916 1.00 . A A . 5 DLY HZ2 1 1 17 2502 1 1 5 . HZ3 H 37.906 22.202 8.473 1.00 . A A . 5 DLY HZ3 1 1 17 2503 1 1 5 . N N 37.527 29.242 11.064 1.00 . A A . 5 DLY N 1 1 17 2504 1 1 5 . NZ N 37.399 23.033 8.196 1.00 . A A . 5 DLY NZ 1 1 17 2505 1 1 5 . O O 37.456 28.291 13.677 1.00 . A A . 5 DLY O 1 1 17 2506 1 1 6 ASP C C 39.746 28.695 15.645 1.00 . A A . 6 ASP C 1 1 17 2507 1 1 6 ASP CA C 39.715 27.384 14.872 1.00 . A A . 6 ASP CA 1 1 17 2508 1 1 6 ASP CB C 40.798 26.407 15.321 1.00 . A A . 6 ASP CB 1 1 17 2509 1 1 6 ASP CG C 40.855 25.050 14.638 1.00 . A A . 6 ASP CG 1 1 17 2510 1 1 6 ASP H H 40.157 27.045 12.816 1.00 . A A . 6 ASP H 1 1 17 2511 1 1 6 ASP HA H 38.784 26.942 15.242 1.00 . A A . 6 ASP HA 1 1 17 2512 1 1 6 ASP HB2 H 41.718 26.919 15.049 1.00 . A A . 6 ASP HB2 1 1 17 2513 1 1 6 ASP HB3 H 40.735 26.277 16.405 1.00 . A A . 6 ASP HB3 1 1 17 2514 1 1 6 ASP N N 39.535 27.529 13.443 1.00 . A A . 6 ASP N 1 1 17 2515 1 1 6 ASP O O 39.303 28.693 16.787 1.00 . A A . 6 ASP O 1 1 17 2516 1 1 6 ASP OD1 O 39.911 24.754 13.871 1.00 . A A . 6 ASP OD1 1 1 17 2517 1 1 6 ASP OD2 O 41.862 24.315 14.693 1.00 . A A . 6 ASP OD2 1 1 17 2518 1 1 7 SER C C 39.245 32.005 14.975 1.00 . A A . 7 SER C 1 1 17 2519 1 1 7 SER CA C 40.283 31.047 15.543 1.00 . A A . 7 SER CA 1 1 17 2520 1 1 7 SER CB C 41.669 31.673 15.391 1.00 . A A . 7 SER CB 1 1 17 2521 1 1 7 SER H H 40.564 29.624 14.005 1.00 . A A . 7 SER H 1 1 17 2522 1 1 7 SER HA H 40.172 31.023 16.632 1.00 . A A . 7 SER HA 1 1 17 2523 1 1 7 SER HB2 H 41.804 31.851 14.321 1.00 . A A . 7 SER HB2 1 1 17 2524 1 1 7 SER HB3 H 41.696 32.667 15.851 1.00 . A A . 7 SER HB3 1 1 17 2525 1 1 7 SER HG H 43.458 31.377 15.917 1.00 . A A . 7 SER HG 1 1 17 2526 1 1 7 SER N N 40.265 29.722 14.961 1.00 . A A . 7 SER N 1 1 17 2527 1 1 7 SER O O 39.484 32.563 13.912 1.00 . A A . 7 SER O 1 1 17 2528 1 1 7 SER OG O 42.657 30.843 15.939 1.00 . A A . 7 SER OG 1 1 17 2529 1 1 8 . C C 35.775 32.497 15.517 1.00 . A A . 8 DTY C 1 1 17 2530 1 1 8 . CA C 37.145 33.146 15.420 1.00 . A A . 8 DTY CA 1 1 17 2531 1 1 8 . CB C 37.154 34.245 16.472 1.00 . A A . 8 DTY CB 1 1 17 2532 1 1 8 . CD1 C 38.827 35.831 15.463 1.00 . A A . 8 DTY CD1 1 1 17 2533 1 1 8 . CD2 C 39.100 35.085 17.790 1.00 . A A . 8 DTY CD2 1 1 17 2534 1 1 8 . CE1 C 40.017 36.559 15.518 1.00 . A A . 8 DTY CE1 1 1 17 2535 1 1 8 . CE2 C 40.304 35.799 17.836 1.00 . A A . 8 DTY CE2 1 1 17 2536 1 1 8 . CG C 38.418 35.066 16.564 1.00 . A A . 8 DTY CG 1 1 17 2537 1 1 8 . CZ C 40.671 36.631 16.761 1.00 . A A . 8 DTY CZ 1 1 17 2538 1 1 8 . H H 38.193 31.936 16.755 1.00 . A A . 8 DTY H 1 1 17 2539 1 1 8 . HA H 37.254 33.569 14.422 1.00 . A A . 8 DTY HA 1 1 17 2540 1 1 8 . HB2 H 37.061 33.829 17.485 1.00 . A A . 8 DTY HB2 1 1 17 2541 1 1 8 . HB3 H 36.377 34.965 16.217 1.00 . A A . 8 DTY HB3 1 1 17 2542 1 1 8 . HD1 H 38.208 35.931 14.587 1.00 . A A . 8 DTY HD1 1 1 17 2543 1 1 8 . HD2 H 38.815 34.482 18.638 1.00 . A A . 8 DTY HD2 1 1 17 2544 1 1 8 . HE1 H 40.321 37.175 14.680 1.00 . A A . 8 DTY HE1 1 1 17 2545 1 1 8 . HE2 H 40.889 35.759 18.751 1.00 . A A . 8 DTY HE2 1 1 17 2546 1 1 8 . HH H 42.106 37.454 17.805 1.00 . A A . 8 DTY HH 1 1 17 2547 1 1 8 . N N 38.207 32.234 15.787 1.00 . A A . 8 DTY N 1 1 17 2548 1 1 8 . O O 35.506 31.569 16.272 1.00 . A A . 8 DTY O 1 1 17 2549 1 1 8 . OH O 41.789 37.397 16.910 1.00 . A A . 8 DTY OH 1 1 17 2550 1 1 9 . C C 32.595 33.896 15.172 1.00 . A A . 9 DCY C 1 1 17 2551 1 1 9 . CA C 33.427 32.640 14.924 1.00 . A A . 9 DCY CA 1 1 17 2552 1 1 9 . CB C 33.001 31.892 13.667 1.00 . A A . 9 DCY CB 1 1 17 2553 1 1 9 . H H 35.114 33.804 14.170 1.00 . A A . 9 DCY H 1 1 17 2554 1 1 9 . HA H 33.381 31.972 15.785 1.00 . A A . 9 DCY HA 1 1 17 2555 1 1 9 . HB2 H 33.310 32.382 12.742 1.00 . A A . 9 DCY HB2 1 1 17 2556 1 1 9 . HB3 H 31.913 31.768 13.693 1.00 . A A . 9 DCY HB3 1 1 17 2557 1 1 9 . N N 34.820 33.038 14.760 1.00 . A A . 9 DCY N 1 1 17 2558 1 1 9 . O O 31.989 34.389 14.220 1.00 . A A . 9 DCY O 1 1 17 2559 1 1 9 . SG S 33.721 30.246 13.496 1.00 . A A . 9 DCY SG 1 1 17 2560 1 1 10 PRO C C 31.352 36.568 15.890 1.00 . A A . 10 PRO C 1 1 17 2561 1 1 10 PRO CA C 31.466 35.360 16.818 1.00 . A A . 10 PRO CA 1 1 17 2562 1 1 10 PRO CB C 31.719 35.679 18.291 1.00 . A A . 10 PRO CB 1 1 17 2563 1 1 10 PRO CD C 33.288 34.028 17.537 1.00 . A A . 10 PRO CD 1 1 17 2564 1 1 10 PRO CG C 32.522 34.480 18.771 1.00 . A A . 10 PRO CG 1 1 17 2565 1 1 10 PRO HA H 30.549 34.776 16.833 1.00 . A A . 10 PRO HA 1 1 17 2566 1 1 10 PRO HB2 H 32.324 36.585 18.359 1.00 . A A . 10 PRO HB2 1 1 17 2567 1 1 10 PRO HB3 H 30.809 35.857 18.855 1.00 . A A . 10 PRO HB3 1 1 17 2568 1 1 10 PRO HD2 H 34.271 34.467 17.359 1.00 . A A . 10 PRO HD2 1 1 17 2569 1 1 10 PRO HD3 H 33.468 32.952 17.504 1.00 . A A . 10 PRO HD3 1 1 17 2570 1 1 10 PRO HG2 H 33.240 34.680 19.569 1.00 . A A . 10 PRO HG2 1 1 17 2571 1 1 10 PRO HG3 H 31.876 33.672 19.123 1.00 . A A . 10 PRO HG3 1 1 17 2572 1 1 10 PRO N N 32.508 34.445 16.382 1.00 . A A . 10 PRO N 1 1 17 2573 1 1 10 PRO O O 32.318 37.261 15.598 1.00 . A A . 10 PRO O 1 1 17 2574 1 1 11 . C C 30.566 37.888 13.198 1.00 . A A . 11 DSN C 1 1 17 2575 1 1 11 . CA C 29.750 37.833 14.480 1.00 . A A . 11 DSN CA 1 1 17 2576 1 1 11 . CB C 28.250 37.757 14.214 1.00 . A A . 11 DSN CB 1 1 17 2577 1 1 11 . H H 29.500 35.991 15.571 1.00 . A A . 11 DSN H 1 1 17 2578 1 1 11 . HA H 29.978 38.734 15.050 1.00 . A A . 11 DSN HA 1 1 17 2579 1 1 11 . HB2 H 28.005 36.755 13.864 1.00 . A A . 11 DSN HB2 1 1 17 2580 1 1 11 . HB3 H 27.963 38.589 13.567 1.00 . A A . 11 DSN HB3 1 1 17 2581 1 1 11 . HG H 26.674 37.509 15.326 1.00 . A A . 11 DSN HG 1 1 17 2582 1 1 11 . N N 30.150 36.736 15.344 1.00 . A A . 11 DSN N 1 1 17 2583 1 1 11 . O O 30.711 38.988 12.676 1.00 . A A . 11 DSN O 1 1 17 2584 1 1 11 . OG O 27.542 37.907 15.423 1.00 . A A . 11 DSN OG 1 1 18 2585 1 1 1 DAL C C 32.842 36.802 11.220 1.00 . A A . 1 DAL C 1 1 18 2586 1 1 1 DAL CA C 31.377 36.398 11.237 1.00 . A A . 1 DAL CA 1 1 18 2587 1 1 1 DAL CB C 31.039 34.921 11.024 1.00 . A A . 1 DAL CB 1 1 18 2588 1 1 1 DAL H1 H 30.759 35.897 13.180 1.00 . A A . 1 DAL H1 1 1 18 2589 1 1 1 DAL HA H 30.890 36.941 10.434 1.00 . A A . 1 DAL HA 1 1 18 2590 1 1 1 DAL HB1 H 31.671 34.301 11.664 1.00 . A A . 1 DAL HB1 1 1 18 2591 1 1 1 DAL HB2 H 31.228 34.606 10.000 1.00 . A A . 1 DAL HB2 1 1 18 2592 1 1 1 DAL HB3 H 30.007 34.641 11.232 1.00 . A A . 1 DAL HB3 1 1 18 2593 1 1 1 DAL N N 30.735 36.648 12.514 1.00 . A A . 1 DAL N 1 1 18 2594 1 1 1 DAL O O 33.363 37.004 10.127 1.00 . A A . 1 DAL O 1 1 18 2595 1 1 2 GLN C C 35.787 36.215 12.545 1.00 . A A . 2 GLN C 1 1 18 2596 1 1 2 GLN CA C 34.883 37.435 12.510 1.00 . A A . 2 GLN CA 1 1 18 2597 1 1 2 GLN CB C 35.082 38.336 13.724 1.00 . A A . 2 GLN CB 1 1 18 2598 1 1 2 GLN CD C 34.152 40.137 15.258 1.00 . A A . 2 GLN CD 1 1 18 2599 1 1 2 GLN CG C 34.150 39.537 13.861 1.00 . A A . 2 GLN CG 1 1 18 2600 1 1 2 GLN H H 33.017 36.732 13.191 1.00 . A A . 2 GLN H 1 1 18 2601 1 1 2 GLN HA H 35.102 37.915 11.549 1.00 . A A . 2 GLN HA 1 1 18 2602 1 1 2 GLN HB2 H 35.000 37.760 14.654 1.00 . A A . 2 GLN HB2 1 1 18 2603 1 1 2 GLN HB3 H 36.125 38.652 13.709 1.00 . A A . 2 GLN HB3 1 1 18 2604 1 1 2 GLN HE21 H 32.491 39.219 15.830 1.00 . A A . 2 GLN HE21 1 1 18 2605 1 1 2 GLN HE22 H 33.254 40.205 17.060 1.00 . A A . 2 GLN HE22 1 1 18 2606 1 1 2 GLN HG2 H 34.496 40.260 13.120 1.00 . A A . 2 GLN HG2 1 1 18 2607 1 1 2 GLN HG3 H 33.099 39.299 13.750 1.00 . A A . 2 GLN HG3 1 1 18 2608 1 1 2 GLN N N 33.527 36.967 12.352 1.00 . A A . 2 GLN N 1 1 18 2609 1 1 2 GLN NE2 N 33.129 39.958 16.097 1.00 . A A . 2 GLN NE2 1 1 18 2610 1 1 2 GLN O O 35.415 35.210 13.144 1.00 . A A . 2 GLN O 1 1 18 2611 1 1 2 GLN OE1 O 34.995 40.949 15.649 1.00 . A A . 2 GLN OE1 1 1 18 2612 1 1 3 DPR C C 37.338 33.814 11.056 1.00 . A A . 3 DPR C 1 1 18 2613 1 1 3 DPR CA C 37.769 34.984 11.921 1.00 . A A . 3 DPR CA 1 1 18 2614 1 1 3 DPR CB C 39.242 35.307 11.669 1.00 . A A . 3 DPR CB 1 1 18 2615 1 1 3 DPR CD C 37.662 37.243 11.249 1.00 . A A . 3 DPR CD 1 1 18 2616 1 1 3 DPR CG C 39.046 36.648 10.981 1.00 . A A . 3 DPR CG 1 1 18 2617 1 1 3 DPR HA H 37.774 34.610 12.952 1.00 . A A . 3 DPR HA 1 1 18 2618 1 1 3 DPR HB2 H 39.792 34.677 10.966 1.00 . A A . 3 DPR HB2 1 1 18 2619 1 1 3 DPR HB3 H 39.786 35.619 12.560 1.00 . A A . 3 DPR HB3 1 1 18 2620 1 1 3 DPR HD2 H 37.194 37.561 10.314 1.00 . A A . 3 DPR HD2 1 1 18 2621 1 1 3 DPR HD3 H 37.656 38.153 11.849 1.00 . A A . 3 DPR HD3 1 1 18 2622 1 1 3 DPR HG2 H 39.109 36.367 9.930 1.00 . A A . 3 DPR HG2 1 1 18 2623 1 1 3 DPR HG3 H 39.862 37.311 11.286 1.00 . A A . 3 DPR HG3 1 1 18 2624 1 1 3 DPR N N 36.922 36.155 11.843 1.00 . A A . 3 DPR N 1 1 18 2625 1 1 3 DPR O O 37.064 34.038 9.880 1.00 . A A . 3 DPR O 1 1 18 2626 1 1 4 . C C 38.017 30.206 11.252 1.00 . A A . 4 DCY C 1 1 18 2627 1 1 4 . CA C 37.203 31.405 10.788 1.00 . A A . 4 DCY CA 1 1 18 2628 1 1 4 . CB C 35.727 31.029 10.783 1.00 . A A . 4 DCY CB 1 1 18 2629 1 1 4 . H H 37.750 32.467 12.534 1.00 . A A . 4 DCY H 1 1 18 2630 1 1 4 . HA H 37.438 31.590 9.738 1.00 . A A . 4 DCY HA 1 1 18 2631 1 1 4 . HB2 H 35.548 30.331 9.978 1.00 . A A . 4 DCY HB2 1 1 18 2632 1 1 4 . HB3 H 35.147 31.937 10.625 1.00 . A A . 4 DCY HB3 1 1 18 2633 1 1 4 . N N 37.417 32.597 11.593 1.00 . A A . 4 DCY N 1 1 18 2634 1 1 4 . O O 38.819 30.371 12.167 1.00 . A A . 4 DCY O 1 1 18 2635 1 1 4 . SG S 35.039 30.242 12.261 1.00 . A A . 4 DCY SG 1 1 18 2636 1 1 5 . C C 38.456 27.470 12.226 1.00 . A A . 5 DLY C 1 1 18 2637 1 1 5 . CA C 38.780 27.927 10.810 1.00 . A A . 5 DLY CA 1 1 18 2638 1 1 5 . CB C 38.598 26.756 9.843 1.00 . A A . 5 DLY CB 1 1 18 2639 1 1 5 . CD C 39.567 24.562 8.980 1.00 . A A . 5 DLY CD 1 1 18 2640 1 1 5 . CE C 39.322 23.324 9.849 1.00 . A A . 5 DLY CE 1 1 18 2641 1 1 5 . CG C 39.797 25.819 9.824 1.00 . A A . 5 DLY CG 1 1 18 2642 1 1 5 . H H 37.574 29.163 9.576 1.00 . A A . 5 DLY H 1 1 18 2643 1 1 5 . HA H 39.852 28.063 10.897 1.00 . A A . 5 DLY HA 1 1 18 2644 1 1 5 . HB2 H 38.526 27.128 8.823 1.00 . A A . 5 DLY HB2 1 1 18 2645 1 1 5 . HB3 H 37.699 26.203 10.133 1.00 . A A . 5 DLY HB3 1 1 18 2646 1 1 5 . HD2 H 40.409 24.403 8.315 1.00 . A A . 5 DLY HD2 1 1 18 2647 1 1 5 . HD3 H 38.626 24.643 8.436 1.00 . A A . 5 DLY HD3 1 1 18 2648 1 1 5 . HE2 H 39.014 22.544 9.152 1.00 . A A . 5 DLY HE2 1 1 18 2649 1 1 5 . HE3 H 38.482 23.507 10.521 1.00 . A A . 5 DLY HE3 1 1 18 2650 1 1 5 . HG2 H 40.073 25.543 10.848 1.00 . A A . 5 DLY HG2 1 1 18 2651 1 1 5 . HG3 H 40.610 26.386 9.368 1.00 . A A . 5 DLY HG3 1 1 18 2652 1 1 5 . HZ1 H 41.134 23.605 10.789 1.00 . A A . 5 DLY HZ1 1 1 18 2653 1 1 5 . HZ2 H 41.125 22.214 10.074 1.00 . A A . 5 DLY HZ2 1 1 18 2654 1 1 5 . HZ3 H 40.215 22.377 11.409 1.00 . A A . 5 DLY HZ3 1 1 18 2655 1 1 5 . N N 37.994 29.103 10.499 1.00 . A A . 5 DLY N 1 1 18 2656 1 1 5 . NZ N 40.509 22.849 10.563 1.00 . A A . 5 DLY NZ 1 1 18 2657 1 1 5 . O O 37.405 26.927 12.543 1.00 . A A . 5 DLY O 1 1 18 2658 1 1 6 ASP C C 39.402 28.239 15.607 1.00 . A A . 6 ASP C 1 1 18 2659 1 1 6 ASP CA C 39.444 27.179 14.507 1.00 . A A . 6 ASP CA 1 1 18 2660 1 1 6 ASP CB C 40.631 26.251 14.767 1.00 . A A . 6 ASP CB 1 1 18 2661 1 1 6 ASP CG C 42.022 26.847 14.586 1.00 . A A . 6 ASP CG 1 1 18 2662 1 1 6 ASP H H 40.325 27.972 12.828 1.00 . A A . 6 ASP H 1 1 18 2663 1 1 6 ASP HA H 38.610 26.537 14.779 1.00 . A A . 6 ASP HA 1 1 18 2664 1 1 6 ASP HB2 H 40.563 25.839 15.775 1.00 . A A . 6 ASP HB2 1 1 18 2665 1 1 6 ASP HB3 H 40.537 25.438 14.047 1.00 . A A . 6 ASP HB3 1 1 18 2666 1 1 6 ASP N N 39.428 27.624 13.129 1.00 . A A . 6 ASP N 1 1 18 2667 1 1 6 ASP O O 39.054 28.037 16.770 1.00 . A A . 6 ASP O 1 1 18 2668 1 1 6 ASP OD1 O 42.332 27.914 15.166 1.00 . A A . 6 ASP OD1 1 1 18 2669 1 1 6 ASP OD2 O 42.789 26.369 13.727 1.00 . A A . 6 ASP OD2 1 1 18 2670 1 1 7 SER C C 39.092 31.757 15.516 1.00 . A A . 7 SER C 1 1 18 2671 1 1 7 SER CA C 39.978 30.608 15.960 1.00 . A A . 7 SER CA 1 1 18 2672 1 1 7 SER CB C 41.438 30.992 15.756 1.00 . A A . 7 SER CB 1 1 18 2673 1 1 7 SER H H 40.066 29.499 14.194 1.00 . A A . 7 SER H 1 1 18 2674 1 1 7 SER HA H 39.786 30.446 17.024 1.00 . A A . 7 SER HA 1 1 18 2675 1 1 7 SER HB2 H 41.660 31.125 14.697 1.00 . A A . 7 SER HB2 1 1 18 2676 1 1 7 SER HB3 H 41.491 31.947 16.266 1.00 . A A . 7 SER HB3 1 1 18 2677 1 1 7 SER HG H 42.218 29.272 15.979 1.00 . A A . 7 SER HG 1 1 18 2678 1 1 7 SER N N 39.699 29.451 15.128 1.00 . A A . 7 SER N 1 1 18 2679 1 1 7 SER O O 39.042 32.223 14.379 1.00 . A A . 7 SER O 1 1 18 2680 1 1 7 SER OG O 42.336 30.116 16.411 1.00 . A A . 7 SER OG 1 1 18 2681 1 1 8 . C C 36.197 33.299 16.476 1.00 . A A . 8 DTY C 1 1 18 2682 1 1 8 . CA C 37.684 33.594 16.340 1.00 . A A . 8 DTY CA 1 1 18 2683 1 1 8 . CB C 38.125 34.664 17.333 1.00 . A A . 8 DTY CB 1 1 18 2684 1 1 8 . CD1 C 38.954 36.577 15.919 1.00 . A A . 8 DTY CD1 1 1 18 2685 1 1 8 . CD2 C 37.088 36.989 17.370 1.00 . A A . 8 DTY CD2 1 1 18 2686 1 1 8 . CE1 C 38.907 37.921 15.512 1.00 . A A . 8 DTY CE1 1 1 18 2687 1 1 8 . CE2 C 37.085 38.354 17.041 1.00 . A A . 8 DTY CE2 1 1 18 2688 1 1 8 . CG C 38.020 36.093 16.837 1.00 . A A . 8 DTY CG 1 1 18 2689 1 1 8 . CZ C 37.988 38.835 16.070 1.00 . A A . 8 DTY CZ 1 1 18 2690 1 1 8 . H H 38.502 31.929 17.414 1.00 . A A . 8 DTY H 1 1 18 2691 1 1 8 . HA H 37.937 33.935 15.336 1.00 . A A . 8 DTY HA 1 1 18 2692 1 1 8 . HB2 H 39.173 34.477 17.582 1.00 . A A . 8 DTY HB2 1 1 18 2693 1 1 8 . HB3 H 37.497 34.444 18.198 1.00 . A A . 8 DTY HB3 1 1 18 2694 1 1 8 . HD1 H 39.759 36.019 15.463 1.00 . A A . 8 DTY HD1 1 1 18 2695 1 1 8 . HD2 H 36.411 36.611 18.114 1.00 . A A . 8 DTY HD2 1 1 18 2696 1 1 8 . HE1 H 39.646 38.286 14.813 1.00 . A A . 8 DTY HE1 1 1 18 2697 1 1 8 . HE2 H 36.333 38.974 17.502 1.00 . A A . 8 DTY HE2 1 1 18 2698 1 1 8 . HH H 37.398 40.762 16.146 1.00 . A A . 8 DTY HH 1 1 18 2699 1 1 8 . N N 38.413 32.346 16.500 1.00 . A A . 8 DTY N 1 1 18 2700 1 1 8 . O O 35.796 32.677 17.453 1.00 . A A . 8 DTY O 1 1 18 2701 1 1 8 . OH O 38.021 40.152 15.736 1.00 . A A . 8 DTY OH 1 1 18 2702 1 1 9 . C C 32.959 34.258 15.372 1.00 . A A . 9 DCY C 1 1 18 2703 1 1 9 . CA C 34.043 33.193 15.314 1.00 . A A . 9 DCY CA 1 1 18 2704 1 1 9 . CB C 34.069 32.378 14.024 1.00 . A A . 9 DCY CB 1 1 18 2705 1 1 9 . H H 35.736 34.375 14.842 1.00 . A A . 9 DCY H 1 1 18 2706 1 1 9 . HA H 33.736 32.501 16.101 1.00 . A A . 9 DCY HA 1 1 18 2707 1 1 9 . HB2 H 34.115 33.103 13.201 1.00 . A A . 9 DCY HB2 1 1 18 2708 1 1 9 . HB3 H 33.152 31.817 13.844 1.00 . A A . 9 DCY HB3 1 1 18 2709 1 1 9 . N N 35.376 33.714 15.514 1.00 . A A . 9 DCY N 1 1 18 2710 1 1 9 . O O 32.327 34.525 14.349 1.00 . A A . 9 DCY O 1 1 18 2711 1 1 9 . SG S 35.521 31.305 13.943 1.00 . A A . 9 DCY SG 1 1 18 2712 1 1 10 PRO C C 31.214 36.678 15.604 1.00 . A A . 10 PRO C 1 1 18 2713 1 1 10 PRO CA C 31.497 35.712 16.738 1.00 . A A . 10 PRO CA 1 1 18 2714 1 1 10 PRO CB C 31.653 36.476 18.051 1.00 . A A . 10 PRO CB 1 1 18 2715 1 1 10 PRO CD C 33.578 35.039 17.636 1.00 . A A . 10 PRO CD 1 1 18 2716 1 1 10 PRO CG C 33.135 36.292 18.391 1.00 . A A . 10 PRO CG 1 1 18 2717 1 1 10 PRO HA H 30.638 35.050 16.862 1.00 . A A . 10 PRO HA 1 1 18 2718 1 1 10 PRO HB2 H 31.384 37.537 17.939 1.00 . A A . 10 PRO HB2 1 1 18 2719 1 1 10 PRO HB3 H 30.947 36.072 18.776 1.00 . A A . 10 PRO HB3 1 1 18 2720 1 1 10 PRO HD2 H 34.591 35.280 17.301 1.00 . A A . 10 PRO HD2 1 1 18 2721 1 1 10 PRO HD3 H 33.479 34.156 18.266 1.00 . A A . 10 PRO HD3 1 1 18 2722 1 1 10 PRO HG2 H 33.744 37.164 18.169 1.00 . A A . 10 PRO HG2 1 1 18 2723 1 1 10 PRO HG3 H 33.245 36.154 19.459 1.00 . A A . 10 PRO HG3 1 1 18 2724 1 1 10 PRO N N 32.720 34.975 16.480 1.00 . A A . 10 PRO N 1 1 18 2725 1 1 10 PRO O O 32.086 37.445 15.206 1.00 . A A . 10 PRO O 1 1 18 2726 1 1 11 . C C 30.117 37.772 12.878 1.00 . A A . 11 DSN C 1 1 18 2727 1 1 11 . CA C 29.511 37.845 14.276 1.00 . A A . 11 DSN CA 1 1 18 2728 1 1 11 . CB C 27.994 37.969 14.275 1.00 . A A . 11 DSN CB 1 1 18 2729 1 1 11 . H H 29.361 35.963 15.263 1.00 . A A . 11 DSN H 1 1 18 2730 1 1 11 . HA H 29.977 38.740 14.682 1.00 . A A . 11 DSN HA 1 1 18 2731 1 1 11 . HB2 H 27.517 37.304 13.552 1.00 . A A . 11 DSN HB2 1 1 18 2732 1 1 11 . HB3 H 27.782 38.964 13.888 1.00 . A A . 11 DSN HB3 1 1 18 2733 1 1 11 . HG H 27.612 38.962 15.814 1.00 . A A . 11 DSN HG 1 1 18 2734 1 1 11 . N N 29.983 36.739 15.093 1.00 . A A . 11 DSN N 1 1 18 2735 1 1 11 . O O 30.036 38.733 12.114 1.00 . A A . 11 DSN O 1 1 18 2736 1 1 11 . OG O 27.508 38.029 15.593 1.00 . A A . 11 DSN OG 1 1 19 2737 1 1 1 DAL C C 33.191 35.723 11.572 1.00 . A A . 1 DAL C 1 1 19 2738 1 1 1 DAL CA C 31.686 35.571 11.565 1.00 . A A . 1 DAL CA 1 1 19 2739 1 1 1 DAL CB C 31.259 34.142 11.239 1.00 . A A . 1 DAL CB 1 1 19 2740 1 1 1 DAL H1 H 30.973 35.437 13.588 1.00 . A A . 1 DAL H1 1 1 19 2741 1 1 1 DAL HA H 31.459 36.228 10.719 1.00 . A A . 1 DAL HA 1 1 19 2742 1 1 1 DAL HB1 H 31.579 33.444 12.013 1.00 . A A . 1 DAL HB1 1 1 19 2743 1 1 1 DAL HB2 H 31.697 33.860 10.286 1.00 . A A . 1 DAL HB2 1 1 19 2744 1 1 1 DAL HB3 H 30.173 33.997 11.167 1.00 . A A . 1 DAL HB3 1 1 19 2745 1 1 1 DAL N N 31.026 36.036 12.773 1.00 . A A . 1 DAL N 1 1 19 2746 1 1 1 DAL O O 33.843 35.356 10.598 1.00 . A A . 1 DAL O 1 1 19 2747 1 1 2 GLN C C 36.162 36.017 12.653 1.00 . A A . 2 GLN C 1 1 19 2748 1 1 2 GLN CA C 35.062 37.042 12.465 1.00 . A A . 2 GLN CA 1 1 19 2749 1 1 2 GLN CB C 35.297 38.184 13.448 1.00 . A A . 2 GLN CB 1 1 19 2750 1 1 2 GLN CD C 34.311 40.251 14.447 1.00 . A A . 2 GLN CD 1 1 19 2751 1 1 2 GLN CG C 34.312 39.330 13.243 1.00 . A A . 2 GLN CG 1 1 19 2752 1 1 2 GLN H H 33.242 36.466 13.432 1.00 . A A . 2 GLN H 1 1 19 2753 1 1 2 GLN HA H 35.237 37.421 11.460 1.00 . A A . 2 GLN HA 1 1 19 2754 1 1 2 GLN HB2 H 35.280 37.745 14.453 1.00 . A A . 2 GLN HB2 1 1 19 2755 1 1 2 GLN HB3 H 36.238 38.702 13.294 1.00 . A A . 2 GLN HB3 1 1 19 2756 1 1 2 GLN HE21 H 32.956 39.098 15.410 1.00 . A A . 2 GLN HE21 1 1 19 2757 1 1 2 GLN HE22 H 33.336 40.486 16.302 1.00 . A A . 2 GLN HE22 1 1 19 2758 1 1 2 GLN HG2 H 34.370 39.892 12.308 1.00 . A A . 2 GLN HG2 1 1 19 2759 1 1 2 GLN HG3 H 33.298 38.929 13.265 1.00 . A A . 2 GLN HG3 1 1 19 2760 1 1 2 GLN N N 33.781 36.377 12.575 1.00 . A A . 2 GLN N 1 1 19 2761 1 1 2 GLN NE2 N 33.477 39.960 15.448 1.00 . A A . 2 GLN NE2 1 1 19 2762 1 1 2 GLN O O 35.871 35.026 13.318 1.00 . A A . 2 GLN O 1 1 19 2763 1 1 2 GLN OE1 O 35.040 41.231 14.543 1.00 . A A . 2 GLN OE1 1 1 19 2764 1 1 3 DPR C C 37.532 33.945 10.791 1.00 . A A . 3 DPR C 1 1 19 2765 1 1 3 DPR CA C 38.169 35.000 11.680 1.00 . A A . 3 DPR CA 1 1 19 2766 1 1 3 DPR CB C 39.524 35.534 11.229 1.00 . A A . 3 DPR CB 1 1 19 2767 1 1 3 DPR CD C 37.927 37.363 11.548 1.00 . A A . 3 DPR CD 1 1 19 2768 1 1 3 DPR CG C 39.214 36.963 10.811 1.00 . A A . 3 DPR CG 1 1 19 2769 1 1 3 DPR HA H 38.357 34.497 12.630 1.00 . A A . 3 DPR HA 1 1 19 2770 1 1 3 DPR HB2 H 39.926 34.944 10.402 1.00 . A A . 3 DPR HB2 1 1 19 2771 1 1 3 DPR HB3 H 40.191 35.513 12.081 1.00 . A A . 3 DPR HB3 1 1 19 2772 1 1 3 DPR HD2 H 37.280 37.869 10.831 1.00 . A A . 3 DPR HD2 1 1 19 2773 1 1 3 DPR HD3 H 38.280 37.970 12.380 1.00 . A A . 3 DPR HD3 1 1 19 2774 1 1 3 DPR HG2 H 38.926 36.976 9.761 1.00 . A A . 3 DPR HG2 1 1 19 2775 1 1 3 DPR HG3 H 40.116 37.566 10.956 1.00 . A A . 3 DPR HG3 1 1 19 2776 1 1 3 DPR N N 37.314 36.129 11.982 1.00 . A A . 3 DPR N 1 1 19 2777 1 1 3 DPR O O 37.119 34.204 9.658 1.00 . A A . 3 DPR O 1 1 19 2778 1 1 4 . C C 37.891 30.488 11.096 1.00 . A A . 4 DCY C 1 1 19 2779 1 1 4 . CA C 36.897 31.552 10.663 1.00 . A A . 4 DCY CA 1 1 19 2780 1 1 4 . CB C 35.409 31.228 10.779 1.00 . A A . 4 DCY CB 1 1 19 2781 1 1 4 . H H 37.615 32.622 12.285 1.00 . A A . 4 DCY H 1 1 19 2782 1 1 4 . HA H 37.016 31.685 9.586 1.00 . A A . 4 DCY HA 1 1 19 2783 1 1 4 . HB2 H 35.065 30.702 9.886 1.00 . A A . 4 DCY HB2 1 1 19 2784 1 1 4 . HB3 H 34.898 32.187 10.737 1.00 . A A . 4 DCY HB3 1 1 19 2785 1 1 4 . N N 37.232 32.777 11.363 1.00 . A A . 4 DCY N 1 1 19 2786 1 1 4 . O O 38.325 30.555 12.246 1.00 . A A . 4 DCY O 1 1 19 2787 1 1 4 . SG S 34.974 30.222 12.218 1.00 . A A . 4 DCY SG 1 1 19 2788 1 1 5 . C C 38.489 27.690 11.898 1.00 . A A . 5 DLY C 1 1 19 2789 1 1 5 . CA C 39.132 28.402 10.720 1.00 . A A . 5 DLY CA 1 1 19 2790 1 1 5 . CB C 39.390 27.376 9.616 1.00 . A A . 5 DLY CB 1 1 19 2791 1 1 5 . CD C 40.566 26.759 7.454 1.00 . A A . 5 DLY CD 1 1 19 2792 1 1 5 . CE C 41.849 26.801 6.627 1.00 . A A . 5 DLY CE 1 1 19 2793 1 1 5 . CG C 40.489 27.737 8.630 1.00 . A A . 5 DLY CG 1 1 19 2794 1 1 5 . H H 37.903 29.528 9.361 1.00 . A A . 5 DLY H 1 1 19 2795 1 1 5 . HA H 40.023 28.823 11.176 1.00 . A A . 5 DLY HA 1 1 19 2796 1 1 5 . HB2 H 38.404 27.326 9.153 1.00 . A A . 5 DLY HB2 1 1 19 2797 1 1 5 . HB3 H 39.645 26.425 10.083 1.00 . A A . 5 DLY HB3 1 1 19 2798 1 1 5 . HD2 H 39.771 27.138 6.812 1.00 . A A . 5 DLY HD2 1 1 19 2799 1 1 5 . HD3 H 40.464 25.739 7.833 1.00 . A A . 5 DLY HD3 1 1 19 2800 1 1 5 . HE2 H 41.789 26.144 5.757 1.00 . A A . 5 DLY HE2 1 1 19 2801 1 1 5 . HE3 H 42.686 26.431 7.212 1.00 . A A . 5 DLY HE3 1 1 19 2802 1 1 5 . HG2 H 41.393 27.679 9.239 1.00 . A A . 5 DLY HG2 1 1 19 2803 1 1 5 . HG3 H 40.281 28.777 8.362 1.00 . A A . 5 DLY HG3 1 1 19 2804 1 1 5 . HZ1 H 42.641 28.695 6.911 1.00 . A A . 5 DLY HZ1 1 1 19 2805 1 1 5 . HZ2 H 41.227 28.684 5.946 1.00 . A A . 5 DLY HZ2 1 1 19 2806 1 1 5 . HZ3 H 42.681 28.135 5.441 1.00 . A A . 5 DLY HZ3 1 1 19 2807 1 1 5 . N N 38.275 29.496 10.301 1.00 . A A . 5 DLY N 1 1 19 2808 1 1 5 . NZ N 42.067 28.202 6.238 1.00 . A A . 5 DLY NZ 1 1 19 2809 1 1 5 . O O 37.438 27.059 11.788 1.00 . A A . 5 DLY O 1 1 19 2810 1 1 6 ASP C C 38.728 28.598 15.402 1.00 . A A . 6 ASP C 1 1 19 2811 1 1 6 ASP CA C 38.622 27.486 14.374 1.00 . A A . 6 ASP CA 1 1 19 2812 1 1 6 ASP CB C 39.434 26.272 14.829 1.00 . A A . 6 ASP CB 1 1 19 2813 1 1 6 ASP CG C 40.932 26.480 14.688 1.00 . A A . 6 ASP CG 1 1 19 2814 1 1 6 ASP H H 40.088 28.154 13.076 1.00 . A A . 6 ASP H 1 1 19 2815 1 1 6 ASP HA H 37.583 27.168 14.342 1.00 . A A . 6 ASP HA 1 1 19 2816 1 1 6 ASP HB2 H 39.249 26.058 15.885 1.00 . A A . 6 ASP HB2 1 1 19 2817 1 1 6 ASP HB3 H 39.131 25.401 14.253 1.00 . A A . 6 ASP HB3 1 1 19 2818 1 1 6 ASP N N 39.129 27.839 13.067 1.00 . A A . 6 ASP N 1 1 19 2819 1 1 6 ASP O O 38.561 28.332 16.594 1.00 . A A . 6 ASP O 1 1 19 2820 1 1 6 ASP OD1 O 41.617 27.491 14.446 1.00 . A A . 6 ASP OD1 1 1 19 2821 1 1 6 ASP OD2 O 41.592 25.415 14.696 1.00 . A A . 6 ASP OD2 1 1 19 2822 1 1 7 SER C C 39.126 32.189 15.505 1.00 . A A . 7 SER C 1 1 19 2823 1 1 7 SER CA C 39.667 30.816 15.864 1.00 . A A . 7 SER CA 1 1 19 2824 1 1 7 SER CB C 41.190 30.804 15.834 1.00 . A A . 7 SER CB 1 1 19 2825 1 1 7 SER H H 39.062 29.973 13.984 1.00 . A A . 7 SER H 1 1 19 2826 1 1 7 SER HA H 39.355 30.554 16.885 1.00 . A A . 7 SER HA 1 1 19 2827 1 1 7 SER HB2 H 41.572 31.196 14.891 1.00 . A A . 7 SER HB2 1 1 19 2828 1 1 7 SER HB3 H 41.547 31.451 16.635 1.00 . A A . 7 SER HB3 1 1 19 2829 1 1 7 SER HG H 41.815 28.975 15.350 1.00 . A A . 7 SER HG 1 1 19 2830 1 1 7 SER N N 39.121 29.805 14.982 1.00 . A A . 7 SER N 1 1 19 2831 1 1 7 SER O O 39.004 32.589 14.354 1.00 . A A . 7 SER O 1 1 19 2832 1 1 7 SER OG O 41.762 29.548 16.124 1.00 . A A . 7 SER OG 1 1 19 2833 1 1 8 . C C 36.216 33.354 16.667 1.00 . A A . 8 DTY C 1 1 19 2834 1 1 8 . CA C 37.632 33.880 16.487 1.00 . A A . 8 DTY CA 1 1 19 2835 1 1 8 . CB C 37.923 35.027 17.451 1.00 . A A . 8 DTY CB 1 1 19 2836 1 1 8 . CD1 C 38.702 36.686 15.792 1.00 . A A . 8 DTY CD1 1 1 19 2837 1 1 8 . CD2 C 36.746 37.263 17.125 1.00 . A A . 8 DTY CD2 1 1 19 2838 1 1 8 . CE1 C 38.766 38.022 15.368 1.00 . A A . 8 DTY CE1 1 1 19 2839 1 1 8 . CE2 C 36.749 38.568 16.629 1.00 . A A . 8 DTY CE2 1 1 19 2840 1 1 8 . CG C 37.752 36.365 16.775 1.00 . A A . 8 DTY CG 1 1 19 2841 1 1 8 . CZ C 37.782 38.963 15.749 1.00 . A A . 8 DTY CZ 1 1 19 2842 1 1 8 . H H 38.702 32.340 17.461 1.00 . A A . 8 DTY H 1 1 19 2843 1 1 8 . HA H 37.657 34.292 15.480 1.00 . A A . 8 DTY HA 1 1 19 2844 1 1 8 . HB2 H 38.966 34.968 17.769 1.00 . A A . 8 DTY HB2 1 1 19 2845 1 1 8 . HB3 H 37.367 34.891 18.375 1.00 . A A . 8 DTY HB3 1 1 19 2846 1 1 8 . HD1 H 39.403 35.957 15.417 1.00 . A A . 8 DTY HD1 1 1 19 2847 1 1 8 . HD2 H 35.988 36.996 17.838 1.00 . A A . 8 DTY HD2 1 1 19 2848 1 1 8 . HE1 H 39.533 38.336 14.691 1.00 . A A . 8 DTY HE1 1 1 19 2849 1 1 8 . HE2 H 35.977 39.261 16.943 1.00 . A A . 8 DTY HE2 1 1 19 2850 1 1 8 . HH H 36.933 40.597 15.289 1.00 . A A . 8 DTY HH 1 1 19 2851 1 1 8 . N N 38.608 32.812 16.568 1.00 . A A . 8 DTY N 1 1 19 2852 1 1 8 . O O 36.036 32.653 17.672 1.00 . A A . 8 DTY O 1 1 19 2853 1 1 8 . OH O 37.815 40.219 15.239 1.00 . A A . 8 DTY OH 1 1 19 2854 1 1 9 . C C 32.854 34.122 15.626 1.00 . A A . 9 DCY C 1 1 19 2855 1 1 9 . CA C 33.958 33.085 15.619 1.00 . A A . 9 DCY CA 1 1 19 2856 1 1 9 . CB C 33.968 32.268 14.318 1.00 . A A . 9 DCY CB 1 1 19 2857 1 1 9 . H H 35.619 34.239 15.023 1.00 . A A . 9 DCY H 1 1 19 2858 1 1 9 . HA H 33.765 32.345 16.401 1.00 . A A . 9 DCY HA 1 1 19 2859 1 1 9 . HB2 H 33.962 32.939 13.471 1.00 . A A . 9 DCY HB2 1 1 19 2860 1 1 9 . HB3 H 33.046 31.694 14.223 1.00 . A A . 9 DCY HB3 1 1 19 2861 1 1 9 . N N 35.277 33.653 15.772 1.00 . A A . 9 DCY N 1 1 19 2862 1 1 9 . O O 32.127 34.226 14.635 1.00 . A A . 9 DCY O 1 1 19 2863 1 1 9 . SG S 35.434 31.287 13.900 1.00 . A A . 9 DCY SG 1 1 19 2864 1 1 10 PRO C C 31.304 36.792 15.827 1.00 . A A . 10 PRO C 1 1 19 2865 1 1 10 PRO CA C 31.459 35.693 16.866 1.00 . A A . 10 PRO CA 1 1 19 2866 1 1 10 PRO CB C 31.671 36.394 18.202 1.00 . A A . 10 PRO CB 1 1 19 2867 1 1 10 PRO CD C 33.349 34.788 17.973 1.00 . A A . 10 PRO CD 1 1 19 2868 1 1 10 PRO CG C 32.416 35.364 19.040 1.00 . A A . 10 PRO CG 1 1 19 2869 1 1 10 PRO HA H 30.519 35.141 16.965 1.00 . A A . 10 PRO HA 1 1 19 2870 1 1 10 PRO HB2 H 32.162 37.364 18.122 1.00 . A A . 10 PRO HB2 1 1 19 2871 1 1 10 PRO HB3 H 30.727 36.696 18.645 1.00 . A A . 10 PRO HB3 1 1 19 2872 1 1 10 PRO HD2 H 34.314 35.286 17.931 1.00 . A A . 10 PRO HD2 1 1 19 2873 1 1 10 PRO HD3 H 33.554 33.747 18.254 1.00 . A A . 10 PRO HD3 1 1 19 2874 1 1 10 PRO HG2 H 33.133 35.745 19.764 1.00 . A A . 10 PRO HG2 1 1 19 2875 1 1 10 PRO HG3 H 31.692 34.659 19.453 1.00 . A A . 10 PRO HG3 1 1 19 2876 1 1 10 PRO N N 32.620 34.844 16.716 1.00 . A A . 10 PRO N 1 1 19 2877 1 1 10 PRO O O 32.291 37.430 15.485 1.00 . A A . 10 PRO O 1 1 19 2878 1 1 11 . C C 30.468 37.246 12.777 1.00 . A A . 11 DSN C 1 1 19 2879 1 1 11 . CA C 29.887 37.754 14.097 1.00 . A A . 11 DSN CA 1 1 19 2880 1 1 11 . CB C 28.417 38.154 14.012 1.00 . A A . 11 DSN CB 1 1 19 2881 1 1 11 . H H 29.323 36.402 15.649 1.00 . A A . 11 DSN H 1 1 19 2882 1 1 11 . HA H 30.457 38.673 14.222 1.00 . A A . 11 DSN HA 1 1 19 2883 1 1 11 . HB2 H 27.953 37.191 13.809 1.00 . A A . 11 DSN HB2 1 1 19 2884 1 1 11 . HB3 H 28.189 38.824 13.195 1.00 . A A . 11 DSN HB3 1 1 19 2885 1 1 11 . HG H 26.918 38.787 15.132 1.00 . A A . 11 DSN HG 1 1 19 2886 1 1 11 . N N 30.104 36.915 15.256 1.00 . A A . 11 DSN N 1 1 19 2887 1 1 11 . O O 30.311 37.904 11.755 1.00 . A A . 11 DSN O 1 1 19 2888 1 1 11 . OG O 27.878 38.735 15.182 1.00 . A A . 11 DSN OG 1 1 20 2889 1 1 1 DAL C C 33.180 37.044 11.408 1.00 . A A . 1 DAL C 1 1 20 2890 1 1 1 DAL CA C 31.656 36.955 11.374 1.00 . A A . 1 DAL CA 1 1 20 2891 1 1 1 DAL CB C 31.137 35.653 10.768 1.00 . A A . 1 DAL CB 1 1 20 2892 1 1 1 DAL H1 H 31.445 36.482 13.435 1.00 . A A . 1 DAL H1 1 1 20 2893 1 1 1 DAL HA H 31.309 37.748 10.717 1.00 . A A . 1 DAL HA 1 1 20 2894 1 1 1 DAL HB1 H 30.061 35.740 10.605 1.00 . A A . 1 DAL HB1 1 1 20 2895 1 1 1 DAL HB2 H 31.336 34.890 11.525 1.00 . A A . 1 DAL HB2 1 1 20 2896 1 1 1 DAL HB3 H 31.719 35.653 9.847 1.00 . A A . 1 DAL HB3 1 1 20 2897 1 1 1 DAL N N 31.120 37.108 12.704 1.00 . A A . 1 DAL N 1 1 20 2898 1 1 1 DAL O O 33.714 37.062 10.307 1.00 . A A . 1 DAL O 1 1 20 2899 1 1 2 GLN C C 35.936 36.068 12.345 1.00 . A A . 2 GLN C 1 1 20 2900 1 1 2 GLN CA C 35.251 37.400 12.620 1.00 . A A . 2 GLN CA 1 1 20 2901 1 1 2 GLN CB C 35.647 37.935 13.992 1.00 . A A . 2 GLN CB 1 1 20 2902 1 1 2 GLN CD C 35.771 40.184 15.401 1.00 . A A . 2 GLN CD 1 1 20 2903 1 1 2 GLN CG C 35.478 39.442 14.100 1.00 . A A . 2 GLN CG 1 1 20 2904 1 1 2 GLN H H 33.356 36.802 13.359 1.00 . A A . 2 GLN H 1 1 20 2905 1 1 2 GLN HA H 35.505 38.119 11.836 1.00 . A A . 2 GLN HA 1 1 20 2906 1 1 2 GLN HB2 H 35.069 37.402 14.753 1.00 . A A . 2 GLN HB2 1 1 20 2907 1 1 2 GLN HB3 H 36.653 37.571 14.231 1.00 . A A . 2 GLN HB3 1 1 20 2908 1 1 2 GLN HE21 H 34.701 41.809 14.842 1.00 . A A . 2 GLN HE21 1 1 20 2909 1 1 2 GLN HE22 H 35.569 42.054 16.295 1.00 . A A . 2 GLN HE22 1 1 20 2910 1 1 2 GLN HG2 H 36.191 39.933 13.446 1.00 . A A . 2 GLN HG2 1 1 20 2911 1 1 2 GLN HG3 H 34.505 39.666 13.656 1.00 . A A . 2 GLN HG3 1 1 20 2912 1 1 2 GLN N N 33.808 37.227 12.567 1.00 . A A . 2 GLN N 1 1 20 2913 1 1 2 GLN NE2 N 35.372 41.450 15.512 1.00 . A A . 2 GLN NE2 1 1 20 2914 1 1 2 GLN O O 35.378 35.084 12.830 1.00 . A A . 2 GLN O 1 1 20 2915 1 1 2 GLN OE1 O 36.356 39.704 16.370 1.00 . A A . 2 GLN OE1 1 1 20 2916 1 1 3 DPR C C 37.065 33.458 11.097 1.00 . A A . 3 DPR C 1 1 20 2917 1 1 3 DPR CA C 37.839 34.622 11.709 1.00 . A A . 3 DPR CA 1 1 20 2918 1 1 3 DPR CB C 39.192 34.883 11.061 1.00 . A A . 3 DPR CB 1 1 20 2919 1 1 3 DPR CD C 37.929 36.875 11.107 1.00 . A A . 3 DPR CD 1 1 20 2920 1 1 3 DPR CG C 39.374 36.390 11.264 1.00 . A A . 3 DPR CG 1 1 20 2921 1 1 3 DPR HA H 38.075 34.374 12.746 1.00 . A A . 3 DPR HA 1 1 20 2922 1 1 3 DPR HB2 H 39.085 34.680 9.999 1.00 . A A . 3 DPR HB2 1 1 20 2923 1 1 3 DPR HB3 H 40.003 34.292 11.470 1.00 . A A . 3 DPR HB3 1 1 20 2924 1 1 3 DPR HD2 H 37.643 36.971 10.061 1.00 . A A . 3 DPR HD2 1 1 20 2925 1 1 3 DPR HD3 H 37.832 37.832 11.607 1.00 . A A . 3 DPR HD3 1 1 20 2926 1 1 3 DPR HG2 H 40.061 36.818 10.538 1.00 . A A . 3 DPR HG2 1 1 20 2927 1 1 3 DPR HG3 H 39.805 36.526 12.255 1.00 . A A . 3 DPR HG3 1 1 20 2928 1 1 3 DPR N N 37.091 35.862 11.712 1.00 . A A . 3 DPR N 1 1 20 2929 1 1 3 DPR O O 36.468 33.634 10.033 1.00 . A A . 3 DPR O 1 1 20 2930 1 1 4 . C C 38.098 30.065 11.309 1.00 . A A . 4 DCY C 1 1 20 2931 1 1 4 . CA C 36.984 31.024 10.943 1.00 . A A . 4 DCY CA 1 1 20 2932 1 1 4 . CB C 35.585 30.452 11.175 1.00 . A A . 4 DCY CB 1 1 20 2933 1 1 4 . H H 37.682 32.134 12.535 1.00 . A A . 4 DCY H 1 1 20 2934 1 1 4 . HA H 37.128 31.248 9.890 1.00 . A A . 4 DCY HA 1 1 20 2935 1 1 4 . HB2 H 35.332 29.876 10.280 1.00 . A A . 4 DCY HB2 1 1 20 2936 1 1 4 . HB3 H 34.934 31.322 11.237 1.00 . A A . 4 DCY HB3 1 1 20 2937 1 1 4 . N N 37.156 32.262 11.681 1.00 . A A . 4 DCY N 1 1 20 2938 1 1 4 . O O 38.869 30.338 12.216 1.00 . A A . 4 DCY O 1 1 20 2939 1 1 4 . SG S 35.303 29.425 12.627 1.00 . A A . 4 DCY SG 1 1 20 2940 1 1 5 . C C 38.558 27.298 12.351 1.00 . A A . 5 DLY C 1 1 20 2941 1 1 5 . CA C 38.971 27.779 10.963 1.00 . A A . 5 DLY CA 1 1 20 2942 1 1 5 . CB C 38.912 26.772 9.825 1.00 . A A . 5 DLY CB 1 1 20 2943 1 1 5 . CD C 39.138 25.987 7.489 1.00 . A A . 5 DLY CD 1 1 20 2944 1 1 5 . CE C 40.065 26.018 6.281 1.00 . A A . 5 DLY CE 1 1 20 2945 1 1 5 . CG C 39.581 27.060 8.487 1.00 . A A . 5 DLY CG 1 1 20 2946 1 1 5 . H H 37.565 28.845 9.813 1.00 . A A . 5 DLY H 1 1 20 2947 1 1 5 . HA H 40.020 28.041 11.027 1.00 . A A . 5 DLY HA 1 1 20 2948 1 1 5 . HB2 H 37.882 26.435 9.669 1.00 . A A . 5 DLY HB2 1 1 20 2949 1 1 5 . HB3 H 39.485 25.897 10.130 1.00 . A A . 5 DLY HB3 1 1 20 2950 1 1 5 . HD2 H 38.168 26.252 7.075 1.00 . A A . 5 DLY HD2 1 1 20 2951 1 1 5 . HD3 H 39.107 25.008 7.980 1.00 . A A . 5 DLY HD3 1 1 20 2952 1 1 5 . HE2 H 39.873 25.139 5.660 1.00 . A A . 5 DLY HE2 1 1 20 2953 1 1 5 . HE3 H 41.131 26.049 6.526 1.00 . A A . 5 DLY HE3 1 1 20 2954 1 1 5 . HG2 H 40.638 26.955 8.733 1.00 . A A . 5 DLY HG2 1 1 20 2955 1 1 5 . HG3 H 39.280 28.060 8.178 1.00 . A A . 5 DLY HG3 1 1 20 2956 1 1 5 . HZ1 H 39.916 27.963 6.007 1.00 . A A . 5 DLY HZ1 1 1 20 2957 1 1 5 . HZ2 H 38.865 27.063 5.079 1.00 . A A . 5 DLY HZ2 1 1 20 2958 1 1 5 . HZ3 H 40.457 27.240 4.611 1.00 . A A . 5 DLY HZ3 1 1 20 2959 1 1 5 . N N 38.227 28.959 10.563 1.00 . A A . 5 DLY N 1 1 20 2960 1 1 5 . NZ N 39.822 27.165 5.400 1.00 . A A . 5 DLY NZ 1 1 20 2961 1 1 5 . O O 37.805 26.341 12.541 1.00 . A A . 5 DLY O 1 1 20 2962 1 1 6 ASP C C 39.173 28.850 15.575 1.00 . A A . 6 ASP C 1 1 20 2963 1 1 6 ASP CA C 39.200 27.578 14.739 1.00 . A A . 6 ASP CA 1 1 20 2964 1 1 6 ASP CB C 40.360 26.666 15.134 1.00 . A A . 6 ASP CB 1 1 20 2965 1 1 6 ASP CG C 41.767 27.074 14.726 1.00 . A A . 6 ASP CG 1 1 20 2966 1 1 6 ASP H H 39.939 28.581 13.075 1.00 . A A . 6 ASP H 1 1 20 2967 1 1 6 ASP HA H 38.251 27.098 14.972 1.00 . A A . 6 ASP HA 1 1 20 2968 1 1 6 ASP HB2 H 40.448 26.560 16.213 1.00 . A A . 6 ASP HB2 1 1 20 2969 1 1 6 ASP HB3 H 40.165 25.721 14.634 1.00 . A A . 6 ASP HB3 1 1 20 2970 1 1 6 ASP N N 39.272 27.874 13.325 1.00 . A A . 6 ASP N 1 1 20 2971 1 1 6 ASP O O 38.986 28.728 16.790 1.00 . A A . 6 ASP O 1 1 20 2972 1 1 6 ASP OD1 O 41.911 28.061 13.978 1.00 . A A . 6 ASP OD1 1 1 20 2973 1 1 6 ASP OD2 O 42.671 26.382 15.232 1.00 . A A . 6 ASP OD2 1 1 20 2974 1 1 7 SER C C 38.992 32.418 15.142 1.00 . A A . 7 SER C 1 1 20 2975 1 1 7 SER CA C 39.853 31.264 15.630 1.00 . A A . 7 SER CA 1 1 20 2976 1 1 7 SER CB C 41.359 31.487 15.643 1.00 . A A . 7 SER CB 1 1 20 2977 1 1 7 SER H H 39.482 30.070 13.994 1.00 . A A . 7 SER H 1 1 20 2978 1 1 7 SER HA H 39.763 31.199 16.715 1.00 . A A . 7 SER HA 1 1 20 2979 1 1 7 SER HB2 H 41.567 31.689 14.590 1.00 . A A . 7 SER HB2 1 1 20 2980 1 1 7 SER HB3 H 41.549 32.391 16.231 1.00 . A A . 7 SER HB3 1 1 20 2981 1 1 7 SER HG H 42.392 29.842 15.465 1.00 . A A . 7 SER HG 1 1 20 2982 1 1 7 SER N N 39.503 30.007 14.994 1.00 . A A . 7 SER N 1 1 20 2983 1 1 7 SER O O 38.829 32.580 13.933 1.00 . A A . 7 SER O 1 1 20 2984 1 1 7 SER OG O 42.100 30.416 16.175 1.00 . A A . 7 SER OG 1 1 20 2985 1 1 8 . C C 35.986 33.498 16.215 1.00 . A A . 8 DTY C 1 1 20 2986 1 1 8 . CA C 37.337 34.082 15.857 1.00 . A A . 8 DTY CA 1 1 20 2987 1 1 8 . CB C 37.559 35.420 16.547 1.00 . A A . 8 DTY CB 1 1 20 2988 1 1 8 . CD1 C 39.437 36.357 15.064 1.00 . A A . 8 DTY CD1 1 1 20 2989 1 1 8 . CD2 C 39.630 36.421 17.480 1.00 . A A . 8 DTY CD2 1 1 20 2990 1 1 8 . CE1 C 40.763 36.735 14.878 1.00 . A A . 8 DTY CE1 1 1 20 2991 1 1 8 . CE2 C 40.926 36.918 17.315 1.00 . A A . 8 DTY CE2 1 1 20 2992 1 1 8 . CG C 38.878 36.140 16.330 1.00 . A A . 8 DTY CG 1 1 20 2993 1 1 8 . CZ C 41.507 37.039 16.036 1.00 . A A . 8 DTY CZ 1 1 20 2994 1 1 8 . H H 38.497 32.819 17.024 1.00 . A A . 8 DTY H 1 1 20 2995 1 1 8 . HA H 37.278 34.221 14.771 1.00 . A A . 8 DTY HA 1 1 20 2996 1 1 8 . HB2 H 37.398 35.314 17.622 1.00 . A A . 8 DTY HB2 1 1 20 2997 1 1 8 . HB3 H 36.801 36.105 16.173 1.00 . A A . 8 DTY HB3 1 1 20 2998 1 1 8 . HD1 H 38.886 36.093 14.168 1.00 . A A . 8 DTY HD1 1 1 20 2999 1 1 8 . HD2 H 39.177 36.355 18.452 1.00 . A A . 8 DTY HD2 1 1 20 3000 1 1 8 . HE1 H 41.207 36.991 13.932 1.00 . A A . 8 DTY HE1 1 1 20 3001 1 1 8 . HE2 H 41.508 37.188 18.191 1.00 . A A . 8 DTY HE2 1 1 20 3002 1 1 8 . HH H 43.266 37.646 16.617 1.00 . A A . 8 DTY HH 1 1 20 3003 1 1 8 . N N 38.441 33.180 16.090 1.00 . A A . 8 DTY N 1 1 20 3004 1 1 8 . O O 35.823 33.024 17.335 1.00 . A A . 8 DTY O 1 1 20 3005 1 1 8 . OH O 42.768 37.512 15.810 1.00 . A A . 8 DTY OH 1 1 20 3006 1 1 9 . C C 32.496 33.234 15.358 1.00 . A A . 9 DCY C 1 1 20 3007 1 1 9 . CA C 33.868 32.559 15.314 1.00 . A A . 9 DCY CA 1 1 20 3008 1 1 9 . CB C 34.040 31.712 14.055 1.00 . A A . 9 DCY CB 1 1 20 3009 1 1 9 . H H 35.154 33.922 14.426 1.00 . A A . 9 DCY H 1 1 20 3010 1 1 9 . HA H 33.904 31.883 16.171 1.00 . A A . 9 DCY HA 1 1 20 3011 1 1 9 . HB2 H 33.806 32.204 13.120 1.00 . A A . 9 DCY HB2 1 1 20 3012 1 1 9 . HB3 H 33.228 30.992 14.005 1.00 . A A . 9 DCY HB3 1 1 20 3013 1 1 9 . N N 35.003 33.452 15.301 1.00 . A A . 9 DCY N 1 1 20 3014 1 1 9 . O O 31.883 33.446 14.317 1.00 . A A . 9 DCY O 1 1 20 3015 1 1 9 . SG S 35.633 30.838 14.051 1.00 . A A . 9 DCY SG 1 1 20 3016 1 1 10 PRO C C 31.371 36.175 15.649 1.00 . A A . 10 PRO C 1 1 20 3017 1 1 10 PRO CA C 31.191 34.962 16.547 1.00 . A A . 10 PRO CA 1 1 20 3018 1 1 10 PRO CB C 31.195 35.400 18.010 1.00 . A A . 10 PRO CB 1 1 20 3019 1 1 10 PRO CD C 32.817 33.700 17.753 1.00 . A A . 10 PRO CD 1 1 20 3020 1 1 10 PRO CG C 31.745 34.174 18.731 1.00 . A A . 10 PRO CG 1 1 20 3021 1 1 10 PRO HA H 30.181 34.615 16.294 1.00 . A A . 10 PRO HA 1 1 20 3022 1 1 10 PRO HB2 H 31.801 36.278 18.216 1.00 . A A . 10 PRO HB2 1 1 20 3023 1 1 10 PRO HB3 H 30.192 35.550 18.412 1.00 . A A . 10 PRO HB3 1 1 20 3024 1 1 10 PRO HD2 H 33.705 34.325 17.815 1.00 . A A . 10 PRO HD2 1 1 20 3025 1 1 10 PRO HD3 H 33.008 32.646 17.973 1.00 . A A . 10 PRO HD3 1 1 20 3026 1 1 10 PRO HG2 H 32.172 34.427 19.700 1.00 . A A . 10 PRO HG2 1 1 20 3027 1 1 10 PRO HG3 H 30.960 33.412 18.802 1.00 . A A . 10 PRO HG3 1 1 20 3028 1 1 10 PRO N N 32.165 33.897 16.468 1.00 . A A . 10 PRO N 1 1 20 3029 1 1 10 PRO O O 32.438 36.657 15.273 1.00 . A A . 10 PRO O 1 1 20 3030 1 1 11 . C C 30.245 37.989 13.204 1.00 . A A . 11 DSN C 1 1 20 3031 1 1 11 . CA C 30.020 38.055 14.705 1.00 . A A . 11 DSN CA 1 1 20 3032 1 1 11 . CB C 28.670 38.707 15.009 1.00 . A A . 11 DSN CB 1 1 20 3033 1 1 11 . H H 29.393 36.458 15.879 1.00 . A A . 11 DSN H 1 1 20 3034 1 1 11 . HA H 30.728 38.767 15.101 1.00 . A A . 11 DSN HA 1 1 20 3035 1 1 11 . HB2 H 27.952 38.000 14.587 1.00 . A A . 11 DSN HB2 1 1 20 3036 1 1 11 . HB3 H 28.715 39.650 14.466 1.00 . A A . 11 DSN HB3 1 1 20 3037 1 1 11 . HG H 27.541 39.194 16.465 1.00 . A A . 11 DSN HG 1 1 20 3038 1 1 11 . N N 30.220 36.809 15.429 1.00 . A A . 11 DSN N 1 1 20 3039 1 1 11 . O O 29.644 38.704 12.412 1.00 . A A . 11 DSN O 1 1 20 3040 1 1 11 . OG O 28.457 38.924 16.379 1.00 . A A . 11 DSN OG 1 1 stop_ save_
Contact the webmaster for help, if required. Thursday, June 13, 2024 6:02:49 AM GMT (wattos1)