Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
611105 | 5twi RC | 30202 | cing | 4-filtered-FRED | STAR | entry | full | 7 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5twi
# This FRED archive file contains, for PDB entry <5twi>:
#
# - 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_5twi
_Assembly.Sf_category assembly
_Assembly.Entry_ID 1
_Assembly.ID 1
_Assembly.Name 5twi
_Assembly.Number_of_components 1
_Assembly.Organic_ligands .
_Assembly.Metal_ions .
_Assembly.Paramagnetic .
_Assembly.Thiol_state "not present"
_Assembly.Molecular_mass 440.50
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 $Cyclic_tetrapeptide_ALA_ARG_ALA_UN1 A . 1 1
stop_
loop_
_PDBX_nonpoly_scheme.Entity_assembly_ID
_PDBX_nonpoly_scheme.Entity_ID
_PDBX_nonpoly_scheme.Mon_ID
_PDBX_nonpoly_scheme.Comp_index_ID
_PDBX_nonpoly_scheme.Comp_ID
_PDBX_nonpoly_scheme.Entry_ID
_PDBX_nonpoly_scheme.Assembly_ID
1 1 ALA 1 ALA 1 1
1 1 ARG 2 ARG 1 1
1 1 ALA 3 ALA 1 1
1 1 UN1 4 UN1 1 1
1 1 NH2 5 NH2 1 1
stop_
save_
save_Cyclic_tetrapeptide_ALA_ARG_ALA_UN1
_Entity.Sf_category entity
_Entity.Entry_ID 1
_Entity.ID 1
_Entity.Name "Cyclic tetrapeptide ALA ARG ALA UN1"
_Entity.Type non-polymer
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 ALA . 1 1
2 ARG . 1 1
3 ALA . 1 1
4 UN1 $UN1 1 1
5 NH2 $NH2 1 1
stop_
save_
save_UN1
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID UN1
_Chem_comp.Type non-polymer
save_
save_NH2
_Chem_comp.Sf_category chem_comp
_Chem_comp.Entry_ID 1
_Chem_comp.ID NH2
_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
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 1 ALA HA . 1 . HA 1 1
1 1 2 1 1 2 ARG H . 2 . HN 1 1
2 1 1 1 1 1 ALA HA . 1 . HA 1 1
2 1 2 1 1 3 ALA H . 3 . HN 1 1
3 1 1 1 1 1 ALA MB . 1 . HB* 1 1
3 1 2 1 1 2 ARG H . 2 . HN 1 1
4 1 1 1 1 1 ALA MB . 1 . HB* 1 1
4 1 2 1 1 3 ALA H . 3 . HN 1 1
5 1 1 1 1 2 ARG H . 2 . HN 1 1
5 1 2 1 1 3 ALA H . 3 . HN 1 1
6 1 1 1 1 2 ARG HA . 2 . HA 1 1
6 1 2 1 1 3 ALA H . 3 . HN 1 1
7 1 1 1 1 2 ARG QB . 2 . HB* 1 1
7 1 2 1 1 3 ALA H . 3 . HN 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 . . . . . 0.0 0.0 3.5 1 1
2 1 . . . . . 0.0 0.0 6.0 1 1
3 1 . . . . . 0.0 0.0 4.2 1 1
4 1 . . . . . 0.0 0.0 6.0 1 1
5 1 . . . . . 0.0 0.0 3.5 1 1
6 1 . . . . . 0.0 0.0 6.0 1 1
7 1 . . . . . 0.0 0.0 6.0 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 ALA C C -24.988 -52.300 -37.129 1.00 . A A . 1 ALA C 1 1
1 2 1 1 1 ALA CA C -25.071 -51.257 -38.252 1.00 . A A . 1 ALA CA 1 1
1 3 1 1 1 ALA CB C -24.452 -51.783 -39.543 1.00 . A A . 1 ALA CB 1 1
1 4 1 1 1 ALA HA H -26.114 -51.049 -38.447 1.00 . A A . 1 ALA HA 1 1
1 5 1 1 1 ALA HB1 H -24.796 -51.188 -40.375 1.00 . A A . 1 ALA HB1 1 1
1 6 1 1 1 ALA HB2 H -24.747 -52.812 -39.691 1.00 . A A . 1 ALA HB2 1 1
1 7 1 1 1 ALA HB3 H -23.376 -51.723 -39.477 1.00 . A A . 1 ALA HB3 1 1
1 8 1 1 1 ALA N N -24.438 -49.996 -37.861 1.00 . A A . 1 ALA N 1 1
1 9 1 1 1 ALA O O -25.834 -52.319 -36.228 1.00 . A A . 1 ALA O 1 1
1 10 1 1 2 ARG C C -23.357 -53.600 -34.836 1.00 . A A . 2 ARG C 1 1
1 11 1 1 2 ARG CA C -23.794 -54.204 -36.172 1.00 . A A . 2 ARG CA 1 1
1 12 1 1 2 ARG CB C -22.779 -55.266 -36.635 1.00 . A A . 2 ARG CB 1 1
1 13 1 1 2 ARG CD C -21.006 -53.787 -37.696 1.00 . A A . 2 ARG CD 1 1
1 14 1 1 2 ARG CG C -21.317 -54.820 -36.619 1.00 . A A . 2 ARG CG 1 1
1 15 1 1 2 ARG CZ C -20.651 -55.267 -39.653 1.00 . A A . 2 ARG CZ 1 1
1 16 1 1 2 ARG H H -23.338 -53.108 -37.924 1.00 . A A . 2 ARG H 1 1
1 17 1 1 2 ARG HA H -24.752 -54.683 -36.029 1.00 . A A . 2 ARG HA 1 1
1 18 1 1 2 ARG HB2 H -22.869 -56.129 -35.992 1.00 . A A . 2 ARG HB2 1 1
1 19 1 1 2 ARG HB3 H -23.028 -55.561 -37.644 1.00 . A A . 2 ARG HB3 1 1
1 20 1 1 2 ARG HD2 H -21.588 -52.899 -37.506 1.00 . A A . 2 ARG HD2 1 1
1 21 1 1 2 ARG HD3 H -19.956 -53.541 -37.644 1.00 . A A . 2 ARG HD3 1 1
1 22 1 1 2 ARG HE H -22.056 -53.850 -39.517 1.00 . A A . 2 ARG HE 1 1
1 23 1 1 2 ARG HG2 H -21.095 -54.389 -35.654 1.00 . A A . 2 ARG HG2 1 1
1 24 1 1 2 ARG HG3 H -20.690 -55.686 -36.774 1.00 . A A . 2 ARG HG3 1 1
1 25 1 1 2 ARG HH11 H -19.313 -55.560 -38.159 1.00 . A A . 2 ARG HH11 1 1
1 26 1 1 2 ARG HH12 H -19.128 -56.597 -39.532 1.00 . A A . 2 ARG HH12 1 1
1 27 1 1 2 ARG HH21 H -21.799 -55.218 -41.320 1.00 . A A . 2 ARG HH21 1 1
1 28 1 1 2 ARG HH22 H -20.536 -56.402 -41.326 1.00 . A A . 2 ARG HH22 1 1
1 29 1 1 2 ARG N N -23.974 -53.167 -37.186 1.00 . A A . 2 ARG N 1 1
1 30 1 1 2 ARG NE N -21.311 -54.276 -39.043 1.00 . A A . 2 ARG NE 1 1
1 31 1 1 2 ARG NH1 N -19.612 -55.855 -39.065 1.00 . A A . 2 ARG NH1 1 1
1 32 1 1 2 ARG NH2 N -21.026 -55.661 -40.866 1.00 . A A . 2 ARG NH2 1 1
1 33 1 1 2 ARG O O -23.780 -54.060 -33.774 1.00 . A A . 2 ARG O 1 1
1 34 1 1 3 ALA C C -23.044 -51.014 -33.049 1.00 . A A . 3 ALA C 1 1
1 35 1 1 3 ALA CA C -22.001 -51.920 -33.688 1.00 . A A . 3 ALA CA 1 1
1 36 1 1 3 ALA CB C -20.726 -51.144 -33.988 1.00 . A A . 3 ALA CB 1 1
1 37 1 1 3 ALA H H -22.195 -52.257 -35.769 1.00 . A A . 3 ALA H 1 1
1 38 1 1 3 ALA HA H -21.763 -52.696 -32.983 1.00 . A A . 3 ALA HA 1 1
1 39 1 1 3 ALA HB1 H -20.001 -51.804 -34.440 1.00 . A A . 3 ALA HB1 1 1
1 40 1 1 3 ALA HB2 H -20.325 -50.742 -33.070 1.00 . A A . 3 ALA HB2 1 1
1 41 1 1 3 ALA HB3 H -20.949 -50.335 -34.668 1.00 . A A . 3 ALA HB3 1 1
1 42 1 1 3 ALA N N -22.501 -52.575 -34.895 1.00 . A A . 3 ALA N 1 1
1 43 1 1 3 ALA O O -23.177 -50.989 -31.824 1.00 . A A . 3 ALA O 1 1
1 44 1 1 4 UN1 C1 C -24.152 -47.988 -36.518 1.00 . A A . 4 UN1 C1 1 1
1 45 1 1 4 UN1 C1' C -24.874 -49.292 -36.816 1.00 . A A . 4 UN1 C1' 1 1
1 46 1 1 4 UN1 C3 C -26.198 -50.136 -33.532 1.00 . A A . 4 UN1 C3 1 1
1 47 1 1 4 UN1 C4 C -24.855 -49.431 -33.363 1.00 . A A . 4 UN1 C4 1 1
1 48 1 1 4 UN1 C5 C -24.853 -48.064 -34.081 1.00 . A A . 4 UN1 C5 1 1
1 49 1 1 4 UN1 C6 C -23.699 -47.859 -35.066 1.00 . A A . 4 UN1 C6 1 1
1 50 1 1 4 UN1 H1C1 H -23.282 -47.923 -37.156 1.00 . A A . 4 UN1 H1C1 1 1
1 51 1 1 4 UN1 H1C2 H -24.819 -47.170 -36.744 1.00 . A A . 4 UN1 H1C2 1 1
1 52 1 1 4 UN1 H4 H -24.675 -49.277 -32.309 1.00 . A A . 4 UN1 H4 1 1
1 53 1 1 4 UN1 H4N1 H -23.688 -50.382 -34.842 1.00 . A A . 4 UN1 H4N1 1 1
1 54 1 1 4 UN1 H5C1 H -24.797 -47.285 -33.334 1.00 . A A . 4 UN1 H5C1 1 1
1 55 1 1 4 UN1 H5C2 H -25.779 -47.956 -34.624 1.00 . A A . 4 UN1 H5C2 1 1
1 56 1 1 4 UN1 H6C1 H -22.933 -48.593 -34.871 1.00 . A A . 4 UN1 H6C1 1 1
1 57 1 1 4 UN1 H6C2 H -23.291 -46.870 -34.919 1.00 . A A . 4 UN1 H6C2 1 1
1 58 1 1 4 UN1 N4 N -23.806 -50.298 -33.872 1.00 . A A . 4 UN1 N4 1 1
1 59 1 1 4 UN1 O1' O -25.823 -49.651 -36.129 1.00 . A A . 4 UN1 O1' 1 1
1 60 1 1 4 UN1 O58 O -27.256 -49.506 -33.498 1.00 . A A . 4 UN1 O58 1 1
1 61 1 1 5 NH2 HN1 H -25.268 -51.886 -33.790 1.00 . A A . 5 NH2 HN1 1 1
1 62 1 1 5 NH2 HN2 H -26.962 -51.918 -33.977 1.00 . A A . 5 NH2 HN2 1 1
1 63 1 1 5 NH2 N N -26.141 -51.449 -33.784 1.00 . A A . 5 NH2 N 1 1
2 64 1 1 1 ALA C C -25.015 -52.102 -37.128 1.00 . A A . 1 ALA C 1 1
2 65 1 1 1 ALA CA C -25.101 -51.005 -38.196 1.00 . A A . 1 ALA CA 1 1
2 66 1 1 1 ALA CB C -24.467 -51.461 -39.505 1.00 . A A . 1 ALA CB 1 1
2 67 1 1 1 ALA HA H -26.144 -50.800 -38.389 1.00 . A A . 1 ALA HA 1 1
2 68 1 1 1 ALA HB1 H -24.732 -52.491 -39.695 1.00 . A A . 1 ALA HB1 1 1
2 69 1 1 1 ALA HB2 H -23.393 -51.373 -39.436 1.00 . A A . 1 ALA HB2 1 1
2 70 1 1 1 ALA HB3 H -24.827 -50.842 -40.314 1.00 . A A . 1 ALA HB3 1 1
2 71 1 1 1 ALA N N -24.486 -49.756 -37.739 1.00 . A A . 1 ALA N 1 1
2 72 1 1 1 ALA O O -25.905 -52.222 -36.278 1.00 . A A . 1 ALA O 1 1
2 73 1 1 2 ARG C C -23.346 -53.434 -34.841 1.00 . A A . 2 ARG C 1 1
2 74 1 1 2 ARG CA C -23.751 -53.981 -36.210 1.00 . A A . 2 ARG CA 1 1
2 75 1 1 2 ARG CB C -22.698 -54.976 -36.717 1.00 . A A . 2 ARG CB 1 1
2 76 1 1 2 ARG CD C -20.331 -55.396 -37.459 1.00 . A A . 2 ARG CD 1 1
2 77 1 1 2 ARG CG C -21.323 -54.363 -36.946 1.00 . A A . 2 ARG CG 1 1
2 78 1 1 2 ARG CZ C -17.954 -55.516 -38.130 1.00 . A A . 2 ARG CZ 1 1
2 79 1 1 2 ARG H H -23.271 -52.757 -37.870 1.00 . A A . 2 ARG H 1 1
2 80 1 1 2 ARG HA H -24.694 -54.498 -36.107 1.00 . A A . 2 ARG HA 1 1
2 81 1 1 2 ARG HB2 H -22.595 -55.771 -35.993 1.00 . A A . 2 ARG HB2 1 1
2 82 1 1 2 ARG HB3 H -23.040 -55.397 -37.651 1.00 . A A . 2 ARG HB3 1 1
2 83 1 1 2 ARG HD2 H -20.250 -56.190 -36.731 1.00 . A A . 2 ARG HD2 1 1
2 84 1 1 2 ARG HD3 H -20.700 -55.799 -38.391 1.00 . A A . 2 ARG HD3 1 1
2 85 1 1 2 ARG HE H -18.886 -53.868 -37.488 1.00 . A A . 2 ARG HE 1 1
2 86 1 1 2 ARG HG2 H -21.409 -53.570 -37.674 1.00 . A A . 2 ARG HG2 1 1
2 87 1 1 2 ARG HG3 H -20.959 -53.960 -36.013 1.00 . A A . 2 ARG HG3 1 1
2 88 1 1 2 ARG HH11 H -18.945 -57.278 -38.279 1.00 . A A . 2 ARG HH11 1 1
2 89 1 1 2 ARG HH12 H -17.277 -57.325 -38.741 1.00 . A A . 2 ARG HH12 1 1
2 90 1 1 2 ARG HH21 H -16.690 -53.936 -38.099 1.00 . A A . 2 ARG HH21 1 1
2 91 1 1 2 ARG HH22 H -15.997 -55.428 -38.639 1.00 . A A . 2 ARG HH22 1 1
2 92 1 1 2 ARG N N -23.945 -52.900 -37.174 1.00 . A A . 2 ARG N 1 1
2 93 1 1 2 ARG NE N -19.003 -54.822 -37.682 1.00 . A A . 2 ARG NE 1 1
2 94 1 1 2 ARG NH1 N -18.069 -56.813 -38.406 1.00 . A A . 2 ARG NH1 1 1
2 95 1 1 2 ARG NH2 N -16.784 -54.910 -38.304 1.00 . A A . 2 ARG NH2 1 1
2 96 1 1 2 ARG O O -23.807 -53.926 -33.810 1.00 . A A . 2 ARG O 1 1
2 97 1 1 3 ALA C C -23.073 -50.962 -32.931 1.00 . A A . 3 ALA C 1 1
2 98 1 1 3 ALA CA C -22.003 -51.817 -33.596 1.00 . A A . 3 ALA CA 1 1
2 99 1 1 3 ALA CB C -20.740 -51.004 -33.839 1.00 . A A . 3 ALA CB 1 1
2 100 1 1 3 ALA H H -22.140 -52.076 -35.693 1.00 . A A . 3 ALA H 1 1
2 101 1 1 3 ALA HA H -21.762 -52.621 -32.925 1.00 . A A . 3 ALA HA 1 1
2 102 1 1 3 ALA HB1 H -19.988 -51.633 -34.292 1.00 . A A . 3 ALA HB1 1 1
2 103 1 1 3 ALA HB2 H -20.370 -50.622 -32.899 1.00 . A A . 3 ALA HB2 1 1
2 104 1 1 3 ALA HB3 H -20.964 -50.179 -34.500 1.00 . A A . 3 ALA HB3 1 1
2 105 1 1 3 ALA N N -22.476 -52.421 -34.839 1.00 . A A . 3 ALA N 1 1
2 106 1 1 3 ALA O O -23.220 -50.992 -31.708 1.00 . A A . 3 ALA O 1 1
2 107 1 1 4 UN1 C1 C -24.222 -47.819 -36.290 1.00 . A A . 4 UN1 C1 1 1
2 108 1 1 4 UN1 C1' C -24.923 -49.120 -36.653 1.00 . A A . 4 UN1 C1' 1 1
2 109 1 1 4 UN1 C3 C -26.243 -50.139 -33.415 1.00 . A A . 4 UN1 C3 1 1
2 110 1 1 4 UN1 C4 C -24.917 -49.410 -33.202 1.00 . A A . 4 UN1 C4 1 1
2 111 1 1 4 UN1 C5 C -24.939 -48.015 -33.864 1.00 . A A . 4 UN1 C5 1 1
2 112 1 1 4 UN1 C6 C -23.782 -47.748 -34.830 1.00 . A A . 4 UN1 C6 1 1
2 113 1 1 4 UN1 H1C1 H -23.349 -47.713 -36.917 1.00 . A A . 4 UN1 H1C1 1 1
2 114 1 1 4 UN1 H1C2 H -24.900 -47.003 -36.485 1.00 . A A . 4 UN1 H1C2 1 1
2 115 1 1 4 UN1 H4 H -24.753 -49.295 -32.140 1.00 . A A . 4 UN1 H4 1 1
2 116 1 1 4 UN1 H4N1 H -23.713 -50.271 -34.704 1.00 . A A . 4 UN1 H4N1 1 1
2 117 1 1 4 UN1 H5C1 H -24.905 -47.266 -33.086 1.00 . A A . 4 UN1 H5C1 1 1
2 118 1 1 4 UN1 H5C2 H -25.863 -47.905 -34.410 1.00 . A A . 4 UN1 H5C2 1 1
2 119 1 1 4 UN1 H6C1 H -23.004 -48.478 -34.662 1.00 . A A . 4 UN1 H6C1 1 1
2 120 1 1 4 UN1 H6C2 H -23.391 -46.760 -34.636 1.00 . A A . 4 UN1 H6C2 1 1
2 121 1 1 4 UN1 N4 N -23.842 -50.230 -33.732 1.00 . A A . 4 UN1 N4 1 1
2 122 1 1 4 UN1 O1' O -25.859 -49.534 -35.979 1.00 . A A . 4 UN1 O1' 1 1
2 123 1 1 4 UN1 O58 O -27.317 -49.546 -33.313 1.00 . A A . 4 UN1 O58 1 1
2 124 1 1 5 NH2 HN1 H -25.268 -51.835 -33.831 1.00 . A A . 5 NH2 HN1 1 1
2 125 1 1 5 NH2 HN2 H -26.964 -51.903 -33.987 1.00 . A A . 5 NH2 HN2 1 1
2 126 1 1 5 NH2 N N -26.153 -51.426 -33.774 1.00 . A A . 5 NH2 N 1 1
3 127 1 1 1 ALA C C -25.172 -51.754 -37.413 1.00 . A A . 1 ALA C 1 1
3 128 1 1 1 ALA CA C -25.214 -50.480 -38.266 1.00 . A A . 1 ALA CA 1 1
3 129 1 1 1 ALA CB C -24.632 -50.730 -39.653 1.00 . A A . 1 ALA CB 1 1
3 130 1 1 1 ALA HA H -26.247 -50.188 -38.390 1.00 . A A . 1 ALA HA 1 1
3 131 1 1 1 ALA HB1 H -23.554 -50.708 -39.601 1.00 . A A . 1 ALA HB1 1 1
3 132 1 1 1 ALA HB2 H -24.975 -49.962 -40.331 1.00 . A A . 1 ALA HB2 1 1
3 133 1 1 1 ALA HB3 H -24.956 -51.696 -40.011 1.00 . A A . 1 ALA HB3 1 1
3 134 1 1 1 ALA N N -24.518 -49.369 -37.613 1.00 . A A . 1 ALA N 1 1
3 135 1 1 1 ALA O O -26.067 -51.990 -36.593 1.00 . A A . 1 ALA O 1 1
3 136 1 1 2 ARG C C -23.548 -53.533 -35.418 1.00 . A A . 2 ARG C 1 1
3 137 1 1 2 ARG CA C -23.981 -53.813 -36.857 1.00 . A A . 2 ARG CA 1 1
3 138 1 1 2 ARG CB C -22.962 -54.728 -37.545 1.00 . A A . 2 ARG CB 1 1
3 139 1 1 2 ARG CD C -21.765 -56.939 -37.583 1.00 . A A . 2 ARG CD 1 1
3 140 1 1 2 ARG CG C -22.782 -56.072 -36.856 1.00 . A A . 2 ARG CG 1 1
3 141 1 1 2 ARG CZ C -20.743 -59.180 -37.369 1.00 . A A . 2 ARG CZ 1 1
3 142 1 1 2 ARG H H -23.454 -52.329 -38.270 1.00 . A A . 2 ARG H 1 1
3 143 1 1 2 ARG HA H -24.941 -54.308 -36.840 1.00 . A A . 2 ARG HA 1 1
3 144 1 1 2 ARG HB2 H -23.287 -54.908 -38.559 1.00 . A A . 2 ARG HB2 1 1
3 145 1 1 2 ARG HB3 H -22.005 -54.228 -37.567 1.00 . A A . 2 ARG HB3 1 1
3 146 1 1 2 ARG HD2 H -22.107 -57.101 -38.594 1.00 . A A . 2 ARG HD2 1 1
3 147 1 1 2 ARG HD3 H -20.818 -56.418 -37.603 1.00 . A A . 2 ARG HD3 1 1
3 148 1 1 2 ARG HE H -22.106 -58.415 -36.123 1.00 . A A . 2 ARG HE 1 1
3 149 1 1 2 ARG HG2 H -22.440 -55.905 -35.846 1.00 . A A . 2 ARG HG2 1 1
3 150 1 1 2 ARG HG3 H -23.732 -56.586 -36.837 1.00 . A A . 2 ARG HG3 1 1
3 151 1 1 2 ARG HH11 H -20.079 -58.118 -38.963 1.00 . A A . 2 ARG HH11 1 1
3 152 1 1 2 ARG HH12 H -19.385 -59.693 -38.782 1.00 . A A . 2 ARG HH12 1 1
3 153 1 1 2 ARG HH21 H -21.188 -60.489 -35.890 1.00 . A A . 2 ARG HH21 1 1
3 154 1 1 2 ARG HH22 H -20.014 -61.040 -37.038 1.00 . A A . 2 ARG HH22 1 1
3 155 1 1 2 ARG N N -24.134 -52.570 -37.608 1.00 . A A . 2 ARG N 1 1
3 156 1 1 2 ARG NE N -21.579 -58.236 -36.931 1.00 . A A . 2 ARG NE 1 1
3 157 1 1 2 ARG NH1 N -20.009 -58.980 -38.462 1.00 . A A . 2 ARG NH1 1 1
3 158 1 1 2 ARG NH2 N -20.639 -60.331 -36.712 1.00 . A A . 2 ARG NH2 1 1
3 159 1 1 2 ARG O O -24.063 -54.143 -34.479 1.00 . A A . 2 ARG O 1 1
3 160 1 1 3 ALA C C -23.098 -51.484 -33.110 1.00 . A A . 3 ALA C 1 1
3 161 1 1 3 ALA CA C -22.081 -52.265 -33.932 1.00 . A A . 3 ALA CA 1 1
3 162 1 1 3 ALA CB C -20.775 -51.491 -34.048 1.00 . A A . 3 ALA CB 1 1
3 163 1 1 3 ALA H H -22.217 -52.171 -36.044 1.00 . A A . 3 ALA H 1 1
3 164 1 1 3 ALA HA H -21.880 -53.186 -33.416 1.00 . A A . 3 ALA HA 1 1
3 165 1 1 3 ALA HB1 H -20.385 -51.293 -33.060 1.00 . A A . 3 ALA HB1 1 1
3 166 1 1 3 ALA HB2 H -20.955 -50.555 -34.557 1.00 . A A . 3 ALA HB2 1 1
3 167 1 1 3 ALA HB3 H -20.060 -52.074 -34.608 1.00 . A A . 3 ALA HB3 1 1
3 168 1 1 3 ALA N N -22.592 -52.616 -35.254 1.00 . A A . 3 ALA N 1 1
3 169 1 1 3 ALA O O -23.236 -51.719 -31.909 1.00 . A A . 3 ALA O 1 1
3 170 1 1 4 UN1 C1 C -24.114 -47.742 -35.850 1.00 . A A . 4 UN1 C1 1 1
3 171 1 1 4 UN1 C1' C -24.896 -48.916 -36.418 1.00 . A A . 4 UN1 C1' 1 1
3 172 1 1 4 UN1 C3 C -26.222 -50.424 -33.385 1.00 . A A . 4 UN1 C3 1 1
3 173 1 1 4 UN1 C4 C -24.856 -49.814 -33.073 1.00 . A A . 4 UN1 C4 1 1
3 174 1 1 4 UN1 C5 C -24.806 -48.326 -33.480 1.00 . A A . 4 UN1 C5 1 1
3 175 1 1 4 UN1 C6 C -23.650 -47.955 -34.411 1.00 . A A . 4 UN1 C6 1 1
3 176 1 1 4 UN1 H1C1 H -23.245 -47.575 -36.470 1.00 . A A . 4 UN1 H1C1 1 1
3 177 1 1 4 UN1 H1C2 H -24.746 -46.867 -35.882 1.00 . A A . 4 UN1 H1C2 1 1
3 178 1 1 4 UN1 H4 H -24.676 -49.896 -32.010 1.00 . A A . 4 UN1 H4 1 1
3 179 1 1 4 UN1 H4N1 H -23.714 -50.460 -34.724 1.00 . A A . 4 UN1 H4N1 1 1
3 180 1 1 4 UN1 H5C1 H -24.719 -47.729 -32.584 1.00 . A A . 4 UN1 H5C1 1 1
3 181 1 1 4 UN1 H5C2 H -25.731 -48.071 -33.975 1.00 . A A . 4 UN1 H5C2 1 1
3 182 1 1 4 UN1 H6C1 H -22.914 -48.744 -34.394 1.00 . A A . 4 UN1 H6C1 1 1
3 183 1 1 4 UN1 H6C2 H -23.200 -47.040 -34.056 1.00 . A A . 4 UN1 H6C2 1 1
3 184 1 1 4 UN1 N4 N -23.832 -50.583 -33.758 1.00 . A A . 4 UN1 N4 1 1
3 185 1 1 4 UN1 O1' O -25.840 -49.394 -35.801 1.00 . A A . 4 UN1 O1' 1 1
3 186 1 1 4 UN1 O58 O -27.261 -49.807 -33.150 1.00 . A A . 4 UN1 O58 1 1
3 187 1 1 5 NH2 HN1 H -25.345 -52.062 -34.126 1.00 . A A . 5 NH2 HN1 1 1
3 188 1 1 5 NH2 HN2 H -27.045 -52.017 -34.249 1.00 . A A . 5 NH2 HN2 1 1
3 189 1 1 5 NH2 N N -26.207 -51.627 -33.974 1.00 . A A . 5 NH2 N 1 1
4 190 1 1 1 ALA C C -25.087 -51.967 -37.240 1.00 . A A . 1 ALA C 1 1
4 191 1 1 1 ALA CA C -25.336 -50.778 -38.173 1.00 . A A . 1 ALA CA 1 1
4 192 1 1 1 ALA CB C -24.778 -51.051 -39.566 1.00 . A A . 1 ALA CB 1 1
4 193 1 1 1 ALA HA H -26.402 -50.638 -38.267 1.00 . A A . 1 ALA HA 1 1
4 194 1 1 1 ALA HB1 H -23.711 -50.880 -39.567 1.00 . A A . 1 ALA HB1 1 1
4 195 1 1 1 ALA HB2 H -25.249 -50.388 -40.277 1.00 . A A . 1 ALA HB2 1 1
4 196 1 1 1 ALA HB3 H -24.978 -52.076 -39.841 1.00 . A A . 1 ALA HB3 1 1
4 197 1 1 1 ALA N N -24.776 -49.538 -37.632 1.00 . A A . 1 ALA N 1 1
4 198 1 1 1 ALA O O -25.937 -52.301 -36.407 1.00 . A A . 1 ALA O 1 1
4 199 1 1 2 ARG C C -23.176 -53.328 -35.148 1.00 . A A . 2 ARG C 1 1
4 200 1 1 2 ARG CA C -23.567 -53.754 -36.562 1.00 . A A . 2 ARG CA 1 1
4 201 1 1 2 ARG CB C -22.418 -54.525 -37.216 1.00 . A A . 2 ARG CB 1 1
4 202 1 1 2 ARG CD C -21.560 -55.577 -39.336 1.00 . A A . 2 ARG CD 1 1
4 203 1 1 2 ARG CG C -22.793 -55.155 -38.549 1.00 . A A . 2 ARG CG 1 1
4 204 1 1 2 ARG CZ C -21.191 -53.488 -40.618 1.00 . A A . 2 ARG CZ 1 1
4 205 1 1 2 ARG H H -23.293 -52.289 -38.065 1.00 . A A . 2 ARG H 1 1
4 206 1 1 2 ARG HA H -24.430 -54.400 -36.503 1.00 . A A . 2 ARG HA 1 1
4 207 1 1 2 ARG HB2 H -21.593 -53.847 -37.380 1.00 . A A . 2 ARG HB2 1 1
4 208 1 1 2 ARG HB3 H -22.100 -55.310 -36.547 1.00 . A A . 2 ARG HB3 1 1
4 209 1 1 2 ARG HD2 H -20.950 -56.211 -38.710 1.00 . A A . 2 ARG HD2 1 1
4 210 1 1 2 ARG HD3 H -21.876 -56.130 -40.209 1.00 . A A . 2 ARG HD3 1 1
4 211 1 1 2 ARG HE H -19.864 -54.336 -39.383 1.00 . A A . 2 ARG HE 1 1
4 212 1 1 2 ARG HG2 H -23.406 -56.025 -38.366 1.00 . A A . 2 ARG HG2 1 1
4 213 1 1 2 ARG HG3 H -23.352 -54.435 -39.129 1.00 . A A . 2 ARG HG3 1 1
4 214 1 1 2 ARG HH11 H -22.984 -54.362 -40.978 1.00 . A A . 2 ARG HH11 1 1
4 215 1 1 2 ARG HH12 H -22.703 -52.876 -41.818 1.00 . A A . 2 ARG HH12 1 1
4 216 1 1 2 ARG HH21 H -19.501 -52.380 -40.502 1.00 . A A . 2 ARG HH21 1 1
4 217 1 1 2 ARG HH22 H -20.727 -51.755 -41.554 1.00 . A A . 2 ARG HH22 1 1
4 218 1 1 2 ARG N N -23.926 -52.602 -37.385 1.00 . A A . 2 ARG N 1 1
4 219 1 1 2 ARG NE N -20.762 -54.425 -39.764 1.00 . A A . 2 ARG NE 1 1
4 220 1 1 2 ARG NH1 N -22.391 -53.585 -41.185 1.00 . A A . 2 ARG NH1 1 1
4 221 1 1 2 ARG NH2 N -20.408 -52.456 -40.915 1.00 . A A . 2 ARG NH2 1 1
4 222 1 1 2 ARG O O -23.595 -53.948 -34.169 1.00 . A A . 2 ARG O 1 1
4 223 1 1 3 ALA C C -23.017 -51.066 -32.989 1.00 . A A . 3 ALA C 1 1
4 224 1 1 3 ALA CA C -21.911 -51.776 -33.755 1.00 . A A . 3 ALA CA 1 1
4 225 1 1 3 ALA CB C -20.704 -50.865 -33.925 1.00 . A A . 3 ALA CB 1 1
4 226 1 1 3 ALA H H -22.061 -51.827 -35.867 1.00 . A A . 3 ALA H 1 1
4 227 1 1 3 ALA HA H -21.608 -52.630 -33.178 1.00 . A A . 3 ALA HA 1 1
4 228 1 1 3 ALA HB1 H -19.876 -51.434 -34.322 1.00 . A A . 3 ALA HB1 1 1
4 229 1 1 3 ALA HB2 H -20.428 -50.450 -32.966 1.00 . A A . 3 ALA HB2 1 1
4 230 1 1 3 ALA HB3 H -20.949 -50.064 -34.606 1.00 . A A . 3 ALA HB3 1 1
4 231 1 1 3 ALA N N -22.366 -52.275 -35.050 1.00 . A A . 3 ALA N 1 1
4 232 1 1 3 ALA O O -23.125 -51.221 -31.771 1.00 . A A . 3 ALA O 1 1
4 233 1 1 4 UN1 C1 C -24.553 -47.730 -36.023 1.00 . A A . 4 UN1 C1 1 1
4 234 1 1 4 UN1 C1' C -25.187 -49.038 -36.468 1.00 . A A . 4 UN1 C1' 1 1
4 235 1 1 4 UN1 C3 C -26.249 -50.421 -33.315 1.00 . A A . 4 UN1 C3 1 1
4 236 1 1 4 UN1 C4 C -24.966 -49.629 -33.064 1.00 . A A . 4 UN1 C4 1 1
4 237 1 1 4 UN1 C5 C -25.094 -48.180 -33.581 1.00 . A A . 4 UN1 C5 1 1
4 238 1 1 4 UN1 C6 C -24.021 -47.760 -34.592 1.00 . A A . 4 UN1 C6 1 1
4 239 1 1 4 UN1 H1C1 H -23.733 -47.502 -36.688 1.00 . A A . 4 UN1 H1C1 1 1
4 240 1 1 4 UN1 H1C2 H -25.297 -46.951 -36.097 1.00 . A A . 4 UN1 H1C2 1 1
4 241 1 1 4 UN1 H4 H -24.776 -49.608 -32.000 1.00 . A A . 4 UN1 H4 1 1
4 242 1 1 4 UN1 H4N1 H -23.757 -50.257 -34.672 1.00 . A A . 4 UN1 H4N1 1 1
4 243 1 1 4 UN1 H5C1 H -25.037 -47.509 -32.736 1.00 . A A . 4 UN1 H5C1 1 1
4 244 1 1 4 UN1 H5C2 H -26.058 -48.063 -34.050 1.00 . A A . 4 UN1 H5C2 1 1
4 245 1 1 4 UN1 H6C1 H -23.194 -48.452 -34.539 1.00 . A A . 4 UN1 H6C1 1 1
4 246 1 1 4 UN1 H6C2 H -23.674 -46.770 -34.334 1.00 . A A . 4 UN1 H6C2 1 1
4 247 1 1 4 UN1 N4 N -23.858 -50.318 -33.698 1.00 . A A . 4 UN1 N4 1 1
4 248 1 1 4 UN1 O1' O -26.050 -49.578 -35.788 1.00 . A A . 4 UN1 O1' 1 1
4 249 1 1 4 UN1 O58 O -27.354 -49.926 -33.094 1.00 . A A . 4 UN1 O58 1 1
4 250 1 1 5 NH2 HN1 H -25.186 -51.976 -33.983 1.00 . A A . 5 NH2 HN1 1 1
4 251 1 1 5 NH2 HN2 H -26.879 -52.150 -34.075 1.00 . A A . 5 NH2 HN2 1 1
4 252 1 1 5 NH2 N N -26.092 -51.644 -33.838 1.00 . A A . 5 NH2 N 1 1
5 253 1 1 1 ALA C C -24.711 -52.231 -37.337 1.00 . A A . 1 ALA C 1 1
5 254 1 1 1 ALA CA C -24.828 -51.084 -38.346 1.00 . A A . 1 ALA CA 1 1
5 255 1 1 1 ALA CB C -24.060 -51.400 -39.624 1.00 . A A . 1 ALA CB 1 1
5 256 1 1 1 ALA HA H -25.869 -50.966 -38.608 1.00 . A A . 1 ALA HA 1 1
5 257 1 1 1 ALA HB1 H -23.003 -51.248 -39.457 1.00 . A A . 1 ALA HB1 1 1
5 258 1 1 1 ALA HB2 H -24.396 -50.748 -40.417 1.00 . A A . 1 ALA HB2 1 1
5 259 1 1 1 ALA HB3 H -24.235 -52.428 -39.905 1.00 . A A . 1 ALA HB3 1 1
5 260 1 1 1 ALA N N -24.372 -49.813 -37.778 1.00 . A A . 1 ALA N 1 1
5 261 1 1 1 ALA O O -25.668 -52.530 -36.611 1.00 . A A . 1 ALA O 1 1
5 262 1 1 2 ARG C C -23.092 -53.477 -34.947 1.00 . A A . 2 ARG C 1 1
5 263 1 1 2 ARG CA C -23.303 -53.980 -36.373 1.00 . A A . 2 ARG CA 1 1
5 264 1 1 2 ARG CB C -22.091 -54.809 -36.819 1.00 . A A . 2 ARG CB 1 1
5 265 1 1 2 ARG CD C -22.549 -54.758 -39.306 1.00 . A A . 2 ARG CD 1 1
5 266 1 1 2 ARG CG C -22.327 -55.634 -38.080 1.00 . A A . 2 ARG CG 1 1
5 267 1 1 2 ARG CZ C -23.812 -56.318 -40.757 1.00 . A A . 2 ARG CZ 1 1
5 268 1 1 2 ARG H H -22.818 -52.584 -37.889 1.00 . A A . 2 ARG H 1 1
5 269 1 1 2 ARG HA H -24.180 -54.610 -36.388 1.00 . A A . 2 ARG HA 1 1
5 270 1 1 2 ARG HB2 H -21.264 -54.140 -37.005 1.00 . A A . 2 ARG HB2 1 1
5 271 1 1 2 ARG HB3 H -21.821 -55.484 -36.021 1.00 . A A . 2 ARG HB3 1 1
5 272 1 1 2 ARG HD2 H -23.424 -54.149 -39.144 1.00 . A A . 2 ARG HD2 1 1
5 273 1 1 2 ARG HD3 H -21.687 -54.120 -39.437 1.00 . A A . 2 ARG HD3 1 1
5 274 1 1 2 ARG HE H -22.035 -55.514 -41.198 1.00 . A A . 2 ARG HE 1 1
5 275 1 1 2 ARG HG2 H -21.464 -56.259 -38.252 1.00 . A A . 2 ARG HG2 1 1
5 276 1 1 2 ARG HG3 H -23.197 -56.256 -37.930 1.00 . A A . 2 ARG HG3 1 1
5 277 1 1 2 ARG HH11 H -24.779 -55.837 -39.041 1.00 . A A . 2 ARG HH11 1 1
5 278 1 1 2 ARG HH12 H -25.608 -56.955 -40.069 1.00 . A A . 2 ARG HH12 1 1
5 279 1 1 2 ARG HH21 H -23.139 -56.981 -42.547 1.00 . A A . 2 ARG HH21 1 1
5 280 1 1 2 ARG HH22 H -24.680 -57.603 -42.059 1.00 . A A . 2 ARG HH22 1 1
5 281 1 1 2 ARG N N -23.541 -52.869 -37.292 1.00 . A A . 2 ARG N 1 1
5 282 1 1 2 ARG NE N -22.744 -55.548 -40.522 1.00 . A A . 2 ARG NE 1 1
5 283 1 1 2 ARG NH1 N -24.815 -56.374 -39.883 1.00 . A A . 2 ARG NH1 1 1
5 284 1 1 2 ARG NH2 N -23.883 -57.026 -41.880 1.00 . A A . 2 ARG NH2 1 1
5 285 1 1 2 ARG O O -23.627 -54.048 -33.995 1.00 . A A . 2 ARG O 1 1
5 286 1 1 3 ALA C C -23.226 -51.132 -32.897 1.00 . A A . 3 ALA C 1 1
5 287 1 1 3 ALA CA C -22.015 -51.836 -33.494 1.00 . A A . 3 ALA CA 1 1
5 288 1 1 3 ALA CB C -20.826 -50.888 -33.570 1.00 . A A . 3 ALA CB 1 1
5 289 1 1 3 ALA H H -21.902 -52.002 -35.603 1.00 . A A . 3 ALA H 1 1
5 290 1 1 3 ALA HA H -21.755 -52.650 -32.843 1.00 . A A . 3 ALA HA 1 1
5 291 1 1 3 ALA HB1 H -19.972 -51.414 -33.971 1.00 . A A . 3 ALA HB1 1 1
5 292 1 1 3 ALA HB2 H -20.591 -50.524 -32.580 1.00 . A A . 3 ALA HB2 1 1
5 293 1 1 3 ALA HB3 H -21.070 -50.055 -34.212 1.00 . A A . 3 ALA HB3 1 1
5 294 1 1 3 ALA N N -22.303 -52.409 -34.806 1.00 . A A . 3 ALA N 1 1
5 295 1 1 3 ALA O O -23.477 -51.239 -31.695 1.00 . A A . 3 ALA O 1 1
5 296 1 1 4 UN1 C1 C -24.408 -47.950 -36.212 1.00 . A A . 4 UN1 C1 1 1
5 297 1 1 4 UN1 C1' C -24.947 -49.288 -36.697 1.00 . A A . 4 UN1 C1' 1 1
5 298 1 1 4 UN1 C3 C -26.413 -50.615 -33.650 1.00 . A A . 4 UN1 C3 1 1
5 299 1 1 4 UN1 C4 C -25.196 -49.769 -33.275 1.00 . A A . 4 UN1 C4 1 1
5 300 1 1 4 UN1 C5 C -25.303 -48.349 -33.870 1.00 . A A . 4 UN1 C5 1 1
5 301 1 1 4 UN1 C6 C -24.101 -47.918 -34.717 1.00 . A A . 4 UN1 C6 1 1
5 302 1 1 4 UN1 H1C1 H -23.499 -47.730 -36.753 1.00 . A A . 4 UN1 H1C1 1 1
5 303 1 1 4 UN1 H1C2 H -25.142 -47.190 -36.429 1.00 . A A . 4 UN1 H1C2 1 1
5 304 1 1 4 UN1 H4 H -25.143 -49.698 -32.198 1.00 . A A . 4 UN1 H4 1 1
5 305 1 1 4 UN1 H4N1 H -23.778 -50.422 -34.692 1.00 . A A . 4 UN1 H4N1 1 1
5 306 1 1 4 UN1 H5C1 H -25.409 -47.644 -33.058 1.00 . A A . 4 UN1 H5C1 1 1
5 307 1 1 4 UN1 H5C2 H -26.185 -48.297 -34.490 1.00 . A A . 4 UN1 H5C2 1 1
5 308 1 1 4 UN1 H6C1 H -23.271 -48.578 -34.514 1.00 . A A . 4 UN1 H6C1 1 1
5 309 1 1 4 UN1 H6C2 H -23.830 -46.910 -34.443 1.00 . A A . 4 UN1 H6C2 1 1
5 310 1 1 4 UN1 N4 N -23.996 -50.444 -33.736 1.00 . A A . 4 UN1 N4 1 1
5 311 1 1 4 UN1 O1' O -25.883 -49.829 -36.121 1.00 . A A . 4 UN1 O1' 1 1
5 312 1 1 4 UN1 O58 O -27.551 -50.145 -33.606 1.00 . A A . 4 UN1 O58 1 1
5 313 1 1 5 NH2 HN1 H -25.229 -52.167 -34.081 1.00 . A A . 5 NH2 HN1 1 1
5 314 1 1 5 NH2 HN2 H -26.889 -52.402 -34.387 1.00 . A A . 5 NH2 HN2 1 1
5 315 1 1 5 NH2 N N -26.155 -51.858 -34.077 1.00 . A A . 5 NH2 N 1 1
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